data_2mse_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2mse _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 76.7 mt . . . . . 0 C--O 1.222 -0.35 0 N-CA-C 110.031 -0.359 . . . . 10.0 110.031 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -66.27 -50.33 64.06 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -58.29 -45.3 88.21 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.444 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -63.87 -44.84 91.88 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.978 -1.01 . . . . 10.0 110.479 179.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -65.15 -27.48 68.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.908 179.336 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 24.8 m -63.03 -49.16 75.72 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 108.411 -0.959 . . . . 10.0 108.411 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -70.55 -42.42 71.17 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.142 -0.688 . . . . 10.0 109.142 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.29 -65.02 0.64 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.277 -0.874 . . . . 10.0 110.934 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 45.2 mt -58.5 -45.97 87.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.817 -0.629 . . . . 10.0 111.972 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -61.03 -48.25 82.62 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.947 0.351 . . . . 10.0 111.947 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -65.19 -40.83 94.75 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.116 -0.328 . . . . 10.0 110.116 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 24.8 t -63.51 -42.85 97.63 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.441 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.547 179.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -72.38 -43.43 63.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.829 0.347 . . . . 10.0 111.398 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.94 -34.73 78.1 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.321 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 45.4 mtpt -88.57 -25.49 22.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.398 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.84 -26.22 38.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.739 0.304 . . . . 10.0 110.548 179.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -60.93 9.04 Favored Pre-proline 0 CA--C 1.535 0.388 0 CA-C-N 116.188 -0.46 . . . . 10.0 109.809 178.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -65.39 -24.41 57.34 Favored 'Trans proline' 0 C--N 1.36 1.176 0 C-N-CA 121.725 1.617 . . . . 10.0 111.059 177.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -65.53 -52.97 48.6 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 177.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 83.8 mt -66.44 -41.21 89.48 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.556 -0.747 . . . . 10.0 110.007 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -60.18 -43.91 95.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.065 0.459 . . . . 10.0 110.391 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -65.55 -47.24 76.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.278 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -65.92 -45.94 80.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.782 -0.644 . . . . 10.0 111.646 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 23.1 tt0 -64.9 -34.71 79.05 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-O 120.497 0.189 . . . . 10.0 110.537 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 2.8 ttmp? -60.83 -49.57 76.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.507 0.67 . . . . 10.0 109.283 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 41.7 mttt -70.64 -35.11 72.74 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.342 -0.844 . . . . 10.0 110.199 179.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 9.2 t90 -62.44 -35.73 80.19 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.746 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -62.02 -46.05 90.88 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 108.827 -0.805 . . . . 10.0 108.827 178.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -62.74 -43.55 98.51 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -56.81 -48.9 76.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.68 179.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 81.3 mmm -71.64 -43.17 66.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.754 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -61.51 -49.94 74.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.902 -0.135 . . . . 10.0 111.113 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 86.8 mt -64.58 -36.27 83.68 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.867 -0.42 . . . . 10.0 109.867 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -61.67 -50.03 74.14 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.479 178.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 50.3 mtt85 -67.05 -36.03 81.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.706 0.288 . . . . 10.0 110.588 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -61.2 -45.34 94.99 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.797 -0.638 . . . . 10.0 109.923 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 63.1 mttt -80.52 -31.65 37.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.428 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 1.4 t -53.95 -37.64 34.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 O-C-N 123.123 0.264 . . . . 10.0 111.42 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -58.96 -63.37 4.23 Favored Pre-proline 0 CA--C 1.533 0.296 0 N-CA-C 112.332 0.493 . . . . 10.0 112.332 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -60.68 -35.69 88.3 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 122.11 1.873 . . . . 10.0 111.601 178.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 16.6 mt -65.19 -41.61 94.38 Favored 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 109.931 -0.396 . . . . 10.0 109.931 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 20.4 ttm180 -67.55 -35.07 78.34 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -65.82 -44.17 86.43 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.261 178.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -60.46 -45.08 95.01 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 108.953 -0.758 . . . . 10.0 108.953 178.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 84.3 mt -62.71 -47.14 84.89 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.459 -0.791 . . . . 10.0 109.884 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -62.98 -56.71 14.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.91 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -61.92 -43.97 97.74 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.884 0.374 . . . . 10.0 110.576 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -61.98 -47.2 91.6 Favored Glycine 0 N--CA 1.444 -0.819 0 N-CA-C 110.857 -0.897 . . . . 10.0 110.857 178.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.61 -34.5 78.41 Favored 'General case' 0 C--O 1.218 -0.595 0 N-CA-C 110.187 -0.301 . . . . 10.0 110.187 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -57.81 -44.92 86.7 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -68.83 -53.2 22.83 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.655 -0.498 . . . . 10.0 109.655 178.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 53.6 mttt -52.82 -49.74 65.07 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.668 -0.696 . . . . 10.0 111.515 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 84.1 mt -68.11 -45.48 73.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.487 -0.324 . . . . 10.0 111.355 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 43.8 t60 -59.84 -47.72 84.61 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.686 -0.234 . . . . 10.0 110.683 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -63.03 -35.27 79.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.689 179.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 36.6 mt -70.94 -38.6 72.87 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.066 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -63.57 -35.39 80.34 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 108.65 -0.87 . . . . 10.0 108.65 177.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -73.2 -7.44 51.45 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.081 -0.963 . . . . 10.0 110.349 178.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 2.6 mmpp? -100.87 -44.28 5.82 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.757 -0.831 . . . . 10.0 108.757 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 90.7 mt -60.82 -22.85 64.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.598 -0.728 . . . . 10.0 111.267 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 18.5 m -73.77 -67.09 0.45 Allowed Pre-proline 0 CA--C 1.542 0.642 0 C-N-CA 120.841 -0.344 . . . . 10.0 111.41 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.84 -44.59 7.61 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.04 1.827 . . . . 10.0 112.25 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 85.0 mt -69.89 -22.01 63.27 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.024 0.44 . . . . 10.0 110.007 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -77.99 -45.22 10.62 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 109.169 -1.573 . . . . 10.0 109.169 177.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -61.57 -41.95 98.13 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.6 -0.889 . . . . 10.0 108.6 177.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.07 -36.88 85.07 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.272 -0.876 . . . . 10.0 109.448 178.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 11.2 tpt -64.81 -46.13 83.31 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.511 -0.551 . . . . 10.0 109.511 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 27.8 mtt180 -63.52 -43.55 96.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.419 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -64.19 -40.04 95.26 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.253 -0.431 . . . . 10.0 110.348 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . 1.195 ' CD ' ' CD1' ' C' ' 469' ' ' LEU . 5.1 mmp_? -69.55 -36.72 76.62 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.912 -0.774 . . . . 10.0 108.912 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -65.39 -35.07 79.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.739 -0.664 . . . . 10.0 109.783 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -58.37 -55.22 37.86 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 109.026 -0.731 . . . . 10.0 109.026 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -62.28 -39.89 94.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.613 178.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.29 -54.45 45.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.738 179.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 57.7 t -73.75 -41.77 54.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.813 -0.63 . . . . 10.0 112.24 -178.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.1 -39.15 93.84 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.998 -0.281 . . . . 10.0 111.309 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -68.21 -28.73 67.5 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 108.569 -0.9 . . . . 10.0 108.569 177.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 16.5 mt -73.86 -37.17 64.84 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-N 115.428 -0.806 . . . . 10.0 108.889 178.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -61.58 -49.37 76.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.933 0.397 . . . . 10.0 110.163 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -69.18 -10.35 57.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.818 -0.628 . . . . 10.0 112.063 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 17.5 m80 -106.31 -50.49 3.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.652 -0.249 . . . . 10.0 111.372 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 82.8 mt -63.12 -38.57 91.71 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.539 0.57 . . . . 10.0 112.539 -179.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.19 -60.24 9.54 Favored Pre-proline 0 CA--C 1.534 0.345 0 C-N-CA 121.206 -0.198 . . . . 10.0 111.292 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -66.43 -32.73 39.72 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 121.444 1.429 . . . . 10.0 111.239 178.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 5.2 m-30 -60.6 -48.66 80.78 Favored 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 110.333 -0.247 . . . . 10.0 110.333 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 25.4 p -69.97 -35.05 74.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.859 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -67.04 -46.83 73.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.935 0.398 . . . . 10.0 110.161 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -67.77 -30.21 69.61 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.066 -0.716 . . . . 10.0 109.066 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.66 -29.61 68.95 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 108.952 -0.759 . . . . 10.0 108.952 178.01 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -64.96 -38.45 91.02 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 108.611 -0.885 . . . . 10.0 108.611 178.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -69.12 -40.76 78.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.111 178.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 13.5 ttm180 -65.17 -44.99 86.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.652 -0.704 . . . . 10.0 109.391 178.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 48.5 mt -65.12 -34.32 78.12 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.826 -0.624 . . . . 10.0 109.572 178.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -63.93 -43.07 96.99 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -64.2 -42.73 96.52 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.076 -0.713 . . . . 10.0 109.076 178.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 6.7 mmt180 -61.28 -52.35 65.1 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.593 -0.73 . . . . 10.0 109.285 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 43.7 mt -61.51 -37.74 84.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.543 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -61.17 -48.86 79.61 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.42 -43.12 95.34 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.929 -0.578 . . . . 10.0 109.916 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 69.5 mt -63.09 -32.61 74.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 10.0 111.274 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -76.46 -46.39 27.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.662 0.268 . . . . 10.0 110.507 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -65.48 -48.99 70.71 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.128 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -65.68 -38.04 88.16 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -60.34 -42.98 99.06 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.472 -0.785 . . . . 10.0 111.544 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.75 -37.88 93.08 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 110.731 -0.948 . . . . 10.0 110.731 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -73.16 -44.82 59.41 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.446 -0.576 . . . . 10.0 109.446 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -53.92 -49.33 68.9 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.969 178.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 95.3 mt -63.67 -40.56 97.14 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.325 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -64.29 -47.32 79.94 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.157 0.503 . . . . 10.0 109.839 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -66.67 -41.38 88.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.788 179.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 1.8 m-30 -61.22 -39.33 89.86 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.937 -0.394 . . . . 10.0 109.937 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -65.64 -39.92 91.96 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.395 -0.594 . . . . 10.0 109.395 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -65.7 -50.82 63.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.676 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 16.4 mttm -60.72 -37.57 82.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.575 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -64.89 -44.59 89.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.023 178.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 32.4 m -61.04 -41.79 97.25 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.832 -0.433 . . . . 10.0 109.832 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -63.19 -40.02 96.31 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 17.7 m80 -65.79 -45.18 83.37 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.484 -0.78 . . . . 10.0 109.852 179.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 96.5 mt -59.49 -34.98 73.26 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.649 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 29.7 m -63.26 -49.19 75.06 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.057 -0.519 . . . . 10.0 110.258 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 21.0 p -72.63 -28.22 62.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.084 0.468 . . . . 10.0 109.942 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 28.9 mt -64.45 -47.65 78.24 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.164 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 1.4 p -64.69 -34.87 79.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.817 0.341 . . . . 10.0 110.591 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -68.48 -9.02 46.19 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.426 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 7.5 mtmp? -116.88 -29.81 5.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.604 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -73.5 -14.69 61.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.281 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -117.09 -68.86 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 112.401 0.519 . . . . 10.0 112.401 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.42 -56.07 2.06 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.141 1.894 . . . . 10.0 112.445 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -64.07 -42.62 96.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.207 -0.452 . . . . 10.0 111.367 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 9.2 mt -65.68 -37.57 86.86 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 120.908 -0.317 . . . . 10.0 111.248 179.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . 0.532 ' O ' ' CG ' ' A' ' 373' ' ' GLN . 9.6 mt-10 -68.77 -32.75 72.72 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.998 -0.371 . . . . 10.0 109.998 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.22 -45.0 78.13 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.413 -0.958 . . . . 10.0 108.413 177.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.51 -47.95 79.61 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.171 -0.922 . . . . 10.0 109.908 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -65.13 -39.9 93.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.933 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.532 ' CG ' ' O ' ' A' ' 369' ' ' GLU . 98.8 mt-30 -64.32 -34.58 78.47 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.15 -0.477 . . . . 20.0 110.704 178.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -77.43 -34.65 39.61 Favored Glycine 0 C--N 1.332 0.336 0 N-CA-C 109.698 -1.361 . . . . 10.0 109.698 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 18.0 mt -61.26 -28.39 69.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.758 -0.221 . . . . 10.0 111.186 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 56.3 mt -59.47 -65.07 2.27 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 121.083 -0.247 . . . . 10.0 111.089 179.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -65.09 -34.07 47.92 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 121.819 1.68 . . . . 10.0 111.212 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 16.0 t -62.3 -53.36 48.48 Favored 'Isoleucine or valine' 0 C--O 1.231 0.095 0 CA-C-N 116.702 -0.226 . . . . 10.0 110.433 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 40.4 mt -62.09 -41.47 98.23 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 109.957 -0.386 . . . . 10.0 109.957 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -61.78 -46.65 88.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.765 179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 30.0 p -64.45 -34.11 77.43 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.867 0.365 . . . . 10.0 110.346 178.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -68.55 -41.4 79.88 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.06 -0.718 . . . . 10.0 109.06 178.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 83.0 mttt -63.22 -40.28 97.01 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 178.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 54.5 t -59.98 -45.86 94.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-N 116.057 -0.52 . . . . 10.0 109.927 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.26 -43.06 71.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.522 -0.308 . . . . 10.0 111.491 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -63.68 -48.31 77.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.767 0.318 . . . . 10.0 111.38 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 99.2 mt -63.07 -39.76 95.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.432 -0.349 . . . . 10.0 111.363 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 31.4 p -72.52 -39.31 67.66 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.856 -0.338 . . . . 10.0 110.896 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -66.01 -31.07 71.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.261 0.553 . . . . 10.0 110.318 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 27.6 mt -61.4 -22.0 64.6 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.752 -0.658 . . . . 10.0 111.113 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -64.02 -50.36 68.81 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.902 -0.777 . . . . 10.0 108.902 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 20.5 mp0 -61.56 -44.05 97.75 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.32 -0.855 . . . . 10.0 111.658 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -54.04 -42.52 69.27 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 123.683 0.614 . . . . 10.0 112.169 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 30.2 m -82.88 -38.88 22.3 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.396 0.517 . . . . 10.0 112.396 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt . . . . . 0 N--CA 1.466 0.34 0 N-CA-C 112.808 0.67 . . . . 10.0 112.808 -178.888 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 1.7 mt . . . . . 0 N--CA 1.452 -0.328 0 CA-C-O 120.835 0.35 . . . . 10.0 111.003 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 56.9 mt -64.6 -38.06 89.71 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.156 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.84 -43.55 75.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.617 0.722 . . . . 10.0 109.484 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -66.91 -44.73 80.03 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.391 -0.822 . . . . 10.0 110.667 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -29.19 69.81 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.224 -0.444 . . . . 10.0 111.176 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.23 -37.16 79.49 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 109.406 -0.59 . . . . 10.0 109.406 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 69.6 m -69.8 -28.63 65.89 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.408 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 57.6 t -69.93 -38.16 74.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.479 -0.782 . . . . 10.0 108.89 178.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 1.6 m -62.54 -41.82 99.13 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.5 -0.926 . . . . 10.0 108.5 177.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 3.8 m -63.82 -33.18 75.09 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.044 -0.725 . . . . 10.0 109.044 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 95.7 m -65.93 -41.83 90.88 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 108.847 -0.797 . . . . 10.0 108.847 178.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -61.87 -42.3 98.89 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.291 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 8.5 m -61.17 -44.73 96.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.012 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 35.0 mmtt -61.71 -37.58 84.7 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.127 0.489 . . . . 10.0 110.007 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 83.9 mt -68.83 -38.24 79.7 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.663 178.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -65.0 -31.74 73.13 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.431 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -65.25 -35.54 81.34 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -80.56 -33.49 36.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.723 -0.672 . . . . 10.0 109.972 178.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 53.2 mt -63.94 -15.88 60.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.636 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -89.0 -95.76 1.05 Allowed Glycine 0 N--CA 1.444 -0.803 0 C-N-CA 120.801 -0.714 . . . . 10.0 111.969 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -54.05 -39.96 83.34 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.553 2.835 . . . . 10.0 114.345 -178.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 76.0 t -63.61 -48.18 87.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 117.953 0.342 . . . . 10.0 111.062 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 4.9 m -68.59 -39.16 81.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.817 0.342 . . . . 10.0 110.096 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -61.97 -42.28 98.95 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.276 -0.639 . . . . 10.0 109.276 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -64.8 -39.74 94.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.205 -0.907 . . . . 10.0 108.676 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.37 -38.86 88.52 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.048 -0.723 . . . . 10.0 109.048 178.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -66.98 -38.16 85.55 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.602 178.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -64.7 -36.92 85.83 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -68.2 -39.94 82.3 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 177.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 43.2 mt -61.21 -34.12 74.59 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.518 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -63.76 -35.61 81.16 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -72.89 -36.83 67.41 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.567 -0.901 . . . . 10.0 108.567 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -63.59 -48.62 76.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.039 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.75 -42.85 97.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.91 -0.587 . . . . 10.0 110.227 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -63.03 -40.92 99.19 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.92 -44.94 96.66 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 110.405 -1.078 . . . . 10.0 110.405 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 98.1 mt -63.39 -31.32 72.44 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 50.1 mtt180 -77.07 -3.45 39.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.089 0.471 . . . . 10.0 110.453 178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -111.41 -23.68 10.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.684 -0.858 . . . . 10.0 108.684 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -91.93 -61.0 1.72 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.927 -1.033 . . . . 10.0 110.494 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 97.4 mmm -62.66 -30.83 71.67 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.952 -0.567 . . . . 10.0 112.459 -178.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.5 p -60.17 -46.04 91.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.127 0.489 . . . . 10.0 109.725 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -78.83 -40.79 31.78 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.432 -0.804 . . . . 10.0 109.653 179.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.15 -52.91 63.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.739 -179.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 62.2 mt -58.85 -44.16 90.92 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -68.15 -38.17 81.83 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.7 -0.481 . . . . 10.0 109.7 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -61.99 -38.68 89.53 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 178.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 32.2 t -66.4 -51.2 60.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-N 115.24 -0.891 . . . . 10.0 109.354 178.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -58.09 -48.53 79.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.767 0.318 . . . . 10.0 111.413 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -67.27 -11.78 58.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.184 -0.462 . . . . 10.0 112.031 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 43.3 mttp -108.19 -33.1 7.24 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.025 0.38 . . . . 10.0 112.025 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 18.9 t -66.21 -37.93 80.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 O-C-N 123.158 0.286 . . . . 10.0 110.653 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -57.38 -60.57 9.33 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 121.011 -0.275 . . . . 10.0 110.742 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -67.06 -24.37 45.13 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 121.679 1.586 . . . . 10.0 111.674 178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -69.02 -48.08 63.85 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 109.35 -0.611 . . . . 10.0 109.35 179.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 24.6 mt -69.41 -27.18 65.06 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.755 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -71.78 -48.89 43.57 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -65.5 -37.42 86.74 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -67.19 -36.56 82.0 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.371 -0.831 . . . . 10.0 109.348 178.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -64.8 -39.42 93.56 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.031 -0.729 . . . . 10.0 109.031 178.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 40.6 mttp -60.88 -48.39 82.01 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.699 -0.852 . . . . 10.0 108.699 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 16.1 mtmm -64.95 -39.24 93.2 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.512 -0.767 . . . . 10.0 110.665 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 1.3 m95 -62.8 -41.02 99.11 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.102 -0.703 . . . . 10.0 109.102 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -49.89 73.55 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.061 -0.718 . . . . 10.0 109.061 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . 0.694 ' O ' ' CG ' ' C' ' 469' ' ' LEU . 42.4 mt-10 -55.96 -44.89 78.9 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.356 179.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -66.11 -52.78 45.46 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.88 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 88.3 mmm -59.63 -48.07 83.13 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.049 0.388 . . . . 10.0 112.049 -179.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -63.96 -46.14 86.0 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.554 -0.536 . . . . 10.0 109.554 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . 1.195 ' CD1' ' CD ' ' A' ' 308' ' ' ARG . 96.4 mt -59.89 -43.23 94.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.623 -0.717 . . . . 20.0 110.659 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 13.0 m-30 -68.49 -36.75 79.38 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.049 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 -63.83 -39.37 94.06 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.329 -0.619 . . . . 10.0 109.329 178.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -81.47 10.44 5.8 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.629 -0.714 . . . . 10.0 111.244 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -124.58 -54.2 1.66 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.281 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 79.2 t -58.15 -43.24 85.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.524 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -60.7 -62.18 6.47 Favored Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 120.966 -0.294 . . . . 10.0 111.75 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.11 -40.1 63.61 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 121.985 1.79 . . . . 10.0 112.057 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 26.0 mt -65.31 -43.91 89.53 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.45 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 38.6 mtt180 -62.38 -39.84 94.5 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 109.665 -0.495 . . . . 10.0 109.665 179.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -63.92 -48.54 76.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.039 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -66.53 -39.83 88.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.489 179.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 23.1 mt -67.47 -32.03 72.59 Favored 'General case' 0 C--O 1.219 -0.552 0 N-CA-C 109.585 -0.524 . . . . 10.0 109.585 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -67.72 -46.95 70.72 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.55 -0.537 . . . . 10.0 109.55 178.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -65.32 -40.51 93.81 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -66.64 -35.58 90.08 Favored Glycine 0 N--CA 1.445 -0.714 0 N-CA-C 110.646 -0.982 . . . . 10.0 110.646 178.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -71.77 -36.78 70.47 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 109.071 -0.715 . . . . 10.0 109.071 178.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -66.35 -37.4 85.23 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -66.06 -42.65 89.17 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 107.91 -1.144 . . . . 10.0 107.91 176.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -65.11 -39.43 93.11 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.596 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 58.5 mt -63.38 -46.63 85.59 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.164 -0.68 . . . . 10.0 109.164 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -60.92 -41.39 96.09 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 108.968 -0.753 . . . . 10.0 108.968 178.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -59.65 -53.2 60.8 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 84.2 mt -56.27 -43.63 78.97 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.908 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -61.96 -51.47 67.96 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.95 -0.389 . . . . 10.0 109.95 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -70.66 -8.64 53.4 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.949 0.722 . . . . 10.0 112.949 -178.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 13.2 mttm -102.13 -49.97 3.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.96 0.409 . . . . 10.0 110.047 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 85.3 mt -71.3 -19.75 62.29 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.972 0.73 . . . . 10.0 112.972 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 68.4 m -71.73 -60.9 2.25 Favored Pre-proline 0 C--N 1.329 -0.29 0 C-N-CA 120.563 -0.455 . . . . 10.0 111.113 178.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -63.38 -37.54 48.85 Favored 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 121.835 1.69 . . . . 10.0 110.851 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 40.8 mt -72.04 -29.73 64.45 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 116.345 -0.389 . . . . 10.0 109.994 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -69.71 -46.82 52.17 Favored Glycine 0 N--CA 1.449 -0.47 0 N-CA-C 110.212 -1.155 . . . . 10.0 110.212 178.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -61.45 -42.2 98.4 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.312 -0.996 . . . . 10.0 108.312 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.64 -44.91 92.47 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 114.955 -1.021 . . . . 10.0 109.882 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 47.4 mmm -61.79 -34.31 75.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.706 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -68.97 -38.33 79.32 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.693 -0.484 . . . . 10.0 109.693 178.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.0 -30.14 61.07 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.932 -0.766 . . . . 10.0 108.932 178.027 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 38.8 mtt180 -64.64 -46.02 84.35 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 107.056 -1.461 . . . . 10.0 107.056 176.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -62.18 -39.07 91.46 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 114.812 -1.085 . . . . 10.0 108.989 178.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 43.0 mtt180 -61.78 -54.16 46.18 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.849 -0.797 . . . . 10.0 108.849 178.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -61.81 -22.42 65.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.349 -0.841 . . . . 10.0 112.766 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -95.24 -52.12 4.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.58 0.229 . . . . 10.0 111.389 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 96.6 t -67.18 -44.26 87.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.46 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -64.87 -33.59 76.37 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.18 -47.29 77.47 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 107.136 -1.431 . . . . 10.0 107.136 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 75.8 mt -61.15 -36.62 80.29 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.177 178.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -62.12 -23.35 66.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.963 0.411 . . . . 10.0 109.965 178.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 1.6 m -113.24 8.31 18.1 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.454 0.645 . . . . 10.0 110.236 179.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -118.15 -47.2 2.58 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.207 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 76.2 mt -82.45 -29.43 30.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.886 -0.597 . . . . 10.0 111.247 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -60.1 -57.86 23.61 Favored Pre-proline 0 C--N 1.331 -0.216 0 C-N-CA 121.094 -0.243 . . . . 10.0 111.009 179.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -66.83 -27.7 43.69 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 121.242 1.294 . . . . 10.0 110.367 178.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -65.51 -45.25 84.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.226 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 4.4 p -70.25 -34.54 72.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.859 0.361 . . . . 10.0 110.06 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.33 -45.53 76.14 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 178.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -61.41 -45.54 93.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.442 -0.947 . . . . 10.0 108.442 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 16.2 mt -61.58 -32.81 72.93 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.506 -0.77 . . . . 10.0 110.726 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 37.7 mtt180 -64.1 -43.06 96.52 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 110.135 -0.32 . . . . 10.0 110.135 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -67.74 -44.35 77.75 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.994 -0.743 . . . . 10.0 108.994 178.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 77.9 mtt180 -61.61 -43.17 99.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.924 -1.034 . . . . 10.0 110.739 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 57.2 mt -69.03 -35.48 76.67 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 116.176 -0.466 . . . . 10.0 110.203 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -63.13 -47.88 80.88 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.591 -0.522 . . . . 10.0 109.591 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -61.92 -40.23 94.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.717 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 -66.73 -40.49 88.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.497 -0.774 . . . . 10.0 110.168 178.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 17.2 mt -62.46 -40.8 97.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.129 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -63.77 -39.44 94.26 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.845 -0.428 . . . . 10.0 109.845 178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -66.13 -40.61 90.78 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 97.3 mt -68.67 -33.43 73.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.262 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -77.06 -37.01 55.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.431 -0.349 . . . . 10.0 111.205 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -64.16 -53.35 50.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.114 0.483 . . . . 10.0 109.706 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -72.75 -32.75 65.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.474 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.43 -45.33 86.49 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.863 -0.684 . . . . 10.0 111.426 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -63.31 -35.64 92.33 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 110.72 -0.952 . . . . 10.0 110.72 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -70.49 -46.02 64.52 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.754 -0.832 . . . . 10.0 108.754 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 48.2 mtt85 -59.81 -36.66 77.21 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.73 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 74.1 mt -60.77 -41.82 96.24 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.605 -0.517 . . . . 10.0 109.605 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.98 -46.49 71.19 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.22 -47.82 82.3 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.503 -0.771 . . . . 10.0 110.151 178.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -61.45 -40.91 96.22 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 116.345 -0.388 . . . . 10.0 110.494 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -63.32 -39.48 94.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.909 0.385 . . . . 10.0 110.177 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -66.99 -46.47 74.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.374 178.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -36.71 84.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.144 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.93 -38.22 90.27 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.588 -0.893 . . . . 10.0 108.588 178.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 91.3 m -65.41 -44.55 87.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.474 -0.785 . . . . 10.0 108.895 178.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -63.43 -41.11 98.68 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.332 -0.618 . . . . 10.0 109.332 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -63.85 -42.64 97.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.778 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 49.3 mt -65.61 -38.24 88.88 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 18.1 m -67.57 -38.45 84.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.388 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 2.9 p -78.29 -9.56 59.29 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.153 0.502 . . . . 10.0 110.162 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 19.4 mt -90.77 -25.33 20.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.785 -0.643 . . . . 10.0 109.434 178.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.9 m -60.89 -37.89 83.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.047 -0.524 . . . . 10.0 109.948 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.79 0.52 15.13 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.583 179.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -117.2 -45.83 2.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.015 0.436 . . . . 10.0 110.521 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -75.47 -8.76 57.56 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.101 -0.5 . . . . 10.0 112.151 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -113.62 -75.73 0.01 OUTLIER Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 113.043 0.757 . . . . 10.0 113.043 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -65.86 -45.16 6.64 Favored 'Trans proline' 0 C--N 1.357 0.989 0 C-N-CA 121.404 1.403 . . . . 10.0 112.355 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.79 -40.98 96.13 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.487 0.184 . . . . 10.0 111.275 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -40.76 96.78 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.863 -0.421 . . . . 10.0 109.863 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -67.84 -35.52 78.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.998 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -66.46 -43.94 84.12 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.749 -0.834 . . . . 10.0 108.749 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.44 -42.97 97.22 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.647 178.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 65.0 mtt180 -63.88 -42.52 97.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.052 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -64.93 -21.96 66.91 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.571 -0.741 . . . . 20.0 111.794 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -89.39 -42.15 5.59 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 109.556 -1.418 . . . . 10.0 109.556 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 54.1 mt -59.25 -41.17 88.15 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.068 0.396 . . . . 10.0 112.068 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 87.9 mt -51.61 -64.38 1.47 Allowed Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 112.716 0.635 . . . . 10.0 112.716 -179.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.46 -32.15 50.11 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.773 1.649 . . . . 10.0 111.964 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 12.1 t -64.41 -48.02 86.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.649 -0.25 . . . . 10.0 110.527 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 49.1 mt -62.24 -37.45 85.48 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.461 -0.57 . . . . 10.0 109.461 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.75 -49.1 76.34 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.758 -0.656 . . . . 10.0 109.919 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 37.3 m -64.34 -37.39 87.33 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.396 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -66.52 -40.16 89.02 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.223 -0.658 . . . . 10.0 109.223 178.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 78.1 mttt -61.11 -43.88 98.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.157 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 97.4 t -59.86 -45.1 95.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 121.197 0.522 . . . . 10.0 109.926 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 9.5 m -68.25 -35.61 78.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.417 -0.81 . . . . 10.0 111.109 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -72.24 -47.0 53.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.234 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 52.0 mt -58.94 -45.38 90.55 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.828 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 9.4 p -63.24 -46.73 85.57 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.568 -0.53 . . . . 10.0 109.568 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -56.18 -45.74 79.64 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.89 179.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 97.2 mt -55.67 -54.14 47.91 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.277 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -62.34 -46.83 86.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 10.0 111.7 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -59.0 -47.95 83.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.463 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -66.32 -43.13 87.03 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.296 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 35.9 m -61.47 -35.91 78.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.743 0.306 . . . . 10.0 111.014 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -64.99 -34.62 78.87 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.952 0.352 . . . . 10.0 111.952 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -92.95 -14.17 27.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.966 0.412 . . . . 10.0 111.776 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 94.0 mt -106.91 34.93 3.2 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.295 0.569 . . . . 10.0 110.16 179.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 60.8 t30 . . . . . 0 C--O 1.246 0.886 0 CA-C-O 118.49 -0.767 . . . . 10.0 110.502 -179.649 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 2.9 m . . . . . 0 N--CA 1.451 -0.404 0 CA-C-O 120.758 0.313 . . . . 10.0 110.421 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -108.18 132.9 53.15 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.748 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -117.29 142.89 46.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.658 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 50.8 mmtt -101.92 113.43 26.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.518 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 33.4 mt -112.13 125.97 54.69 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.522 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 59.2 t -110.13 122.81 65.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 120.941 -0.303 . . . . 10.0 110.504 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 59.5 t -102.18 108.86 24.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.357 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 9.6 m -109.57 153.53 11.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.543 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 168.76 168.72 31.23 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 111.227 -0.749 . . . . 10.0 111.227 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.2 155.92 37.83 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.253 0.549 . . . . 10.0 111.545 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -66.13 119.3 12.81 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.672 -0.694 . . . . 10.0 111.788 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 124.43 -20.4 6.98 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.706 -0.759 . . . . 10.0 112.605 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 35.6 m -65.28 -24.64 35.47 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.34 45.83 3.96 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.569 -0.824 . . . . 10.0 113.568 178.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -65.12 -44.0 90.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.668 0.27 . . . . 10.0 110.79 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.84 -46.91 84.07 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.084 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.83 -47.75 83.75 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.779 -0.646 . . . . 10.0 111.346 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 25.1 mt -57.68 -46.73 83.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.432 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.4 m -68.64 -47.75 65.8 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.083 -0.508 . . . . 10.0 112.198 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 88.6 mt -62.24 -31.77 52.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-O 120.806 0.336 . . . . 10.0 111.077 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -66.3 -28.11 68.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.112 0.482 . . . . 10.0 110.581 179.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 29.4 tp -86.64 -33.86 19.98 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.934 0.397 . . . . 10.0 110.658 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 46.3 mm -73.0 -78.36 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 112.421 0.526 . . . . 10.0 112.421 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -98.42 -1.05 42.36 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.058 0.392 . . . . 10.0 112.058 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 4.0 t30 60.55 55.29 3.45 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.214 179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -135.72 123.72 22.8 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.761 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -80.88 133.95 35.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.301 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 23.7 m -85.94 166.98 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.54 -0.3 . . . . 10.0 110.482 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -133.58 -17.19 2.28 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.364 0.602 . . . . 10.0 110.898 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 17.0 pm0 -97.68 165.52 11.93 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.464 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -83.23 96.77 8.56 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 178.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -69.54 112.86 13.41 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.78 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -78.88 54.41 5.12 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.894 2.396 . . . . 10.0 111.919 -179.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -56.75 133.38 54.09 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.057 -0.974 . . . . 10.0 112.098 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 79.6 mt -126.34 -53.98 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -154.61 95.01 1.74 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.126 -0.943 . . . . 10.0 108.745 178.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -140.21 124.22 17.54 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.693 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.92 150.05 23.91 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.723 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -131.42 121.74 25.1 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 28.8 ttp85 -118.14 126.5 52.34 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.727 0.298 . . . . 10.0 111.585 -178.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 52.7 tttt -140.92 161.95 36.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.5 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -120.77 127.09 51.64 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 110.11 -0.33 . . . . 10.0 110.11 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 7.3 m -138.83 169.22 18.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.966 0.412 . . . . 10.0 111.021 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 42.2 t -102.66 111.22 31.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 179.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 32.7 mt -111.14 110.73 33.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.919 -178.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 61.65 38.96 14.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.698 -0.683 . . . . 10.0 111.941 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.6 -15.07 56.5 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.832 -0.622 . . . . 10.0 113.816 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -104.36 130.45 52.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 117.118 0.459 . . . . 10.0 111.331 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 1.2 t -75.53 127.68 33.63 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 73.8 m -137.0 139.71 41.62 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-O 121.14 0.495 . . . . 10.0 111.726 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 46.0 tp -95.27 121.04 36.51 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 107.609 -1.256 . . . . 10.0 107.609 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 88.0 mt -108.31 119.83 40.62 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 112.331 0.493 . . . . 10.0 112.331 -178.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -108.49 98.74 8.22 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.117 -1.068 . . . . 10.0 108.117 177.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 10.1 mt -90.57 127.12 43.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.477 -0.783 . . . . 10.0 111.369 -178.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 61.1 tp -102.43 111.74 24.17 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.303 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -104.5 103.07 12.7 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.861 -0.608 . . . . 10.0 109.507 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 11.4 p -105.36 171.58 7.25 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.04 -0.527 . . . . 10.0 112.383 -178.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.96 145.75 52.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 10.0 112.06 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -108.74 25.54 18.83 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.62 -0.718 . . . . 10.0 111.4 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -136.0 34.88 2.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.055 0.455 . . . . 20.0 111.756 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -96.99 143.39 27.89 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.289 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -84.78 -74.18 0.4 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.387 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -158.38 87.32 0.9 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.167 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -105.55 141.19 37.45 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.866 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.34 -35.36 79.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.031 0.443 . . . . 10.0 110.28 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 50.3 ttp -62.76 -39.44 94.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.846 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 46.5 ttt85 -65.89 -46.6 77.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.132 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -55.59 -44.46 76.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.717 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -64.34 -48.65 74.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.781 -0.645 . . . . 10.0 112.377 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . 0.256 0.5 OUTLIER -70.78 -19.6 62.69 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.527 0.936 . . . . 10.0 113.527 -178.795 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 40.7 mmm -74.45 -24.24 59.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.181 0.515 . . . . 10.0 110.081 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -73.47 -30.75 63.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.5 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.3 -5.2 43.45 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.979 0.733 . . . . 10.0 112.979 -179.251 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -87.87 130.78 10.26 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.383 -0.913 . . . . 10.0 111.799 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -80.94 -65.02 1.07 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.743 0.306 . . . . 10.0 110.275 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -103.18 147.75 16.96 Favored Glycine 0 N--CA 1.446 -0.7 0 N-CA-C 111.046 -0.822 . . . . 10.0 111.046 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -123.79 136.22 54.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.268 0.556 . . . . 10.0 111.909 -179.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 79.8 mt -107.61 120.45 42.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.316 179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 18.2 m -92.69 88.7 6.37 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 27.3 t -88.1 116.03 29.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.987 -0.551 . . . . 10.0 112.048 -178.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -129.11 159.68 35.22 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.558 178.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -96.97 132.37 42.83 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 110.129 -0.323 . . . . 10.0 110.129 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 2.5 pt -68.3 -10.94 13.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.91 0.386 . . . . 10.0 111.442 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.25 5.47 34.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.434 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -124.3 104.44 8.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.172 0.511 . . . . 10.0 110.306 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.46 -34.57 78.06 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.579 -0.737 . . . . 10.0 111.875 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -60.55 -41.54 94.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.863 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 11.2 m -63.42 -37.95 89.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.43 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -64.98 -35.43 81.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.022 0.439 . . . . 10.0 110.766 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -80.37 -32.72 37.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.063 0.459 . . . . 10.0 110.574 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -73.91 -7.47 52.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.772 -0.649 . . . . 10.0 112.034 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 23.8 mm -58.91 -37.9 69.9 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 CA-C-O 121.148 0.499 . . . . 10.0 109.985 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 16.0 t-80 -64.0 -33.46 75.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.196 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -62.77 -42.65 99.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.802 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -64.38 -44.79 90.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.084 -0.507 . . . . 10.0 109.695 179.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -56.67 -48.41 77.68 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.309 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -66.39 -41.55 89.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.447 -0.342 . . . . 10.0 111.614 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -60.67 -45.86 92.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.942 0.401 . . . . 10.0 110.691 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 54.3 mt -65.79 -40.89 88.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.802 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 39.3 mtpt -58.15 -37.18 74.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.004 -0.543 . . . . 10.0 111.259 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 59.8 ttp85 -76.98 -47.65 20.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.018 -0.537 . . . . 10.0 112.407 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 32.7 m -66.85 -30.1 48.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 N-CA-C 112.654 0.612 . . . . 10.0 112.654 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -91.72 -12.51 33.78 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 121.112 -0.235 . . . . 10.0 111.382 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 28.0 t0 60.0 34.8 21.5 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.696 0.76 . . . . 10.0 110.971 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 42.9 m -156.43 147.16 21.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.736 -0.665 . . . . 10.0 109.858 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 20.7 mp0 -93.88 -26.67 16.8 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.972 0.415 . . . . 10.0 110.503 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -94.0 77.18 4.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.69 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 57.8 t -120.06 133.38 23.93 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.749 -0.659 . . . . 10.0 110.081 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -59.55 114.97 2.28 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.843 2.362 . . . . 10.0 112.324 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 41.1 mtt -136.71 156.5 48.45 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.386 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 87.0 t -135.38 132.38 52.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 110.049 -0.352 . . . . 10.0 110.049 179.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 19.9 tp -84.53 121.89 28.23 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.381 -0.6 . . . . 10.0 109.381 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 47.7 t -117.11 115.13 47.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.031 0.443 . . . . 10.0 111.769 -178.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.69 97.25 1.76 Allowed Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 110.49 -1.044 . . . . 10.0 110.49 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -87.28 161.41 18.0 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.853 0.359 . . . . 10.0 111.925 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 91.4 mttt 69.54 35.18 2.56 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.336 -0.847 . . . . 10.0 112.148 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 29.1 p -74.33 -12.97 60.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.479 -0.328 . . . . 10.0 111.797 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -81.39 -20.64 40.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.398 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 73.7 mt -67.92 142.42 95.44 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.013 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -61.66 -32.36 86.92 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.914 2.409 . . . . 10.0 111.947 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.87 118.7 17.14 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.33 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 18.0 ttt180 -141.93 115.47 9.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.806 0.336 . . . . 10.0 111.094 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.56 -24.78 11.64 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.571 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 38.5 t -104.34 114.29 43.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.56 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -75.61 152.42 37.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.676 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.2 m -56.75 -42.29 79.04 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.838 -0.619 . . . . 10.0 112.094 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -64.91 -44.7 88.68 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 121.256 -0.178 . . . . 10.0 111.294 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -58.16 -45.97 86.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.851 0.357 . . . . 10.0 110.805 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.6 -44.94 76.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.307 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -62.7 -39.79 95.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.847 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -61.7 -41.29 97.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.342 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 37.8 tp -64.78 -44.19 90.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.009 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.22 -43.98 97.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.184 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -60.35 -36.5 78.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.803 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 20.6 m -66.65 -30.42 70.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.688 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -85.82 -18.18 33.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.582 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.64 28.94 28.12 Favored Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 111.259 -0.736 . . . . 10.0 111.259 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 50.4 pt -128.19 159.07 69.04 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.723 -0.238 . . . . 10.0 110.444 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -82.83 158.36 15.98 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 122.569 2.179 . . . . 10.0 112.42 179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -119.07 124.38 46.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.398 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 23.0 mm -119.13 121.42 66.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.947 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -85.24 123.6 30.92 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.676 -1.231 . . . . 10.0 107.676 177.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 70.1 p -130.09 170.45 14.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.783 0.801 . . . . 10.0 113.073 -176.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 8.7 t -155.44 108.16 2.71 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.672 -1.149 . . . . 10.0 108.495 178.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -66.15 -24.94 66.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.739 0.304 . . . . 10.0 111.611 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 23.1 ttpp -74.85 -35.28 62.38 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.123 0.416 . . . . 10.0 112.123 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 69.6 p -100.68 -7.46 23.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.942 0.401 . . . . 10.0 111.156 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 1.8 ttt-85 67.07 23.3 9.71 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 115.588 -0.733 . . . . 10.0 111.781 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -90.08 127.42 36.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.395 -0.366 . . . . 10.0 111.541 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 75.11 -4.85 37.02 Favored Glycine 0 CA--C 1.52 0.362 0 N-CA-C 114.635 0.614 . . . . 10.0 114.635 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 65.6 t -55.61 -60.91 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 117.1 0.45 . . . . 10.0 111.88 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.88 -34.01 76.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.974 0.416 . . . . 10.0 110.597 -179.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -59.76 -43.35 94.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.696 -0.684 . . . . 10.0 111.383 -179.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -59.64 -45.4 92.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.671 179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -64.52 -43.99 92.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.806 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -59.88 -40.66 89.46 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.915 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 18.4 m -62.99 -43.07 99.81 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.789 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 39.6 tp -60.66 -44.11 96.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.42 . . . . 10.0 111.128 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 58.1 t -61.9 -38.53 80.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.181 0.515 . . . . 10.0 110.332 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -67.09 -33.66 75.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.177 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -68.07 -40.61 82.68 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 109.763 -0.458 . . . . 10.0 109.763 178.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 81.2 mt -62.62 -45.5 98.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.341 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 76.0 mtt180 -61.03 -46.75 89.47 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.671 -0.695 . . . . 10.0 109.709 178.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -54.4 -47.53 72.62 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.674 -0.693 . . . . 10.0 111.42 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -64.65 -45.84 85.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.205 0.446 . . . . 10.0 112.205 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -66.96 -40.31 87.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.264 -0.425 . . . . 10.0 112.098 -179.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -65.6 -43.66 88.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.957 0.408 . . . . 10.0 110.351 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.7 tttm -60.23 -44.58 95.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.024 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 77.0 mtp -66.17 -31.92 73.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.416 -0.356 . . . . 10.0 111.783 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 22.0 m . . . . . 0 C--N 1.326 -0.42 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.679 -179.545 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 111.779 -0.528 . . . . 10.0 111.779 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 9.3 p -123.79 133.68 53.78 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.598 -0.301 . . . . 10.0 110.561 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 8.8 t -123.45 135.44 63.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.282 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 13.9 pttp -99.99 116.5 32.17 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.073 0.463 . . . . 10.0 111.112 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 32.2 t -96.11 133.36 37.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.571 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.06 134.22 35.33 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.795 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 47.1 mt -99.71 150.28 36.67 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.132 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -67.75 0.64 4.02 Favored 'Trans proline' 0 CA--C 1.534 0.485 0 C-N-CA 122.999 2.466 . . . . 10.0 113.069 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -98.03 17.18 18.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.017 0.437 . . . . 10.0 110.076 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 28.1 tttp 66.89 48.35 1.32 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 115.369 -0.832 . . . . 10.0 110.565 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -150.05 -179.32 7.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.497 -0.774 . . . . 10.0 109.508 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.7 160.76 41.81 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.463 -0.199 . . . . 10.0 110.463 178.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 6.6 t -142.61 132.89 24.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.387 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 57.1 t -91.82 117.68 35.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.076 0.465 . . . . 10.0 111.593 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 27.4 m -115.06 164.16 11.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.072 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.26 135.5 34.42 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.78 0.324 . . . . 10.0 110.948 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 21.3 t -83.04 125.36 40.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 179.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 7.6 mtp180 -121.9 151.45 40.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.867 0.365 . . . . 10.0 110.823 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -91.7 37.38 0.96 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.497 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . -143.78 -66.79 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.449 -0.882 . . . . 10.0 113.047 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 11.5 ptm -58.44 155.62 11.7 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 113.072 0.767 . . . . 10.0 113.072 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.06 178.21 5.34 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.59 -0.732 . . . . 10.0 111.136 -179.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 79.3 t -60.12 -43.36 92.75 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 109.765 -0.457 . . . . 10.0 109.765 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -55.36 -45.2 76.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.278 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -69.16 -48.13 63.11 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.976 -0.557 . . . . 10.0 111.601 -179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 4.3 m -63.78 -40.32 96.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.88 -179.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.89 -9.52 59.27 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 111.902 0.334 . . . . 10.0 111.902 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -62.61 -51.89 65.52 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 120.622 0.249 . . . . 10.0 110.552 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 13.3 mmmt -60.45 -29.99 69.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.947 -0.569 . . . . 10.0 111.22 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -75.66 -42.62 50.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.167 -0.469 . . . . 10.0 111.085 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 30.8 mt -76.14 -41.08 51.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.724 0.297 . . . . 10.0 111.74 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -63.36 -26.27 68.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.431 -0.35 . . . . 10.0 111.259 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -80.52 -17.66 12.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.114 0.483 . . . . 10.0 111.147 -179.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 4.8 mmt180 -106.54 -0.62 23.77 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.37 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 77.5 32.89 45.23 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.762 -0.733 . . . . 10.0 112.105 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 62.5 mt -115.17 161.11 18.87 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.711 0.291 . . . . 10.0 110.745 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -122.38 152.0 40.63 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.112 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 19.0 mp0 -78.42 21.5 0.37 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.906 0.706 . . . . 10.0 112.906 -178.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 37.4 p-10 -95.4 -40.68 9.38 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.422 0.527 . . . . 10.0 112.422 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 62.1 m -109.04 6.66 25.25 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.901 0.334 . . . . 10.0 111.901 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 36.2 m -106.61 144.75 32.82 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.91 0.386 . . . . 10.0 111.006 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 7.3 p -132.82 137.99 52.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.922 -0.581 . . . . 10.0 109.733 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 18.1 t -99.83 139.49 21.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 120.768 0.318 . . . . 10.0 110.636 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -119.23 132.62 55.95 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.987 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -79.21 171.37 15.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.351 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.73 96.23 5.39 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.439 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 33.6 mt -133.36 115.76 23.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.537 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 3.4 mmpt? 63.78 42.38 6.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.663 -0.699 . . . . 10.0 111.681 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 76.66 -31.32 1.46 Allowed Glycine 0 N--CA 1.452 -0.239 0 CA-C-N 115.796 -0.638 . . . . 10.0 113.742 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -91.53 158.4 16.48 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.281 0.562 . . . . 10.0 112.0 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -87.68 148.95 24.55 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.455 -0.793 . . . . 10.0 111.223 -179.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 1.3 m -127.99 137.21 52.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.453 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 8.6 t -66.07 130.35 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.688 0.28 . . . . 10.0 111.421 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 2.1 t -127.68 160.79 30.58 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.955 -0.387 . . . . 10.0 109.955 178.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -103.57 159.45 15.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.865 0.364 . . . . 10.0 111.591 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -79.0 -30.8 44.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.038 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.61 -29.76 70.97 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.508 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 2.2 m -64.36 145.51 55.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.417 -179.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -73.5 161.83 29.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.118 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 6.2 tp -93.98 -1.84 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.088 0.471 . . . . 10.0 111.097 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -54.29 -51.8 74.65 Favored Pre-proline 0 CA--C 1.539 0.546 0 N-CA-C 113.582 0.956 . . . . 10.0 113.582 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -79.83 19.34 1.01 Allowed 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 122.466 2.111 . . . . 10.0 113.04 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -107.64 22.22 16.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.258 0.551 . . . . 10.0 110.741 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -87.38 108.12 18.84 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.564 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 127.93 -55.25 0.76 Allowed Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.665 -0.779 . . . . 10.0 112.767 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -85.41 172.06 11.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.833 0.349 . . . . 10.0 111.33 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -118.37 159.2 23.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.253 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 24.8 mt -122.9 154.32 38.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.019 0.438 . . . . 10.0 111.875 -178.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 61.1 mt -126.17 122.29 61.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.222 -0.659 . . . . 10.0 109.222 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 40.3 t -93.18 131.99 38.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.762 0.315 . . . . 10.0 111.146 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.89 162.78 20.38 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.717 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 50.6 t -114.84 133.16 61.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 120.91 0.386 . . . . 10.0 110.652 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 99.2 mt . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.343 -0.837 . . . . 10.0 110.075 179.626 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 33.6 mt . . . . . 0 N--CA 1.452 -0.374 0 N-CA-C 109.986 -0.376 . . . . 10.0 109.986 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 21.6 mtm180 -65.79 -43.1 89.73 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.13 -0.692 . . . . 10.0 109.13 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -64.98 -41.1 95.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.608 -0.724 . . . . 10.0 109.172 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -65.73 -45.78 81.38 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.298 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 48.1 mmm -60.4 -48.25 82.58 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.964 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.9 p -59.53 -37.82 79.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.054 0.454 . . . . 10.0 111.236 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -78.61 -59.44 2.78 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.17 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -56.23 -50.13 72.18 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.983 0.735 . . . . 10.0 112.983 -178.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 21.4 mt -56.5 -51.59 67.92 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.582 0.23 . . . . 10.0 111.437 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -67.65 -33.01 74.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.531 -0.304 . . . . 10.0 111.355 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.64 -43.5 76.14 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 48.4 t -67.91 -41.91 85.2 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.409 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.867 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 44.0 mttm -64.28 -42.96 96.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.712 0.291 . . . . 10.0 110.826 179.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -64.43 -40.81 96.47 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.109 -0.496 . . . . 10.0 109.945 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 7.7 mtpt -77.93 -21.81 50.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.811 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.55 -26.26 37.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.413 -0.358 . . . . 10.0 110.057 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -62.45 -61.79 6.94 Favored Pre-proline 0 N--CA 1.451 -0.408 0 CA-C-N 115.922 -0.581 . . . . 10.0 109.599 178.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -62.61 -27.06 76.01 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 121.741 1.627 . . . . 10.0 110.818 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -62.13 -60.61 3.35 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.838 -0.801 . . . . 10.0 108.838 178.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 86.5 mt -64.3 -35.01 79.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.915 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -64.55 -55.08 22.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.543 -0.299 . . . . 10.0 110.548 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -64.3 -42.05 96.55 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.325 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 4.7 m-30 -62.04 -38.69 89.68 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.422 -0.354 . . . . 10.0 110.122 178.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -67.81 -43.2 80.19 Favored 'General case' 0 C--O 1.22 -0.471 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -58.99 -49.34 78.26 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -63.94 -55.28 23.68 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.734 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -39.97 80.45 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.049 0.388 . . . . 10.0 112.049 -179.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 43.0 tt0 -63.47 -47.45 81.72 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -64.44 -44.66 90.44 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.724 -0.473 . . . . 10.0 109.724 178.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.11 -38.05 84.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.653 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 14.9 ttt -70.56 -46.27 63.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.061 179.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -63.84 -45.91 87.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.472 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 74.3 mt -63.47 -29.99 71.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.004 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.77 -45.98 48.45 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.103 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -61.62 -37.66 84.76 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.343 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -62.92 -20.4 65.15 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.216 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 51.5 mttp -99.85 -30.86 11.8 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.952 178.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 42.6 t -62.04 -42.56 95.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.879 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -55.77 -59.25 12.02 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 111.695 0.257 . . . . 10.0 111.695 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -66.67 -36.97 23.01 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 121.639 1.559 . . . . 10.0 111.397 178.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 3.0 mt -60.16 -44.76 94.74 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 120.666 0.269 . . . . 10.0 110.722 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 23.2 ttm180 -58.62 -42.14 87.52 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.174 -0.676 . . . . 10.0 109.174 179.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -69.73 -47.87 61.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.842 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -58.25 -47.29 84.03 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.016 0.436 . . . . 10.0 110.399 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 61.1 mt -66.93 -41.6 86.73 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.933 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -62.78 -56.4 17.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.495 0.188 . . . . 10.0 111.335 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -66.33 -41.57 89.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.892 0.377 . . . . 10.0 110.695 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -62.03 -49.43 75.29 Favored Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 111.621 -0.592 . . . . 10.0 111.621 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -67.17 -35.57 79.94 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 109.93 -0.396 . . . . 10.0 109.93 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 39.2 ttm180 -60.42 -45.14 94.68 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 178.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -63.1 -54.18 41.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.061 178.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 73.3 mttt -58.14 -46.42 85.68 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.476 -0.784 . . . . 10.0 111.551 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 60.7 mt -68.53 -42.4 78.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.576 -0.284 . . . . 10.0 111.622 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -61.19 -46.91 88.54 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.35 -0.241 . . . . 10.0 110.35 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -65.75 -36.31 83.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.762 0.315 . . . . 10.0 111.006 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 36.9 mt -69.86 -41.86 74.3 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 178.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -67.66 -37.46 82.42 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.021 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.3 -30.86 70.83 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.913 -0.585 . . . . 10.0 109.602 178.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 18.6 tttp -82.25 -26.24 33.39 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.381 178.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 18.9 mt -67.01 -24.72 66.05 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.719 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 31.4 m -65.85 -63.54 3.19 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.837 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -61.64 -47.08 12.1 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 121.632 1.555 . . . . 10.0 111.732 178.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 80.2 mt -65.24 -28.62 69.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.726 0.298 . . . . 10.0 111.38 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -81.46 -45.58 7.32 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 110.802 -0.919 . . . . 10.0 110.802 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -62.22 -43.41 98.88 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.852 -0.425 . . . . 10.0 109.852 178.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -66.86 -31.72 72.51 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 109.535 -0.543 . . . . 10.0 109.535 178.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 12.9 tpt -67.86 -45.45 74.54 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 178.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 49.5 mtt85 -66.95 -36.21 81.71 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.896 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -64.46 -47.52 78.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.24 178.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 13.0 mmt180 -70.76 -33.32 70.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.168 178.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -63.62 -36.78 84.94 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 35.2 ttm105 -60.3 -50.89 71.85 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.17 -1.048 . . . . 10.0 108.17 177.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.16 88.45 Favored 'General case' 0 C--N 1.331 -0.203 0 O-C-N 123.702 0.626 . . . . 10.0 110.222 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -56.98 -57.61 11.78 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.958 -0.564 . . . . 10.0 109.886 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 47.8 t -68.56 -39.17 80.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.446 -0.797 . . . . 10.0 112.308 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -62.71 -45.69 91.6 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.579 0.228 . . . . 10.0 111.369 -179.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -65.46 -32.05 73.46 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.984 -0.747 . . . . 10.0 108.984 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 36.1 mt -71.88 -34.3 69.08 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 115.223 -0.899 . . . . 10.0 109.809 178.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 64.2 mtt180 -62.58 -49.89 73.47 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.636 -0.505 . . . . 10.0 109.636 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 2.9 m -66.57 -13.38 60.95 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.482 -0.781 . . . . 10.0 111.23 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -100.99 -43.0 6.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.4 -0.364 . . . . 10.0 110.754 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 64.2 mt -67.65 -30.87 70.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.444 -0.344 . . . . 10.0 111.398 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -57.32 -60.86 8.43 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 121.268 -0.173 . . . . 10.0 110.698 179.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -66.16 -38.02 23.01 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.246 1.297 . . . . 10.0 110.385 177.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -55.57 -52.68 62.92 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 111.83 0.307 . . . . 10.0 111.83 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 22.0 p -63.96 -43.68 95.08 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 123.088 0.243 . . . . 10.0 111.603 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -65.88 -41.78 91.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.996 0.427 . . . . 10.0 110.819 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 73.0 mt-10 -70.81 -30.11 66.47 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 13.4 mt -66.34 -35.65 80.89 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 108.231 -1.025 . . . . 10.0 108.231 177.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -64.99 -35.56 81.57 Favored 'General case' 0 C--O 1.223 -0.294 0 N-CA-C 108.676 -0.861 . . . . 10.0 108.676 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -67.48 -41.55 84.42 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.103 -0.703 . . . . 10.0 109.103 178.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 4.6 mtp-105 -65.31 -45.54 83.93 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 108.984 -0.747 . . . . 10.0 108.984 178.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 44.2 mt -64.34 -38.24 90.32 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.89 179.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -63.55 -45.06 92.23 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.92 -44.76 94.12 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.304 -0.628 . . . . 10.0 109.304 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -63.72 -43.27 97.04 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.989 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 55.4 mt -65.18 -44.99 86.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.668 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -59.21 -42.48 91.05 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.572 -0.529 . . . . 10.0 109.572 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -69.83 -39.8 76.26 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.246 -0.65 . . . . 10.0 109.246 178.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 7.0 tp -62.37 -28.66 69.92 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.402 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -70.43 -44.53 67.68 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.844 -0.428 . . . . 10.0 109.844 178.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -71.52 -49.8 37.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.444 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -61.3 -46.57 89.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.363 -0.835 . . . . 10.0 109.938 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -64.95 -44.25 94.79 Favored Glycine 0 N--CA 1.449 -0.5 0 N-CA-C 111.687 -0.565 . . . . 10.0 111.687 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.87 -43.59 97.87 Favored Glycine 0 C--N 1.332 0.309 0 N-CA-C 110.756 -0.938 . . . . 10.0 110.756 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -66.08 -45.01 82.8 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.281 -0.637 . . . . 10.0 109.281 178.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -56.48 -48.46 77.1 Favored 'General case' 0 C--O 1.224 -0.257 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 81.9 mt -61.18 -39.73 91.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.979 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -66.63 -48.81 68.25 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.563 -0.532 . . . . 10.0 109.563 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -59.39 -46.83 87.58 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.898 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -62.42 -42.09 99.18 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.092 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 6.4 m80 -62.43 -43.93 97.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.747 0.308 . . . . 10.0 110.377 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.99 -45.16 94.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.932 0.396 . . . . 10.0 109.947 178.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 11.0 mttp -67.75 -35.89 79.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.877 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.64 -35.88 81.23 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 52.2 m -61.34 -50.86 71.23 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.771 -0.825 . . . . 10.0 108.771 178.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -65.75 -28.14 68.82 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.669 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -64.84 -40.2 94.79 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.249 -1.019 . . . . 10.0 108.249 177.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 83.0 mt -72.82 -41.43 64.91 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.413 -0.812 . . . . 10.0 109.573 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 4.9 m -56.01 -53.87 51.69 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.062 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 61.3 p -70.9 -19.65 62.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.004 -0.543 . . . . 10.0 110.789 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 34.8 tp -68.43 -42.85 78.3 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.393 -0.595 . . . . 10.0 109.393 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.44 -30.32 70.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.271 0.558 . . . . 10.0 109.893 178.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -78.19 5.8 9.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.441 -0.799 . . . . 10.0 111.311 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 27.0 mttp -131.1 -46.38 1.01 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.025 -0.534 . . . . 10.0 109.65 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.17 -11.69 61.07 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.964 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -108.79 -72.77 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.43 0 CA-C-O 119.336 -0.364 . . . . 10.0 111.97 178.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -64.16 -51.32 2.2 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 121.553 1.502 . . . . 10.0 112.862 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -61.98 -42.32 99.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 10.0 111.384 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 9.3 mt -67.39 -36.82 82.08 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.99 -0.284 . . . . 10.0 110.874 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . 0.407 ' O ' ' CG ' ' A' ' 373' ' ' GLN . 68.9 mt-10 -66.66 -35.34 79.93 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.905 -0.776 . . . . 10.0 108.905 177.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -63.94 -47.01 82.17 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.636 -0.876 . . . . 10.0 108.636 178.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 1.5 mt -59.76 -44.48 93.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.309 179.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 58.8 mtt180 -66.79 -42.34 86.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.045 179.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.407 ' CG ' ' O ' ' A' ' 369' ' ' GLU . 98.6 mt-30 -60.96 -34.79 75.3 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.686 -0.688 . . . . 20.0 111.413 178.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -79.19 -35.32 30.5 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 109.583 -1.407 . . . . 10.0 109.583 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 18.8 mt -57.64 -35.49 70.56 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.667 0.247 . . . . 10.0 111.667 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 22.0 mt -56.59 -65.83 1.46 Allowed Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 111.737 0.273 . . . . 10.0 111.737 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -65.22 -33.95 47.23 Favored 'Trans proline' 0 C--N 1.357 1.012 0 C-N-CA 121.72 1.614 . . . . 10.0 111.828 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 19.2 t -62.68 -50.86 78.05 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 N-CA-C 110.429 -0.211 . . . . 10.0 110.429 179.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 56.0 mt -61.84 -35.99 79.87 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -62.99 -52.65 62.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.309 178.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.8 p -61.54 -36.71 81.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.736 0.303 . . . . 10.0 110.482 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -65.92 -43.52 87.87 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 178.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 79.7 mttt -67.04 -39.14 86.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.697 179.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 54.1 t -60.72 -45.74 97.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 109.67 -0.493 . . . . 10.0 109.67 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.0 p -69.34 -41.98 75.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.446 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -63.03 -49.48 74.46 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.597 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 82.8 mt -58.82 -38.39 78.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.968 0.413 . . . . 10.0 111.017 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 14.7 m -72.73 -37.36 67.78 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.12 178.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -70.07 -34.5 73.27 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.931 0.396 . . . . 10.0 110.661 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 70.0 mt -58.87 -47.07 86.2 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.277 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 77.0 mt-10 -68.62 -29.67 68.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.195 0.522 . . . . 10.0 110.039 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.42 -36.92 83.88 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.699 179.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -68.26 -46.57 70.06 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.149 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.2 -30.27 70.97 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.288 -0.415 . . . . 10.0 111.96 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt . . . . . 0 N--CA 1.464 0.26 0 CA-C-O 121.02 0.438 . . . . 10.0 110.946 179.436 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 57.4 mt . . . . . 0 N--CA 1.45 -0.47 0 CA-C-O 120.639 0.257 . . . . 10.0 111.152 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 98.4 mt -71.8 -40.4 69.21 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 120.862 0.363 . . . . 10.0 111.238 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.09 -46.62 77.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.448 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -65.19 -38.29 90.03 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 179.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -61.1 -34.88 75.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.437 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -64.81 -45.53 85.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.132 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 1.6 m -61.71 -36.33 80.63 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.092 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 96.9 t -67.01 -37.75 79.99 Favored 'Isoleucine or valine' 0 C--O 1.231 0.107 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 178.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 38.6 m -62.93 -42.6 99.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.737 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 14.5 m -62.44 -30.64 71.38 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 47.1 m -66.81 -33.57 75.91 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.745 178.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -70.52 -38.47 74.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.13 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 2.0 m -63.15 -40.94 99.03 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 36.9 mmtt -69.25 -31.85 70.67 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.033 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 46.1 tp -71.06 -37.92 72.51 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -66.7 -23.32 66.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.631 -0.713 . . . . 10.0 111.03 179.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -64.56 -36.08 83.07 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 108.243 -1.021 . . . . 10.0 108.243 177.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -81.66 -30.03 32.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.033 -0.985 . . . . 10.0 109.277 178.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 71.6 mt -69.27 -11.62 60.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.318 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -97.89 -99.75 2.07 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.159 -0.543 . . . . 10.0 112.038 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -49.44 -43.67 37.6 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.789 2.993 . . . . 10.0 113.769 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 55.1 t -59.66 -46.95 92.78 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-O 120.531 0.205 . . . . 10.0 111.085 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 5.0 m -65.97 -39.65 90.56 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.952 -0.388 . . . . 10.0 109.952 178.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -60.54 -45.72 92.82 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -64.3 -30.88 71.91 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.715 -0.675 . . . . 10.0 109.551 178.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -67.6 -38.17 83.6 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.885 -0.783 . . . . 10.0 108.885 178.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 44.4 m95 -67.05 -41.66 86.13 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 108.178 -1.045 . . . . 10.0 108.178 177.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -60.56 -40.52 91.93 Favored 'General case' 0 C--N 1.333 -0.11 0 N-CA-C 108.349 -0.982 . . . . 10.0 108.349 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -63.95 -46.53 84.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.447 178.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 50.0 mt -61.69 -28.82 69.67 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.106 179.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -64.96 -46.43 81.55 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.612 -0.885 . . . . 10.0 108.612 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -62.64 -40.91 98.5 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 108.405 -0.961 . . . . 10.0 108.405 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -60.08 -55.43 34.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.115 -0.948 . . . . 10.0 110.914 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 3.1 p -59.14 -38.3 79.36 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.967 0.358 . . . . 10.0 111.967 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -63.55 -50.6 68.88 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 110.03 -0.359 . . . . 10.0 110.03 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.8 -48.03 76.57 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.677 -0.773 . . . . 10.0 111.358 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 74.5 mt -57.74 -40.04 78.73 Favored 'General case' 0 C--O 1.22 -0.455 0 O-C-N 123.556 0.21 . . . . 10.0 110.986 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -66.47 -33.56 75.97 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.706 -0.398 . . . . 10.0 110.914 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -67.52 -41.38 84.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.839 -0.8 . . . . 10.0 108.839 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -69.84 -53.48 17.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.328 -0.851 . . . . 10.0 109.77 178.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 80.7 mmm -57.92 -41.04 81.84 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.977 0.732 . . . . 10.0 112.977 -178.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 33.4 p -60.91 -49.91 75.56 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.643 -0.423 . . . . 10.0 110.003 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 8.1 tttt -67.71 -37.92 82.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.741 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.32 -51.52 69.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.285 178.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 85.2 mt -65.98 -37.33 85.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.917 -0.583 . . . . 10.0 111.119 179.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -63.3 -47.13 83.58 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.108 -0.701 . . . . 10.0 109.108 178.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -65.84 -36.0 82.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.594 -0.73 . . . . 10.0 109.308 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.38 -47.12 93.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.871 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 69.7 mttt -66.28 -30.44 70.86 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.962 0.411 . . . . 10.0 110.87 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -86.3 5.29 35.22 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.543 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 37.8 mttp -124.93 -36.67 2.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.703 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.0 -44.52 99.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 110.29 -0.263 . . . . 10.0 110.29 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -59.31 -58.84 16.49 Favored Pre-proline 0 CA--C 1.535 0.365 0 CA-C-N 116.541 -0.3 . . . . 10.0 111.014 179.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -60.65 -34.77 91.78 Favored 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 122.035 1.824 . . . . 10.0 112.013 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -67.17 -50.14 62.2 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.209 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 28.1 mt -64.8 -39.94 94.41 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 110.203 -0.295 . . . . 10.0 110.203 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.73 -47.03 88.11 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -72.73 -34.15 66.89 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.445 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -70.64 -32.33 69.59 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 178.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -62.51 -34.47 76.96 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 178.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 58.4 mttt -66.09 -43.39 87.47 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.542 -0.91 . . . . 10.0 108.542 177.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -60.93 -45.46 94.59 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.448 -0.797 . . . . 10.0 108.975 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -60.68 -39.53 88.82 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.395 178.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -66.97 -49.09 66.49 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 110.095 -0.335 . . . . 10.0 110.095 178.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . 1.226 ' O ' ' CG ' ' C' ' 469' ' ' LEU . 49.0 mt-10 -57.09 -37.5 71.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.816 0.341 . . . . 10.0 110.163 179.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.25 -52.56 10.58 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.903 -0.59 . . . . 10.0 111.078 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 74.3 mmm -60.79 -49.0 79.24 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.615 0.245 . . . . 10.0 111.47 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -67.27 -37.28 83.22 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.679 -0.489 . . . . 10.0 109.679 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . 1.226 ' CG ' ' O ' ' C' ' 465' ' ' GLU . 96.5 mt -61.96 -44.47 96.68 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 115.803 -0.635 . . . . 20.0 109.513 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -70.85 -22.95 62.25 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.497 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 26.9 mtt180 -67.76 -33.85 75.66 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 108.801 -0.814 . . . . 10.0 108.801 178.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -93.04 10.09 32.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.324 -0.853 . . . . 10.0 109.905 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 75.9 mttt -121.46 -67.3 0.98 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.755 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 61.8 t -55.77 -42.2 69.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.01 -0.541 . . . . 10.0 112.229 -178.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -59.93 -62.61 5.55 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 112.293 0.479 . . . . 10.0 112.293 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -64.19 -32.97 62.22 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 121.69 1.594 . . . . 10.0 111.424 179.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 23.6 mt -65.9 -42.72 89.86 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 120.993 -0.283 . . . . 10.0 110.25 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -62.88 -38.22 90.02 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -66.13 -50.73 62.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.892 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.27 -39.48 94.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.785 0.326 . . . . 10.0 110.198 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 17.9 mt -65.57 -33.71 76.54 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 178.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -71.93 -38.91 69.78 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 178.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -64.64 -43.1 94.76 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.352 -0.981 . . . . 10.0 108.352 177.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -69.25 -33.44 73.44 Favored Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 110.826 -0.91 . . . . 10.0 110.826 178.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.77 -45.58 70.99 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 57.0 mtt180 -61.73 -36.68 81.67 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.215 -0.661 . . . . 10.0 109.215 178.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -65.74 -49.32 68.83 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 177.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -63.43 -37.09 85.95 Favored 'General case' 0 C--O 1.226 -0.159 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.276 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 60.4 mt -64.95 -32.33 74.0 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 6.3 m80 -73.87 -43.14 59.5 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.26 -1.015 . . . . 10.0 108.26 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -58.77 -44.1 90.55 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.289 -0.869 . . . . 10.0 109.2 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 90.1 mt -74.95 -39.95 61.06 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 115.431 -0.804 . . . . 10.0 111.703 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -62.57 -44.48 96.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.792 0.33 . . . . 10.0 110.607 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -75.27 4.65 6.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.412 0.625 . . . . 10.0 110.844 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -114.39 -46.33 2.98 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.18 178.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 74.1 mt -63.8 -35.82 81.87 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.992 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 22.9 m -62.68 -59.8 11.67 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 120.67 -0.412 . . . . 10.0 111.253 179.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -65.85 -40.78 15.75 Favored 'Trans proline' 0 C--N 1.356 0.936 0 C-N-CA 121.629 1.552 . . . . 10.0 111.721 178.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 12.8 mt -66.81 -37.07 83.81 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 121.237 -0.185 . . . . 10.0 110.837 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.71 -45.56 92.42 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.06 -1.216 . . . . 10.0 110.06 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -62.69 -42.01 99.41 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.237 -0.653 . . . . 10.0 109.237 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -65.27 -47.67 75.88 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.293 -0.867 . . . . 10.0 109.74 179.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 77.1 mmm -60.98 -36.83 80.47 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.999 -0.371 . . . . 10.0 109.999 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 90.8 mtt180 -62.54 -48.0 81.44 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -65.8 -38.29 88.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.02 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -60.93 -47.99 83.87 Favored 'General case' 0 CA--C 1.522 -0.125 0 N-CA-C 108.291 -1.003 . . . . 10.0 108.291 177.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.95 -42.89 95.05 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.43 -0.805 . . . . 10.0 109.878 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 57.1 mtt180 -59.65 -51.05 71.46 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 109.612 -0.514 . . . . 10.0 109.612 178.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -59.57 -38.38 80.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.157 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -71.27 -56.94 5.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.566 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 75.9 t -61.46 -39.27 82.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.941 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.75 -41.96 98.35 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.9 -36.46 82.31 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.968 -0.752 . . . . 10.0 108.968 178.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 93.1 mt -67.39 -37.78 83.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.258 178.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 83.9 mtt180 -58.43 -56.01 27.63 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.16 0.505 . . . . 10.0 110.256 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.75 22.74 0.46 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.6 0.593 . . . . 10.0 112.6 -179.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -138.95 -43.48 0.47 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 121.87 -0.518 . . . . 10.0 111.562 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 86.0 mt -73.79 -38.43 64.63 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -61.79 -56.39 32.89 Favored Pre-proline 0 CA--C 1.535 0.397 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.373 179.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -62.0 -38.08 60.2 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 121.549 1.499 . . . . 10.0 111.607 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -68.24 -39.28 82.33 Favored 'General case' 0 C--N 1.334 -0.091 0 C-N-CA 120.677 -0.409 . . . . 10.0 111.69 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 10.2 p -66.36 -34.28 77.62 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 109.119 -0.697 . . . . 10.0 109.119 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -68.73 -36.6 78.6 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 177.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -62.79 -44.78 95.29 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 107.64 -1.244 . . . . 10.0 107.64 176.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 93.5 mt -61.89 -43.8 98.1 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 114.962 -1.017 . . . . 10.0 109.69 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 66.2 mtt180 -56.98 -45.66 82.76 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.991 -0.374 . . . . 10.0 109.991 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -62.72 -49.39 75.24 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.169 -0.469 . . . . 10.0 111.043 179.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 52.9 mtt85 -66.32 -42.4 88.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.162 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 67.2 mt -66.16 -33.48 75.87 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.416 -0.356 . . . . 10.0 110.25 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -64.84 -42.82 94.61 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.885 -0.784 . . . . 10.0 108.885 178.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.67 -40.69 84.43 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.621 178.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 24.2 ttm180 -64.38 -42.32 96.22 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 34.8 mt -64.47 -36.95 85.84 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.959 -0.564 . . . . 10.0 109.566 178.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -58.41 -47.82 82.67 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.713 -0.847 . . . . 10.0 108.713 178.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.18 -37.99 89.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.557 -0.747 . . . . 10.0 109.769 178.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 76.7 mt -68.29 -27.03 65.96 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.627 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -81.65 -40.27 23.15 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -68.83 -53.45 21.4 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.517 -0.549 . . . . 10.0 109.517 178.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -66.94 -40.56 87.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.562 179.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -63.46 -45.85 93.91 Favored Glycine 0 C--O 1.226 -0.348 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.989 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -61.33 -40.35 98.5 Favored Glycine 0 N--CA 1.449 -0.441 0 N-CA-C 110.754 -0.938 . . . . 10.0 110.754 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -66.19 -44.65 83.34 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 178.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 69.9 mtt180 -61.46 -39.5 91.07 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.747 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 62.6 mt -61.35 -41.8 97.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.717 0.294 . . . . 10.0 110.569 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -70.58 -38.78 74.09 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.4 -0.593 . . . . 10.0 109.4 178.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -63.22 -49.22 75.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.257 -0.883 . . . . 10.0 109.709 178.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -59.14 -42.52 90.85 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 115.694 -0.684 . . . . 10.0 109.913 178.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.3 m170 -60.83 -48.68 80.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.962 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -62.56 -47.82 82.19 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.864 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.65 -31.66 72.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.138 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.26 -49.98 65.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.251 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.23 -35.24 75.0 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.937 0.399 . . . . 10.0 110.507 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -69.09 -31.46 70.19 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.479 179.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 62.1 m170 -82.74 -26.02 32.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.518 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 82.2 mt -64.48 -35.38 80.74 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.88 -42.57 94.71 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.937 -0.764 . . . . 10.0 108.937 178.432 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.75 -38.39 88.97 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.647 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 51.8 mt -66.32 -34.64 78.45 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 178.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 70.9 m -66.23 -31.4 72.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.582 178.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -64.63 -25.21 67.86 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 121.515 0.674 . . . . 10.0 109.518 178.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.64 -27.36 14.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.532 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -79.47 -27.2 41.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 10.0 112.087 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -105.88 -73.87 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.3 -52.49 3.99 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.279 1.986 . . . . 10.0 112.876 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -63.15 -45.58 91.22 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.672 0.619 . . . . 10.0 112.672 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 12.0 mt -62.57 -36.6 83.19 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.85 -0.34 . . . . 10.0 111.061 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . 0.763 ' O ' ' CG ' ' C' ' 571' ' ' GLN . 53.3 tt0 -67.9 -36.14 79.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.974 -0.75 . . . . 10.0 108.974 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -68.57 -44.4 74.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.487 -0.778 . . . . 10.0 109.323 178.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 77.5 mt -61.42 -46.29 90.74 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.534 179.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 45.5 mtt180 -71.09 -29.35 65.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.92 0.391 . . . . 10.0 110.391 179.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . 0.763 ' CG ' ' O ' ' C' ' 567' ' ' GLU . 99.0 mt-30 -65.3 -29.69 70.48 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.667 -0.697 . . . . 20.0 109.98 178.107 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -90.15 -27.0 22.3 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 109.519 -1.432 . . . . 10.0 109.519 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 14.5 mt -59.12 -43.08 91.92 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.56 0.207 . . . . 10.0 111.56 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 93.8 mt -55.57 -61.04 6.86 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 112.126 0.417 . . . . 10.0 112.126 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -58.85 -35.98 97.72 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 122.092 1.861 . . . . 10.0 111.737 178.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 18.0 t -65.41 -45.21 93.74 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 110.052 -0.351 . . . . 10.0 110.052 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 63.2 mt -63.13 -38.7 92.2 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -65.17 -49.32 70.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.887 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 2.8 p -62.5 -41.39 98.79 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.025 0.44 . . . . 10.0 110.175 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -64.71 -41.02 96.3 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.805 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -61.33 -47.16 87.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.12 178.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 84.1 t -60.43 -42.24 90.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.869 -0.419 . . . . 10.0 109.869 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 20.0 m -64.29 -44.27 92.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.319 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -66.06 -46.64 77.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.842 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 29.5 mt -55.65 -48.48 74.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.803 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 5.1 m -66.56 -42.14 87.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.175 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -61.65 -42.51 99.01 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.287 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 84.7 mt -59.09 -40.82 86.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.06 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -66.62 -38.4 86.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.961 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -72.6 -40.46 66.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.084 0.469 . . . . 10.0 110.853 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 8.4 m-30 -66.25 -44.93 82.3 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.962 -0.563 . . . . 10.0 112.172 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 2.7 p -59.5 -33.48 71.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.81 0.338 . . . . 10.0 111.699 -179.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -69.0 -20.23 64.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.194 0.521 . . . . 10.0 111.349 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.13 -2.93 51.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.891 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 81.9 mt -119.79 16.59 12.7 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.12 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.616 -0.707 . . . . 10.0 109.664 179.811 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.53 0.193 0 CA-C-O 120.664 0.269 . . . . 10.0 111.446 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -96.22 124.14 40.11 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.458 -0.571 . . . . 10.0 109.458 178.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -114.76 120.97 41.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.785 0.326 . . . . 10.0 110.452 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 23.9 mtmm -91.01 111.05 22.34 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.248 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 15.0 mt -107.75 119.62 39.95 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.478 -178.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 55.4 t -103.44 124.25 57.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 120.914 0.388 . . . . 10.0 110.632 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 22.9 t -98.8 112.53 31.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.564 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 22.9 m -109.41 161.6 7.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.789 0.328 . . . . 10.0 111.075 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 156.95 -179.67 32.57 Favored Glycine 0 N--CA 1.446 -0.661 0 N-CA-C 111.22 -0.752 . . . . 10.0 111.22 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -83.66 173.87 11.0 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.957 0.408 . . . . 10.0 111.11 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -84.6 118.07 4.64 Favored Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 120.597 -0.811 . . . . 10.0 112.016 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 110.96 -1.94 28.61 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.419 -0.896 . . . . 10.0 112.959 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 27.8 m -73.05 -38.69 56.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 111.996 0.369 . . . . 10.0 111.996 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 113.9 33.72 1.8 Allowed Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.383 -0.913 . . . . 10.0 113.264 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 38.5 mtmt -62.28 -58.79 6.41 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.835 0.35 . . . . 10.0 111.119 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.89 -33.22 68.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.519 -0.764 . . . . 10.0 111.616 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.54 -41.45 94.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.955 0.407 . . . . 10.0 110.273 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 91.5 mt -67.4 -39.23 85.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.012 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 2.1 m -64.42 -49.28 72.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.879 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.08 -31.11 52.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.107 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -68.92 -30.56 69.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.661 0.267 . . . . 10.0 110.906 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.2 tp -87.6 -35.36 18.12 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.182 0.515 . . . . 10.0 111.088 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 43.7 mm -80.83 -55.57 8.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 112.548 0.573 . . . . 10.0 112.548 -178.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 15.3 mt-30 -96.98 -15.58 21.03 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.735 0.642 . . . . 10.0 112.735 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 65.58 29.73 10.88 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.71 0.767 . . . . 10.0 109.208 -178.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -128.76 138.09 51.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.858 -1.064 . . . . 10.0 109.479 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -94.61 139.17 31.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.301 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 m -103.39 114.16 42.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.057 -0.519 . . . . 10.0 110.752 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -91.55 6.82 44.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.343 0.592 . . . . 10.0 109.782 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -94.72 158.73 15.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.306 -0.861 . . . . 10.0 110.207 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -105.43 79.96 1.52 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.0 0.428 . . . . 10.0 110.054 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -98.64 130.81 27.08 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.383 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -69.16 -172.84 0.55 Allowed 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.196 2.598 . . . . 10.0 112.286 179.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -169.94 143.48 2.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.389 -0.369 . . . . 10.0 111.121 -179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 11.5 mt -115.99 -62.58 2.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 108.458 -0.942 . . . . 10.0 108.458 178.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -154.74 92.5 1.48 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.298 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -109.21 160.05 16.42 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.187 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.6 p -148.24 138.3 22.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 112.274 0.472 . . . . 10.0 112.274 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . 0.446 ' CE2' ' CG2' ' D' ' 840' ' ' VAL . 1.5 m-85 -128.55 151.5 49.38 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.847 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -137.25 126.46 24.64 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.521 0.2 . . . . 10.0 110.634 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 8.6 tttm -151.06 141.03 22.02 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.369 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -88.94 135.14 33.7 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.14 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 21.7 m -137.54 167.21 23.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.852 0.358 . . . . 10.0 111.227 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 58.9 t -115.48 114.41 46.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.669 -0.696 . . . . 10.0 109.744 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 46.1 mt -127.27 121.0 56.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.337 -179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 66.25 21.88 10.99 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.432 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.51 -20.39 50.88 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 121.033 -0.604 . . . . 10.0 112.45 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -88.46 150.43 23.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.997 0.427 . . . . 10.0 110.907 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 9.8 t -103.58 137.5 41.57 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 108.505 -0.924 . . . . 10.0 108.505 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 3.6 p -147.84 153.24 38.89 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.954 0.407 . . . . 10.0 111.529 -178.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 26.5 tp -100.93 117.03 34.18 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.619 -0.882 . . . . 10.0 108.619 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 46.7 mt -92.43 120.52 33.0 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.464 0.542 . . . . 10.0 112.464 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -104.77 90.75 3.58 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 106.992 -1.484 . . . . 10.0 106.992 177.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 13.5 mt -84.9 134.56 26.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.729 -0.669 . . . . 10.0 112.055 -177.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 63.7 tp -112.36 111.12 21.76 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.582 -0.735 . . . . 10.0 111.348 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -89.95 91.04 8.42 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.34 -0.985 . . . . 10.0 108.34 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 81.7 p -78.36 171.7 14.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.87 -178.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.04 158.71 27.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.692 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -82.86 -47.83 5.72 Favored Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 110.573 -1.011 . . . . 10.0 110.573 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -127.31 118.99 25.26 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.28 -0.637 . . . . 20.0 109.28 178.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -137.71 166.95 22.7 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.502 -179.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -115.59 -160.49 0.75 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.053 -0.521 . . . . 10.0 109.969 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -71.38 104.56 3.23 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.75 -0.463 . . . . 10.0 109.75 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 68.4 m -136.99 135.49 37.68 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.974 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.96 -33.55 76.08 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.543 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 63.6 mmm -61.65 -41.52 97.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 10.0 109.984 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 58.9 ttt85 -64.18 -45.77 86.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.604 -0.726 . . . . 10.0 110.797 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -62.05 -38.38 88.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.194 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 18.7 tp60 -69.02 -47.4 65.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.626 -0.716 . . . . 10.0 112.099 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . 0.292 0.2 OUTLIER -69.01 -23.18 64.06 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 114.14 1.163 . . . . 10.0 114.14 -178.722 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 55.4 mtm -87.42 -25.67 23.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.198 0.523 . . . . 10.0 110.3 178.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 15.4 ttm180 -67.34 -28.7 68.19 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.914 -0.584 . . . . 10.0 111.363 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -89.63 -1.45 58.02 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.346 0.499 . . . . 10.0 112.346 -179.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.27 149.66 34.27 Favored Glycine 0 C--O 1.237 0.305 0 C-N-CA 120.647 -0.787 . . . . 10.0 113.102 -179.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -102.99 -55.35 2.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.061 0.457 . . . . 10.0 109.873 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -115.01 142.77 17.83 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 110.992 -0.843 . . . . 10.0 110.992 179.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 73.8 m-85 -122.35 126.34 47.83 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.121 0.486 . . . . 10.0 112.155 -178.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 56.5 mt -98.79 117.59 33.61 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.864 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 9.6 m -91.21 91.57 8.27 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 50.0 t -90.01 119.96 38.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.08 0.467 . . . . 10.0 112.167 -178.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -132.12 140.06 48.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.021 178.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -82.77 128.03 34.0 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.829 -0.434 . . . . 10.0 109.829 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 43.1 pt -72.25 -5.9 6.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 112.083 0.401 . . . . 10.0 112.083 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -98.45 1.14 46.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.942 179.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -129.23 119.45 24.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.635 -0.712 . . . . 10.0 110.335 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.67 -38.11 76.94 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 -178.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 52.3 tttp -59.73 -39.12 83.67 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.906 0.384 . . . . 10.0 111.062 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 49.2 m -59.42 -38.18 79.99 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.701 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -68.62 -36.71 79.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.116 0.484 . . . . 10.0 111.115 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -79.82 -30.72 40.54 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.683 -179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.36 -16.28 63.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.19 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 38.7 mm -56.74 -42.29 76.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.677 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -66.6 -36.99 83.94 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.912 0.387 . . . . 10.0 110.223 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -62.82 -39.36 94.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.042 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -78.96 -34.09 44.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.385 -0.371 . . . . 10.0 111.061 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -57.68 -50.01 74.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.314 179.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -68.2 -32.44 72.66 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.993 -0.548 . . . . 10.0 111.026 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -63.38 -47.43 82.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.002 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 55.3 mt -63.13 -35.8 73.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.29 179.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 49.7 mtpt -62.62 -31.4 72.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.513 179.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.01 -20.06 33.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.85 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 15.0 m -87.99 -33.72 6.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.599 -0.441 . . . . 10.0 111.586 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -95.95 -15.84 22.1 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.473 179.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 63.12 48.11 3.89 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.454 -0.794 . . . . 10.0 112.054 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 9.2 t -166.68 164.88 16.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.659 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -101.58 -20.21 15.15 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -91.91 77.15 5.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.626 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 39.6 t -123.43 132.83 24.28 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.26 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -65.71 106.97 0.98 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.852 2.368 . . . . 10.0 111.881 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 61.4 mtt -127.81 152.34 47.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.862 -0.608 . . . . 10.0 109.891 179.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 88.6 t -135.67 127.99 46.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.744 -0.465 . . . . 10.0 109.744 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 18.7 tp -80.43 114.52 19.38 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 45.3 t -111.15 110.23 31.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.518 -178.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -86.35 128.89 9.1 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 109.335 -1.506 . . . . 10.0 109.335 178.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -114.89 155.94 25.92 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 117.42 0.61 . . . . 10.0 112.372 -178.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 80.3 mttt 71.99 46.05 0.37 Allowed 'General case' 0 N--CA 1.462 0.146 0 O-C-N 124.174 0.921 . . . . 10.0 112.65 179.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 26.3 p -79.0 -15.31 58.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.032 0.444 . . . . 10.0 110.642 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -86.22 1.29 51.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.165 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 24.4 mt -100.27 137.09 19.93 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.568 179.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.92 -3.16 13.5 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.914 2.409 . . . . 10.0 112.326 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 13.2 t -85.51 26.47 0.93 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.923 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 -64.52 107.0 1.26 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.052 0.453 . . . . 10.0 111.927 -179.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 2.8 m -97.25 -34.47 11.08 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.762 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 46.5 t -87.41 119.24 34.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.894 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -72.78 153.8 40.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.521 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.25 -41.88 85.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.858 -0.61 . . . . 10.0 112.152 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -69.64 -38.03 77.0 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.308 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -55.39 -45.38 76.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.179 0.514 . . . . 10.0 110.517 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.97 -41.96 77.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.458 -0.792 . . . . 10.0 110.929 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -60.43 -40.68 91.95 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.959 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -62.5 -45.5 92.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.9 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 32.3 tp -62.85 -45.86 90.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.873 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.67 -45.97 90.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.968 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -61.05 -31.8 71.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.516 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 32.3 m -70.8 -29.81 66.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.459 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -93.5 -6.78 46.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.797 0.332 . . . . 10.0 110.879 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 75.09 29.72 60.13 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.976 -0.631 . . . . 10.0 111.843 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 49.0 pt -122.02 154.82 61.44 Favored Pre-proline 0 C--N 1.329 -0.306 0 N-CA-C 110.55 -0.167 . . . . 10.0 110.55 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -80.51 150.96 19.57 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.922 2.415 . . . . 10.0 112.268 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -113.14 121.51 44.74 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.502 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 11.9 mm -118.12 117.9 56.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.54 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -82.9 123.76 29.7 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.023 -1.103 . . . . 10.0 108.023 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 76.3 p -135.89 172.66 12.69 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 113.568 0.951 . . . . 10.0 113.568 -177.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -163.8 121.41 1.81 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 113.953 -1.476 . . . . 10.0 107.635 178.142 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -72.61 -25.63 61.38 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.317 0.488 . . . . 10.0 112.317 -178.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 22.5 tttt -66.26 -47.96 72.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.848 0.356 . . . . 10.0 111.6 -179.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.1 0.82 41.45 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.2 -0.455 . . . . 10.0 111.522 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 18.3 ttt85 54.5 47.81 21.92 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.18 -179.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -90.05 111.85 23.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.609 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 66.94 10.19 55.31 Favored Glycine 0 CA--C 1.519 0.286 0 N-CA-C 114.594 0.598 . . . . 10.0 114.594 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 90.6 t -59.68 -49.15 84.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 117.046 0.423 . . . . 10.0 111.119 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -63.75 -45.01 91.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.301 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -61.64 -38.35 87.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.863 -0.608 . . . . 10.0 112.055 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.92 -50.63 72.69 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.838 0.352 . . . . 10.0 110.915 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -65.81 -41.52 91.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.816 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -63.01 -41.67 99.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.682 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 98.8 m -57.89 -41.5 82.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.798 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 30.3 tp -58.06 -50.75 72.38 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.212 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 39.3 t -62.73 -38.88 82.84 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.458 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 43.7 mtm-85 -61.76 -34.36 75.71 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.495 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -76.42 -37.13 57.52 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.194 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 78.5 mt -64.01 -44.5 97.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.849 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 29.0 ttm180 -59.53 -52.19 66.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.761 0.315 . . . . 10.0 110.646 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -61.19 -33.52 73.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.156 0.503 . . . . 10.0 110.244 179.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -65.09 -39.43 93.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.591 -0.731 . . . . 10.0 111.042 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -70.48 -42.64 71.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.455 -0.338 . . . . 10.0 110.464 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -71.56 -15.46 62.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.265 0.555 . . . . 10.0 110.145 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -80.5 -39.2 28.39 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.957 -0.757 . . . . 10.0 108.957 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 17.0 mmt -67.99 -30.5 69.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.454 -0.794 . . . . 10.0 111.781 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 12.9 m . . . . . 0 C--N 1.33 -0.242 0 CA-C-O 120.782 0.325 . . . . 10.0 111.322 179.469 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.266 0 N-CA-C 111.79 -0.524 . . . . 10.0 111.79 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 36.1 p -121.42 118.08 28.49 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.359 -0.238 . . . . 10.0 110.359 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 3.5 t -101.69 134.23 42.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.036 0.446 . . . . 10.0 111.209 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 38.3 mtpt -83.35 114.54 21.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.653 -0.703 . . . . 10.0 110.326 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 44.4 t -100.88 122.61 53.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -89.86 137.76 32.06 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.462 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 19.4 mt -109.35 147.92 37.0 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 115.647 -0.706 . . . . 10.0 110.782 -178.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -73.93 56.76 3.69 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.322 2.681 . . . . 10.0 111.79 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -163.47 33.48 0.09 Allowed 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 107.975 -1.12 . . . . 10.0 107.975 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 31.3 mtpt 52.51 39.79 28.57 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 114.357 -1.292 . . . . 10.0 111.66 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -139.18 -173.94 3.73 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 113.23 0.826 . . . . 10.0 113.23 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.51 172.02 17.81 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.678 -0.692 . . . . 10.0 112.218 -177.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 12.1 t -150.99 139.26 20.28 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.346 -1.353 . . . . 10.0 107.346 177.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 2.3 t -110.03 107.53 23.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 120.331 -0.548 . . . . 10.0 111.295 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 10.6 t -109.49 143.59 19.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.01 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.57 136.37 39.26 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.521 -0.309 . . . . 10.0 110.73 179.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 59.1 t -89.02 127.45 41.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.917 0.389 . . . . 10.0 110.418 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -131.01 155.23 47.2 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.77 154.13 36.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.007 0.432 . . . . 10.0 110.883 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 95.49 -55.59 1.71 Allowed Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.817 -0.706 . . . . 10.0 113.071 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 10.2 ptm -64.67 147.73 52.42 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.406 0.622 . . . . 10.0 112.483 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.05 177.88 4.96 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.429 -0.805 . . . . 10.0 110.777 -179.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 69.6 t -59.06 -44.54 91.63 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -55.83 -34.23 65.2 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.32 179.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -68.5 -64.58 0.84 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.675 -178.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 1.2 m -61.69 -38.56 88.29 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.382 0.512 . . . . 10.0 112.382 -179.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.4 -17.55 60.17 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.933 0.716 . . . . 10.0 112.933 -178.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -62.13 -48.88 78.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.95 0.405 . . . . 10.0 109.939 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 3.4 mmmm -67.43 -25.93 66.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.362 179.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -81.67 -18.34 44.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.57 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 16.3 mt -99.26 -47.12 5.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.042 0.448 . . . . 10.0 111.007 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 28.9 mmtp -62.01 -27.49 68.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.898 -0.592 . . . . 10.0 111.061 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 840' ' ' VAL . . . . . 0.446 ' CG2' ' CE2' ' B' ' 40' ' ' TYR . 10.1 p -57.73 -22.84 19.09 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 O-C-N 123.739 0.649 . . . . 10.0 111.208 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 2.5 mtp-105 -120.6 10.15 11.0 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.224 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 73.49 33.35 58.59 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.975 -0.631 . . . . 10.0 112.801 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 90.8 mt -104.93 142.69 34.31 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -108.56 153.82 22.83 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.523 -0.308 . . . . 10.0 111.22 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -76.49 51.36 0.72 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.245 0.545 . . . . 10.0 111.795 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -118.79 -71.74 0.72 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.85 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -92.73 32.45 1.24 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.817 -0.629 . . . . 10.0 111.597 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 36.2 m -125.0 137.84 54.23 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.74 -0.467 . . . . 10.0 109.74 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 4.7 p -126.9 137.8 56.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.622 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 43.4 t -101.58 126.85 55.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 121.066 0.46 . . . . 10.0 111.05 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -109.32 144.74 37.08 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.9 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 27.8 mtm180 -92.13 179.43 5.58 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.252 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.32 56.76 1.17 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.333 0.587 . . . . 10.0 110.455 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 61.4 mt -83.21 100.96 7.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.816 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? 63.8 14.37 8.23 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.938 -0.573 . . . . 10.0 111.302 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 102.62 -13.26 56.62 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 121.067 -0.587 . . . . 10.0 111.92 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -83.05 130.53 35.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.007 0.432 . . . . 10.0 110.649 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -84.07 104.37 14.08 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.102 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.95 136.68 41.36 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.962 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 42.3 t -67.07 126.41 26.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.922 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 5.1 m -119.49 142.85 47.91 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -86.89 162.49 17.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.785 0.326 . . . . 10.0 111.591 -178.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 73.0 m95 -78.97 -25.3 43.49 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.886 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -72.95 -22.94 60.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.705 -0.679 . . . . 10.0 111.319 -179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 5.3 m -62.96 146.19 53.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.388 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -78.0 149.79 34.0 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.107 -0.331 . . . . 10.0 110.107 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 7.9 tp -92.0 -10.41 9.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.111 0.481 . . . . 10.0 111.498 -179.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -55.07 -52.68 69.07 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 113.749 1.018 . . . . 10.0 113.749 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -77.51 9.85 2.73 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 121.864 1.709 . . . . 10.0 113.369 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -104.25 4.7 34.09 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.045 0.387 . . . . 10.0 112.045 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -69.22 104.14 2.12 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.501 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 145.17 -13.55 1.87 Allowed Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.05 -1.071 . . . . 10.0 113.811 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -128.42 -174.85 3.34 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 117.554 0.677 . . . . 10.0 112.201 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -109.33 153.05 24.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.142 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 47.8 mt -121.18 128.53 52.56 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.178 -0.305 . . . . 10.0 110.178 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 2.4 mp -113.65 122.23 67.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.835 0.35 . . . . 10.0 110.806 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 17.6 t -106.42 130.13 58.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.1 163.34 24.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.765 0.317 . . . . 10.0 110.962 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 59.0 t -93.24 130.0 42.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.433 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 49.2 mt . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.551 -0.738 . . . . 10.0 110.46 179.54 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 69.7 mt . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.544 0.211 . . . . 10.0 111.329 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 30.2 ttm180 -66.95 -44.03 81.61 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 178.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -61.07 -44.7 96.97 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 108.362 -0.977 . . . . 10.0 108.362 178.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -59.11 -55.88 29.36 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.225 -0.898 . . . . 10.0 109.892 178.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 81.4 mmm -58.57 -35.18 71.97 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 112.763 0.653 . . . . 10.0 112.763 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 51.1 m -62.07 -38.02 87.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.168 0.508 . . . . 10.0 109.762 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -84.15 -40.43 18.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.004 -0.543 . . . . 10.0 109.539 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -56.61 -51.58 68.13 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.068 179.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 52.8 mt -60.02 -41.72 92.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.928 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -66.67 -49.22 66.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.623 -0.262 . . . . 10.0 110.882 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.04 -43.47 98.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.017 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 41.9 t -67.25 -46.95 82.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.577 0 CA-C-N 116.429 -0.35 . . . . 10.0 111.323 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 53.6 mttm -68.15 -47.46 68.01 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.449 0.537 . . . . 10.0 112.449 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.53 -29.95 71.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.553 0.216 . . . . 10.0 111.285 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -92.8 -26.8 17.54 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 121.142 -0.223 . . . . 10.0 111.563 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 1.1 p -64.0 -28.5 45.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.573 0.225 . . . . 10.0 110.922 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -61.33 -62.13 6.54 Favored Pre-proline 0 CA--C 1.533 0.314 0 N-CA-C 109.487 -0.56 . . . . 10.0 109.487 178.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -62.44 -31.6 80.79 Favored 'Trans proline' 0 C--N 1.359 1.114 0 C-N-CA 121.633 1.555 . . . . 10.0 111.262 177.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 5.5 m-30 -62.53 -53.57 52.82 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 178.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 49.1 mt -68.99 -34.3 75.07 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.763 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -59.93 -45.19 93.4 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.976 -0.749 . . . . 10.0 108.976 178.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -63.88 -43.92 94.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.359 -0.837 . . . . 10.0 109.625 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -63.81 -39.74 94.96 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.681 179.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -65.25 -40.08 93.53 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 178.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 39.1 mttp -63.73 -47.24 81.87 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.562 -0.903 . . . . 10.0 108.562 178.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -58.34 -51.33 70.25 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.543 -0.753 . . . . 10.0 109.446 178.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -56.06 -38.65 70.92 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.956 179.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -45.13 91.02 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -61.31 -48.04 83.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.18 -0.464 . . . . 10.0 109.795 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -61.49 -52.58 63.91 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.865 -0.607 . . . . 10.0 111.075 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 89.4 mmm -62.13 -47.7 83.43 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.549 0.574 . . . . 10.0 112.549 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -59.71 -44.78 93.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.498 0.19 . . . . 10.0 110.601 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 41.4 mt -67.43 -37.33 82.87 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.843 -0.428 . . . . 10.0 109.843 178.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -60.42 -50.52 73.25 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.571 -0.529 . . . . 10.0 109.571 178.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.06 -42.24 98.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.244 179.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -61.62 -23.54 66.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.458 -0.792 . . . . 10.0 110.694 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 14.8 mmtp -94.52 -40.6 9.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.673 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 26.0 t -50.61 -44.38 25.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 O-C-N 123.175 0.297 . . . . 10.0 111.784 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -57.18 -62.18 5.71 Favored Pre-proline 0 CA--C 1.536 0.432 0 N-CA-C 113.041 0.756 . . . . 10.0 113.041 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -67.03 -37.94 17.66 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 121.902 1.735 . . . . 10.0 112.344 179.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 33.7 mt -62.77 -42.45 99.69 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.624 0.249 . . . . 10.0 110.423 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 10.5 ttt180 -64.23 -36.46 84.15 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.14 -0.689 . . . . 10.0 109.14 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.56 -42.85 95.4 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.976 -0.556 . . . . 10.0 109.786 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -64.98 -46.37 81.76 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.59 -0.522 . . . . 10.0 109.59 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 89.0 mt -63.75 -40.66 97.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.119 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.48 -50.35 65.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.188 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -58.78 -46.17 88.15 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.557 -0.534 . . . . 10.0 109.557 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.75 -43.93 97.03 Favored Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 111.101 -0.8 . . . . 10.0 111.101 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.3 -44.23 92.26 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 110.585 -0.154 . . . . 10.0 110.585 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 -56.0 -45.41 79.04 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.829 0.347 . . . . 10.0 110.105 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -68.68 -56.82 6.89 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.692 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 37.3 mttt -55.45 -39.49 70.38 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.203 -0.453 . . . . 10.0 112.131 -179.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 39.4 mt -69.88 -43.51 71.69 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.889 -0.411 . . . . 10.0 109.889 178.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 53.5 t60 -65.9 -39.07 90.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.123 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -61.54 -39.38 90.84 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.739 -0.837 . . . . 10.0 108.739 178.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 59.0 mt -69.06 -38.13 78.92 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.218 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -60.69 -41.47 95.22 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.169 0.509 . . . . 10.0 109.906 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -71.5 -4.68 28.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.269 -0.878 . . . . 10.0 111.276 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 9.4 mmtp -111.2 -43.2 3.77 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 178.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 87.8 mt -60.76 -32.16 71.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.021 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 13.1 m -69.36 -63.46 2.03 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 112.052 0.39 . . . . 10.0 112.052 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.03 -46.81 2.08 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 121.902 1.734 . . . . 10.0 112.942 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 89.5 mt -67.64 -32.6 73.41 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.645 -0.502 . . . . 10.0 109.645 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -69.45 -46.47 55.72 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 109.681 -1.368 . . . . 10.0 109.681 178.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -60.15 -42.34 94.69 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -62.36 -44.06 97.36 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.959 178.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 4.1 tpt -64.83 -37.83 88.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.316 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 47.5 mtt180 -69.31 -38.1 78.09 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -65.73 -45.34 83.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.762 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -68.45 -28.41 67.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.654 -0.703 . . . . 10.0 109.386 178.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -67.47 -34.28 76.84 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.692 -0.855 . . . . 10.0 108.692 177.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 74.4 mtt180 -60.83 -49.54 77.08 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 108.432 -0.951 . . . . 10.0 108.432 177.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -66.62 -39.85 88.5 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.69 178.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -54.29 -54.72 36.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.596 -0.729 . . . . 10.0 110.031 178.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 61.7 t -73.05 -38.21 55.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.534 -0.757 . . . . 10.0 111.968 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -58.88 -53.18 61.26 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 110.392 -0.225 . . . . 10.0 110.392 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -60.97 -31.04 70.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.289 0.566 . . . . 10.0 109.918 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 13.6 mt -71.42 -40.91 70.14 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.732 178.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 84.9 mtt180 -64.22 -43.64 94.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.604 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 2.8 m -65.07 -15.53 62.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.616 179.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 12.0 m80 -101.14 -39.76 7.52 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.22 -0.445 . . . . 10.0 110.322 178.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 47.5 mt -60.96 -40.03 91.8 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.593 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.62 -60.59 8.82 Favored Pre-proline 0 CA--C 1.535 0.381 0 O-C-N 123.135 0.272 . . . . 10.0 111.309 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -66.71 -36.3 25.15 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 121.337 1.358 . . . . 10.0 111.517 178.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 -58.68 -48.74 80.06 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.638 0.256 . . . . 10.0 111.035 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 49.7 p -67.59 -38.62 84.27 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -63.52 -40.93 98.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.194 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -64.36 -40.9 96.76 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 108.276 -1.009 . . . . 10.0 108.276 177.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 68.7 mt -63.25 -33.74 76.14 Favored 'General case' 0 C--O 1.221 -0.412 0 CA-C-N 115.386 -0.824 . . . . 10.0 109.604 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -62.59 -42.49 99.6 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -70.43 -47.51 60.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.942 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -61.55 -48.98 78.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.051 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 49.3 mt -62.35 -34.67 77.11 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 116.539 -0.301 . . . . 10.0 110.477 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.9 -47.26 85.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -63.76 -43.23 97.03 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.03 178.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 3.6 mmt85 -58.97 -52.06 67.38 Favored 'General case' 0 C--O 1.227 -0.108 0 N-CA-C 109.425 -0.583 . . . . 10.0 109.425 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 58.1 mt -63.82 -37.38 87.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.36 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -61.5 -45.14 95.49 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.268 -0.271 . . . . 10.0 110.268 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.17 -39.68 86.48 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 82.2 mt -67.53 -19.56 65.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.579 -0.737 . . . . 10.0 111.084 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 33.9 mtpt -91.47 -46.38 8.02 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.633 -0.506 . . . . 10.0 109.633 178.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -58.8 -53.38 59.05 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.983 -0.747 . . . . 10.0 108.983 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -76.17 -23.6 54.73 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.477 178.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -66.71 -46.09 78.55 Favored Glycine 0 CA--C 1.507 -0.455 0 N-CA-C 111.308 -0.717 . . . . 10.0 111.308 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.95 -38.38 95.95 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 110.113 -1.195 . . . . 10.0 110.113 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.13 -43.13 92.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.072 -0.714 . . . . 10.0 109.072 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 -60.19 -49.96 75.57 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.074 178.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 94.8 mt -60.03 -44.39 94.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.42 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.72 -48.16 80.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.032 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -62.03 -36.6 82.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.295 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -66.97 -38.66 86.48 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.543 -0.54 . . . . 10.0 109.543 178.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 34.5 m-70 -66.02 -39.5 90.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 10.0 109.975 178.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -63.88 -47.12 81.91 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.127 -0.694 . . . . 10.0 109.127 178.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 27.7 mttp -66.85 -33.28 75.26 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.762 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.11 -44.61 79.52 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 56.8 m -61.13 -47.32 86.8 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -61.59 -44.53 96.83 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.905 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.35 -48.28 81.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.154 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 62.7 mt -61.11 -35.57 77.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.574 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 19.2 m -63.9 -51.98 62.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.015 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.36 -30.88 71.76 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.087 0.47 . . . . 10.0 110.098 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 19.4 mt -68.23 -35.4 77.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.423 178.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 26.6 p -67.22 -27.73 67.48 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.561 -0.533 . . . . 10.0 109.561 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -77.23 -0.85 26.8 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 115.613 -0.722 . . . . 10.0 110.068 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -116.78 -42.33 2.98 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.396 -0.82 . . . . 10.0 108.823 178.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -63.29 -21.14 66.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.538 -0.756 . . . . 10.0 111.573 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -104.98 -69.24 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.457 0 N-CA-C 112.172 0.434 . . . . 10.0 112.172 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -66.28 -50.33 1.51 Allowed 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.502 2.134 . . . . 10.0 113.319 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.37 93.95 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.678 0.275 . . . . 10.0 111.74 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 13.8 mt -67.11 -35.99 80.96 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.763 -0.375 . . . . 10.0 110.278 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -66.11 -38.2 87.61 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.527 -0.916 . . . . 10.0 108.527 178.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.04 -43.06 96.69 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 178.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 19.0 mt -62.28 -45.58 92.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.601 -0.727 . . . . 10.0 110.638 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 17.9 mtt180 -67.53 -37.84 83.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.943 0.402 . . . . 10.0 109.941 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -67.27 -16.92 64.56 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 115.569 -0.741 . . . . 20.0 111.34 178.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -96.3 -40.36 3.99 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 108.746 -1.742 . . . . 10.0 108.746 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 62.4 mt -58.24 -36.84 73.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.66 -0.27 . . . . 10.0 111.672 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 96.1 mt -59.65 -63.8 3.78 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 120.925 -0.31 . . . . 10.0 111.364 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -61.83 -35.14 80.3 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 121.994 1.796 . . . . 10.0 111.676 178.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 6.1 t -61.26 -49.5 84.33 Favored 'Isoleucine or valine' 0 C--O 1.231 0.108 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 178.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 34.3 mt -63.06 -33.66 75.92 Favored 'General case' 0 C--O 1.224 -0.255 0 N-CA-C 109.759 -0.459 . . . . 10.0 109.759 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.51 -55.51 30.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.017 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.3 p -63.37 -35.45 80.44 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.006 0.432 . . . . 10.0 110.136 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.9 m-30 -63.76 -47.33 81.39 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.144 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -57.8 -40.5 80.07 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 68.8 t -58.09 -50.82 76.86 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.103 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.844 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -66.45 -34.63 78.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.731 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 22.0 m-30 -69.34 -45.58 69.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.904 0.383 . . . . 10.0 110.109 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.45 -38.02 89.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.223 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 3.4 p -74.71 -31.89 61.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.8 0.333 . . . . 10.0 110.906 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -71.16 -34.89 71.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.367 179.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 87.3 mt -59.37 -37.19 77.28 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.256 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -64.43 -45.3 88.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.469 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -61.12 -49.95 75.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.518 -0.765 . . . . 10.0 111.609 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -57.4 -43.87 84.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.708 0.29 . . . . 10.0 111.228 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 27.5 m -63.98 -50.26 69.28 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.277 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.864 -179.47 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 92.7 mt . . . . . 0 CA--C 1.522 -0.1 0 CA-C-O 120.995 0.426 . . . . 10.0 110.277 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 85.2 mt -71.67 -31.51 66.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.395 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -67.32 -45.98 74.85 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.892 -0.781 . . . . 10.0 108.892 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -64.31 -40.32 95.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.439 178.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -35.85 79.6 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.328 179.132 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -60.55 -49.18 78.59 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.008 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 1.1 m -59.27 -42.14 90.51 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.936 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 70.8 t -64.41 -44.22 97.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.316 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 30.0 m -62.4 -45.99 90.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.396 -0.366 . . . . 10.0 110.496 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 25.2 m -63.17 -45.55 91.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.467 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 12.8 p -67.14 -36.94 82.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.698 0.285 . . . . 10.0 111.11 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -67.87 -39.72 83.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.994 179.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 47.4 m -64.34 -43.28 95.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.307 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -66.14 -32.42 73.86 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.245 0.545 . . . . 10.0 109.969 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 7.7 mt -65.62 -44.24 87.1 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.067 -0.716 . . . . 10.0 109.067 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -65.6 -34.3 77.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.259 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.58 -40.69 93.04 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -67.56 -33.91 75.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.862 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 85.7 mt -62.11 -12.84 21.58 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-N 115.722 -0.672 . . . . 10.0 111.867 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -74.32 -75.72 0.76 Allowed Glycine 0 CA--C 1.522 0.509 0 C-N-CA 120.494 -0.86 . . . . 10.0 111.058 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -58.33 -39.6 82.82 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 123.12 2.547 . . . . 10.0 112.612 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 49.0 t -59.89 -43.12 91.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 87.8 m -68.44 -39.19 81.59 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.823 -0.436 . . . . 10.0 109.823 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -61.1 -48.31 82.27 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -62.69 -47.72 82.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.36 -0.837 . . . . 10.0 109.783 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -57.59 -41.12 80.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.3 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -67.84 -42.36 81.55 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.175 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -63.59 -37.75 88.5 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.321 -0.622 . . . . 10.0 109.321 179.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -67.84 -43.39 79.62 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.486 -0.779 . . . . 10.0 108.96 178.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 30.5 mt -61.28 -36.57 80.42 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.915 -0.584 . . . . 10.0 109.74 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -67.4 -33.87 76.08 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.241 178.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 56.9 mttp -67.59 -47.78 68.75 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.028 -1.101 . . . . 10.0 108.028 177.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -59.72 -47.6 85.01 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 114.951 -1.022 . . . . 10.0 111.106 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 2.8 p -63.41 -37.37 87.02 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.599 0.238 . . . . 10.0 110.825 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -62.98 -49.51 74.41 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.753 -0.832 . . . . 10.0 108.753 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.48 -46.38 93.94 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.885 -0.886 . . . . 10.0 110.885 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 59.2 mt -59.27 -34.12 71.88 Favored 'General case' 0 C--O 1.222 -0.385 0 CA-C-O 120.503 0.192 . . . . 10.0 110.564 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 52.3 mtt85 -69.24 -36.49 77.23 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 178.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -72.11 -33.02 67.51 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.997 -0.742 . . . . 10.0 108.997 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -71.06 -53.39 14.86 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.182 -0.917 . . . . 10.0 109.197 178.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 64.1 mtt -65.58 -29.16 69.73 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.616 0.969 . . . . 10.0 113.616 -178.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 1.8 p -61.17 -47.46 86.08 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.018 -0.673 . . . . 10.0 109.442 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -78.07 -39.61 41.11 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.954 -0.567 . . . . 10.0 109.855 178.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -56.04 -60.32 3.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.095 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 96.0 mt -60.31 -41.97 94.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.954 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.91 -39.79 90.89 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.851 -0.339 . . . . 10.0 110.91 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.67 -38.08 80.11 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.739 -0.838 . . . . 10.0 108.739 178.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 8.9 t -58.98 -43.42 88.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.292 0 CA-C-N 115.753 -0.658 . . . . 10.0 109.232 178.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -65.97 -40.77 91.54 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 178.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -74.48 -3.97 33.93 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.491 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -106.34 -42.94 4.91 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.412 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 31.3 t -61.77 -41.47 90.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.678 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -55.41 -60.48 8.27 Favored Pre-proline 0 CA--C 1.536 0.433 0 O-C-N 123.164 0.29 . . . . 10.0 111.461 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -67.74 -26.46 38.93 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 122.106 1.871 . . . . 10.0 111.334 178.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -53.11 54.33 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 179.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 68.1 mt -66.31 -38.3 87.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.729 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -59.57 -44.9 93.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.327 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -78.96 -33.6 45.09 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.917 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.85 -43.4 98.91 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 178.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -63.66 -42.18 98.11 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 123.368 0.417 . . . . 10.0 110.051 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -58.8 -43.09 90.42 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.213 0.53 . . . . 10.0 109.621 178.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -72.72 -40.6 65.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.306 -0.861 . . . . 10.0 110.436 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 1.2 m95 -62.49 -38.81 91.35 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.337 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -67.72 -42.97 81.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.161 178.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -62.61 -35.53 79.85 Favored 'General case' 0 C--N 1.333 -0.117 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -76.73 -48.21 19.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.148 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 9.8 ttt -61.4 -57.06 13.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.001 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -65.56 -38.67 90.25 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.252 -0.647 . . . . 10.0 109.252 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 96.4 mt -59.34 -36.27 75.39 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.358 -0.837 . . . . 20.0 109.925 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . 0.403 ' O ' ' N ' ' C' ' 474' ' ' VAL . 3.2 m-30 -77.19 -39.38 48.99 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.62 178.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -60.98 -38.65 86.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.996 0.427 . . . . 10.0 110.189 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -81.4 6.74 13.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.536 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 51.3 mttp -123.0 -50.29 1.93 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.277 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . 0.403 ' N ' ' O ' ' C' ' 470' ' ' TYR . 78.0 t -61.12 -36.89 75.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.691 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.28 -59.49 10.84 Favored Pre-proline 0 CA--C 1.534 0.327 0 N-CA-C 111.758 0.281 . . . . 10.0 111.758 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -60.96 -37.39 77.24 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 121.584 1.523 . . . . 10.0 111.051 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 38.5 mt -67.06 -33.85 76.4 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.006 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 24.9 mtt180 -63.55 -38.61 91.78 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 178.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -64.98 -45.76 84.27 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 178.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.68 -44.18 94.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.716 178.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 63.3 mt -65.92 -41.82 90.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.922 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -63.72 -49.68 72.11 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -65.06 -42.13 94.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.928 0.394 . . . . 10.0 110.278 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.54 -36.42 93.33 Favored Glycine 0 N--CA 1.447 -0.615 0 N-CA-C 111.011 -0.835 . . . . 10.0 111.011 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -76.12 -39.84 54.19 Favored 'General case' 0 C--O 1.219 -0.511 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 63.2 mtt180 -61.89 -43.78 98.16 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.978 -0.749 . . . . 10.0 108.978 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -65.74 -40.06 91.76 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 108.812 -0.81 . . . . 10.0 108.812 178.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -65.77 -34.81 79.04 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 109.614 -0.514 . . . . 10.0 109.614 178.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 57.9 mt -65.48 -41.44 93.29 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.728 -0.841 . . . . 10.0 108.728 178.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -68.55 -40.44 80.65 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.722 -0.844 . . . . 10.0 108.722 178.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -60.29 -44.26 95.52 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 108.521 -0.918 . . . . 10.0 108.521 177.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 46.7 mt -69.87 -33.06 71.73 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.854 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -61.09 -40.14 92.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.924 0.393 . . . . 10.0 110.56 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -79.57 11.66 2.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.586 0.708 . . . . 10.0 110.36 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -125.59 -57.6 1.45 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.628 -0.715 . . . . 10.0 109.806 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 90.2 mt -60.71 -35.22 75.77 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.443 0.534 . . . . 10.0 112.443 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 6.8 m -76.13 -62.84 0.67 Allowed Pre-proline 0 CA--C 1.538 0.517 0 C-N-CA 121.052 -0.259 . . . . 10.0 111.457 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.73 -54.54 2.76 Favored 'Trans proline' 0 C--N 1.357 1.015 0 C-N-CA 122.077 1.851 . . . . 10.0 111.787 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 48.1 mt -65.92 -27.58 68.3 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 109.926 -0.398 . . . . 10.0 109.926 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -65.86 -47.12 77.89 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 110.127 -1.189 . . . . 10.0 110.127 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -64.8 -39.46 93.62 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.879 -0.785 . . . . 10.0 108.879 178.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -61.72 -52.39 64.46 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.64 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 88.0 mmm -58.87 -38.16 78.15 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.359 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -63.79 -45.57 89.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.853 0.359 . . . . 10.0 110.262 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -68.17 -45.52 73.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.696 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -63.73 -43.1 97.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.243 179.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -65.14 -33.42 75.97 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 177.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -62.94 -43.92 97.48 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 108.685 -0.858 . . . . 10.0 108.685 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -65.74 -33.45 75.9 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.657 -0.702 . . . . 10.0 109.36 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -66.76 -51.12 59.55 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.103 -0.703 . . . . 10.0 109.103 178.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 95.9 t -64.25 -42.33 95.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.659 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -61.95 -39.01 90.64 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -64.98 -40.22 94.65 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.332 -0.988 . . . . 10.0 108.332 177.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 87.6 mt -62.29 -29.71 70.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.472 178.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -66.11 -30.68 71.22 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.396 -0.594 . . . . 10.0 109.396 178.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.4 10.94 33.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.605 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 42.6 m170 -122.82 -49.64 1.98 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.332 -0.395 . . . . 10.0 111.435 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 89.8 mt -86.62 -42.77 13.18 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -56.18 -56.3 32.66 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 111.793 0.294 . . . . 10.0 111.793 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -62.99 -29.89 76.05 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 121.857 1.704 . . . . 10.0 110.627 178.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.28 -39.63 94.32 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 15.8 m -62.52 -40.56 97.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.669 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.68 -47.58 74.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.392 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -65.01 -37.08 86.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.615 -0.72 . . . . 10.0 110.804 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 23.8 mt -64.11 -38.41 90.95 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.117 -0.698 . . . . 10.0 109.117 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 50.6 mtt85 -62.94 -37.5 87.28 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.069 178.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -59.87 -42.92 94.78 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 10.0 mtt180 -74.0 -44.44 54.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.103 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 68.0 mt -58.38 -38.82 78.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.031 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.6 -40.15 96.03 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.407 -0.361 . . . . 10.0 110.331 179.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.75 -41.33 79.08 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.127 -0.694 . . . . 10.0 109.127 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 19.1 ttm180 -60.18 -42.29 94.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.357 -0.838 . . . . 10.0 109.108 178.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.68 -32.39 73.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.626 -0.716 . . . . 10.0 110.48 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -67.38 -44.65 78.39 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.57 -39.67 94.98 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.226 178.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 93.8 mt -68.7 -22.73 64.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.748 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -83.15 -47.25 11.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.289 -0.414 . . . . 10.0 109.972 179.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -64.69 -53.73 42.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.184 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -68.13 -43.28 78.72 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.311 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -58.49 -51.12 60.66 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.964 -0.636 . . . . 10.0 111.821 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.43 -41.88 99.74 Favored Glycine 0 N--CA 1.451 -0.361 0 N-CA-C 111.677 -0.569 . . . . 10.0 111.677 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -64.14 -50.35 68.56 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.982 -0.377 . . . . 10.0 109.982 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 50.9 mtt180 -58.3 -35.55 72.0 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.624 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 33.2 mt -62.19 -47.09 86.03 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.696 -0.483 . . . . 10.0 109.696 178.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -64.45 -39.53 93.99 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.89 -0.596 . . . . 10.0 109.635 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 78.9 mt-10 -65.46 -47.69 75.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.777 178.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 15.7 m-30 -60.03 -40.86 90.8 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.323 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 29.8 m-70 -62.63 -46.14 89.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.827 0.346 . . . . 10.0 110.378 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.06 -47.5 77.11 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.354 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.39 -32.24 73.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.636 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.22 -37.1 80.5 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 23.1 m -66.2 -47.44 73.87 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.398 -0.964 . . . . 10.0 108.398 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -61.85 -33.98 75.16 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.717 -0.674 . . . . 10.0 109.521 178.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -74.0 -33.62 63.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.141 179.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 44.0 mt -69.34 -44.02 72.47 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.78 -0.452 . . . . 10.0 109.78 178.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 10.1 m -61.97 -40.73 96.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.471 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 4.6 p -72.87 -17.57 61.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.247 0.546 . . . . 10.0 110.526 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 15.6 mt -87.09 -40.2 14.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.858 -0.61 . . . . 10.0 109.513 178.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.5 p -67.26 -28.03 67.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.217 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -72.75 -5.49 38.16 Favored 'General case' 0 C--N 1.339 0.12 0 CA-C-O 121.405 0.621 . . . . 10.0 110.106 178.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -116.79 -39.3 3.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.241 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -65.87 -16.58 63.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.856 -0.611 . . . . 10.0 111.179 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -103.59 -70.29 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.409 0 CA-C-O 119.311 -0.376 . . . . 10.0 111.199 178.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -64.04 -49.75 3.58 Favored 'Trans proline' 0 C--N 1.36 1.154 0 C-N-CA 122.405 2.07 . . . . 10.0 113.263 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.58 -38.95 92.78 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 121.14 -0.224 . . . . 10.0 111.54 -179.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 7.1 mt -66.64 -38.62 87.26 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -66.63 -36.87 83.62 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 178.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.62 -47.28 84.45 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.742 -0.836 . . . . 10.0 108.742 177.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 89.4 mt -61.59 -40.89 96.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.455 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -65.62 -46.93 77.41 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.015 -0.365 . . . . 10.0 110.015 178.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -65.86 -22.74 66.55 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 115.788 -0.642 . . . . 20.0 111.983 179.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -86.15 -40.09 7.64 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 109.189 -1.564 . . . . 10.0 109.189 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 29.8 mt -64.88 -32.13 73.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.579 -0.31 . . . . 10.0 111.624 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 35.7 mt -54.35 -62.28 4.22 Favored Pre-proline 0 CA--C 1.54 0.581 0 N-CA-C 112.357 0.502 . . . . 10.0 112.357 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -66.05 -31.09 46.72 Favored 'Trans proline' 0 C--N 1.357 0.974 0 C-N-CA 121.966 1.777 . . . . 10.0 111.001 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 11.6 t -64.65 -46.37 92.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.058 -0.519 . . . . 10.0 109.828 179.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 46.3 mt -64.71 -38.6 91.54 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -60.17 -50.84 72.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.55 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 2.7 p -68.27 -38.13 81.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.678 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -60.21 -44.44 95.14 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.246 178.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -62.1 -36.89 83.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.654 178.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 53.2 t -62.29 -46.3 96.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 178.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.63 -34.29 77.88 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.352 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -69.38 -44.44 71.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.287 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 88.0 mt -57.29 -47.2 82.06 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.538 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 1.9 p -68.81 -46.15 69.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.613 179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -57.8 -54.0 51.88 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.441 -0.345 . . . . 10.0 111.743 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 88.9 mt -57.66 -41.06 80.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.804 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -71.4 -51.59 23.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.583 -0.28 . . . . 10.0 111.725 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -62.24 -40.69 97.0 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.944 0.35 . . . . 10.0 111.944 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -64.46 -48.74 74.14 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.919 0.34 . . . . 10.0 111.919 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 11.8 p -63.18 -36.48 83.76 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 111.949 0.352 . . . . 10.0 111.949 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -63.8 -28.55 69.94 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.453 -0.34 . . . . 10.0 111.092 179.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -95.15 -15.49 23.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.428 -0.351 . . . . 10.0 111.504 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 60.9 mt -80.19 -25.07 39.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.293 -0.412 . . . . 10.0 111.381 179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.793 -0.623 . . . . 10.0 109.759 179.989 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 121.027 0.441 . . . . 10.0 111.317 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -115.32 130.61 56.95 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.047 -0.723 . . . . 10.0 109.047 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -122.26 136.38 54.89 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.851 0.357 . . . . 10.0 110.91 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt -107.52 114.37 28.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.372 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 14.2 mt -109.47 132.1 54.45 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.389 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 67.2 t -121.44 125.92 74.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.965 0.412 . . . . 10.0 110.916 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 3.6 t -93.19 113.14 27.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 20.9 m -96.72 168.43 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.993 0.425 . . . . 10.0 111.801 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 131.65 161.0 9.99 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 110.873 -0.891 . . . . 10.0 110.873 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.12 -140.55 0.07 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.891 0.376 . . . . 10.0 110.89 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -101.69 159.51 18.33 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.69 -0.767 . . . . 10.0 111.684 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.97 -24.54 15.13 Favored Glycine 0 CA--C 1.519 0.311 0 C-N-CA 121.048 -0.596 . . . . 10.0 113.004 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 3.3 m -60.65 -50.74 79.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 112.317 0.488 . . . . 10.0 112.317 -179.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 105.23 35.84 3.04 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.783 -0.722 . . . . 10.0 113.351 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -59.49 -54.06 50.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.166 0.508 . . . . 10.0 111.255 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.62 -37.65 76.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.593 -0.731 . . . . 10.0 111.863 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.72 -44.79 92.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.339 -0.392 . . . . 10.0 110.997 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 99.1 mt -66.98 -33.26 75.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.055 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.1 m -71.15 -49.55 42.81 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.991 -0.549 . . . . 10.0 111.357 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 85.2 mt -63.31 -29.97 48.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.184 0.516 . . . . 10.0 110.43 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -66.75 -16.78 64.49 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.623 -0.717 . . . . 10.0 111.107 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 18.7 tp -106.5 -31.45 8.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.07 0.462 . . . . 10.0 110.901 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 51.1 mm -76.04 -49.6 25.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.704 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -115.35 -8.97 12.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.764 0.316 . . . . 10.0 111.201 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 20.8 m120 65.83 41.53 3.8 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.317 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -133.75 142.79 48.09 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.018 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -99.97 137.23 38.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.491 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 19.1 m -89.87 159.55 2.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.906 0.384 . . . . 10.0 111.558 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -121.73 -19.92 6.63 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.351 0.596 . . . . 10.0 110.256 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -93.47 156.9 16.49 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.271 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -86.28 104.83 16.18 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 110.111 -0.329 . . . . 10.0 110.111 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -77.54 115.77 52.43 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.757 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -78.31 62.59 8.16 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 123.24 2.626 . . . . 10.0 110.47 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.01 130.97 49.08 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.291 -0.868 . . . . 10.0 112.118 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 74.3 mt -121.42 -53.12 3.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.106 -0.952 . . . . 10.0 108.566 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.28 104.79 3.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.514 -0.767 . . . . 10.0 109.345 179.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -159.0 137.5 10.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.423 -0.353 . . . . 10.0 111.269 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 15.4 m -135.76 149.63 49.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.812 0.339 . . . . 10.0 111.137 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -126.07 142.31 51.57 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 30.2 ttp180 -129.06 133.05 47.54 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 111.838 0.31 . . . . 10.0 111.838 -178.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 30.1 mtpt -143.56 175.0 10.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.872 -0.604 . . . . 10.0 110.417 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -115.11 120.27 39.23 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 39.2 t -131.01 132.93 63.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.67 0.272 . . . . 10.0 110.651 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 38.9 t -78.61 111.66 15.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 108.635 -0.876 . . . . 10.0 108.635 178.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 38.3 mt -114.28 117.7 56.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 120.883 0.373 . . . . 10.0 111.17 -178.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.9 m-20 59.85 32.08 21.08 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.476 -0.783 . . . . 10.0 111.076 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.07 -29.93 7.13 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.69 -0.687 . . . . 10.0 113.004 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -84.8 146.59 27.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.906 0.384 . . . . 10.0 111.286 -179.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 14.8 t -102.86 139.19 38.75 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.899 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 3.0 p -154.12 158.45 40.44 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.316 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 96.6 mt -93.67 120.56 34.1 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.235 -0.654 . . . . 10.0 109.235 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 63.7 mt -105.86 124.19 49.18 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.533 0.568 . . . . 10.0 112.533 -178.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -107.77 110.49 22.32 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 107.591 -1.262 . . . . 10.0 107.591 177.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 22.8 mt -99.94 114.92 39.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 120.836 0.35 . . . . 10.0 111.489 -178.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 26.4 tp -94.49 112.13 23.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.931 -0.577 . . . . 10.0 111.147 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -93.67 94.83 8.81 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 178.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 37.6 p -67.51 161.74 24.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.174 -0.921 . . . . 10.0 113.157 -177.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.61 165.24 12.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.578 -0.737 . . . . 10.0 111.112 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -84.28 -80.72 1.05 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.832 -0.699 . . . . 10.0 111.957 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -92.35 114.42 26.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.841 0.353 . . . . 20.0 110.718 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -150.05 160.93 43.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.493 -0.321 . . . . 10.0 110.22 -179.546 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 55.7 mm-40 -106.45 -170.61 1.75 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.009 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -80.12 76.75 6.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.201 0.524 . . . . 10.0 111.195 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.39 147.72 23.91 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.821 179.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.29 -35.63 77.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.9 0.381 . . . . 10.0 110.997 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 27.7 ttt -62.42 -37.02 84.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.794 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 55.8 ttt85 -60.95 -51.8 67.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.815 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.05 -35.35 78.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.776 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -61.17 -41.14 96.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.595 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 2.5 p90 -84.09 -24.71 30.23 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 112.837 0.68 . . . . 10.0 112.837 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 53.1 mmm -76.36 -24.56 54.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.069 0.461 . . . . 10.0 111.242 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -79.73 -0.3 33.61 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.675 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.58 2.05 44.31 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.735 0.643 . . . . 10.0 112.735 -179.2 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -107.06 152.57 16.89 Favored Glycine 0 N--CA 1.454 -0.154 0 C-N-CA 120.248 -0.977 . . . . 10.0 113.108 -179.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -99.86 -60.6 1.5 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.964 0.411 . . . . 10.0 110.19 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -99.79 139.59 14.5 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.654 -0.703 . . . . 10.0 111.993 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -125.26 131.08 53.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.925 0.393 . . . . 10.0 111.082 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 77.6 mt -99.88 122.46 42.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.977 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 32.5 m -95.37 86.24 4.46 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.816 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 22.0 t -87.29 122.82 39.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.243 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -130.04 169.3 15.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.41 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -104.94 123.16 47.28 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.504 179.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 2.3 pp -68.29 -10.97 13.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 112.01 0.374 . . . . 10.0 112.01 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -102.95 10.96 37.97 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.373 -0.376 . . . . 10.0 111.46 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -136.83 104.29 5.45 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.93 -38.21 75.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.791 -0.64 . . . . 10.0 112.008 -178.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -63.0 -39.48 94.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.702 0.287 . . . . 10.0 110.992 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 24.0 t -60.19 -37.56 80.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.969 -0.559 . . . . 10.0 110.644 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -71.21 -39.28 71.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.395 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -66.86 -33.38 75.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.003 0.43 . . . . 10.0 111.145 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.24 -8.23 53.66 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.283 0.475 . . . . 10.0 112.283 -178.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 25.8 mm -60.84 -35.83 67.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.109 0.48 . . . . 10.0 110.04 178.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 6.6 t-80 -68.63 -29.95 68.55 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -68.86 -44.12 74.01 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.091 -0.707 . . . . 10.0 109.091 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -64.41 -43.87 93.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.6 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -54.87 -51.78 64.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.268 -0.878 . . . . 10.0 111.181 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -66.93 -37.39 84.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.354 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -60.35 -46.94 88.13 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.484 -0.325 . . . . 10.0 110.213 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 52.6 mt -66.69 -43.34 90.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.815 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 33.7 mtpt -59.0 -35.98 74.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.856 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 45.9 ttp85 -77.05 -46.38 23.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.872 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 21.1 m -63.39 -28.17 44.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -95.03 -11.53 28.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.53 -0.305 . . . . 10.0 111.004 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 16.9 t70 60.73 21.06 11.09 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.383 0.611 . . . . 10.0 111.099 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 14.0 m -144.74 140.38 28.49 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.268 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 -84.95 -20.0 31.29 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.317 0.58 . . . . 10.0 109.849 179.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -89.16 78.01 7.44 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.233 -0.894 . . . . 10.0 110.322 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 89.5 t -127.07 130.63 23.73 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.529 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -64.74 112.36 1.96 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.967 2.445 . . . . 10.0 111.607 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 54.1 mtt -130.21 158.27 40.19 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.598 -0.519 . . . . 10.0 109.598 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 84.3 t -137.31 129.72 42.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 15.2 tp -82.44 117.74 22.7 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.808 -0.812 . . . . 10.0 108.808 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 38.7 t -109.75 111.49 36.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 120.94 0.4 . . . . 10.0 111.984 -178.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -91.86 88.08 1.33 Allowed Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 110.375 -1.09 . . . . 10.0 110.375 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -87.46 162.9 17.01 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 -178.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 28.3 mttm 67.72 32.84 5.2 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.242 -0.89 . . . . 10.0 111.731 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 28.0 p -85.8 6.71 26.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.288 0.566 . . . . 10.0 110.32 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.69 -21.73 26.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.987 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 82.3 mt -77.61 142.17 65.91 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.429 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.35 -19.91 55.43 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.945 2.43 . . . . 10.0 112.151 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 1.7 m -83.04 105.19 13.82 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 179.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -127.72 109.91 12.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.968 0.413 . . . . 10.0 111.657 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.05 -42.08 9.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.053 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 30.2 t -87.36 115.44 27.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.685 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -80.16 154.29 28.09 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.289 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.9 m -60.23 -33.92 72.95 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.694 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -61.88 -37.72 85.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.061 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -68.18 -41.63 81.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.179 0.514 . . . . 10.0 110.084 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.99 -48.11 69.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.286 -0.87 . . . . 10.0 111.482 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -61.81 -38.03 86.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.956 0.408 . . . . 10.0 110.53 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -62.06 -51.5 67.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.744 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 55.6 tp -64.59 -41.77 96.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.003 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.76 -41.21 95.01 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.686 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -63.39 -40.23 96.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.41 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 12.9 m -66.03 -37.76 86.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.646 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 7.3 m-30 -73.87 -29.63 62.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.701 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 88.71 28.39 21.7 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 110.643 -0.983 . . . . 10.0 110.643 -178.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 46.0 pt -126.41 154.55 74.95 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.439 -0.38 . . . . 10.0 110.461 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.21 157.05 29.85 Favored 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.448 2.098 . . . . 10.0 111.756 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -119.57 126.89 52.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.606 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 36.6 mm -124.41 128.24 73.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.361 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -87.87 125.94 34.76 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.37 -0.974 . . . . 10.0 108.37 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 40.6 p -123.3 138.13 54.69 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 113.323 0.86 . . . . 10.0 113.323 -177.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 7.7 t -107.47 125.17 50.92 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.094 -1.076 . . . . 10.0 108.094 178.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.24 -26.44 52.6 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.233 0.54 . . . . 10.0 110.41 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 46.5 tttp -77.26 -48.29 17.89 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.504 -0.771 . . . . 10.0 112.787 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 72.3 p -98.2 -10.99 23.21 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.629 0.603 . . . . 10.0 112.629 -178.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 15.2 mtp-105 70.95 13.87 6.95 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 122.823 0.449 . . . . 10.0 111.329 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -62.93 123.52 18.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.306 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 81.06 -13.78 30.29 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.938 -0.574 . . . . 10.0 113.97 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 86.9 t -61.71 -42.84 95.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.436 0.532 . . . . 10.0 112.436 -178.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -66.75 -48.26 69.67 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.852 0.316 . . . . 10.0 111.852 -179.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -66.77 -26.34 66.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.433 -0.349 . . . . 10.0 111.606 -179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.8 -47.69 85.19 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.966 0.413 . . . . 10.0 110.034 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -66.57 -40.14 88.82 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.958 178.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 19.3 m-30 -63.45 -45.39 91.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.065 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 69.8 m -57.79 -41.92 83.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.81 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 41.5 tp -57.66 -47.59 81.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.448 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.31 -36.42 76.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.232 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 77.7 mtt180 -66.8 -38.0 85.64 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.509 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -65.05 -40.85 95.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.834 178.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 70.7 mt -61.25 -40.99 87.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.98 179.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.93 -40.0 95.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.038 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 28.5 mtmt -61.34 -33.62 73.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.097 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 24.3 t-80 -65.0 -39.11 92.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.066 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -69.01 -45.61 70.08 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.963 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -65.86 -47.03 76.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.963 -0.562 . . . . 10.0 111.938 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 54.5 tttm -56.66 -45.16 81.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.671 0.272 . . . . 10.0 111.533 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -65.85 -26.18 67.54 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 111.899 0.333 . . . . 10.0 111.899 -179.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 14.7 m . . . . . 0 C--N 1.326 -0.444 0 CA-C-O 120.808 0.337 . . . . 10.0 111.794 -179.47 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.44 0 N-CA-C 111.955 -0.458 . . . . 10.0 111.955 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 6.7 p -123.59 135.47 53.99 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.709 0.29 . . . . 10.0 110.972 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 6.8 t -118.5 133.85 64.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 110.206 -0.294 . . . . 10.0 110.206 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 14.9 mtmt -87.69 112.92 22.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.485 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 39.1 t -91.52 124.78 44.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 109.736 -0.468 . . . . 10.0 109.736 179.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -88.97 115.01 26.22 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.765 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 83.0 mt -88.86 143.01 30.94 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.272 -179.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -68.44 -9.26 25.45 Favored 'Trans proline' 0 N--CA 1.476 0.451 0 C-N-CA 123.213 2.609 . . . . 10.0 112.666 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -88.39 18.59 4.37 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.735 -0.468 . . . . 10.0 109.735 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 26.4 mttt 61.87 47.29 6.14 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.547 0.689 . . . . 10.0 110.838 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -146.1 -177.19 5.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.758 -1.11 . . . . 10.0 108.639 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.92 165.23 37.35 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.952 -0.299 . . . . 10.0 111.351 -179.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 9.7 t -151.21 152.29 33.07 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.584 179.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 90.1 t -112.82 120.34 62.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 120.971 0.415 . . . . 10.0 110.934 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 31.3 m -113.13 157.51 13.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.612 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.21 133.09 35.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.621 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 13.1 t -86.98 109.29 18.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.556 -0.293 . . . . 10.0 110.328 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 -127.47 150.38 49.68 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -79.76 164.19 23.88 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 120.886 0.374 . . . . 10.0 110.696 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 89.25 -56.73 3.95 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 121.041 -0.599 . . . . 10.0 112.591 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 16.4 ptm -65.36 139.92 58.61 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.11 0.481 . . . . 10.0 111.268 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.3 172.99 8.04 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.611 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 90.5 t -60.83 -35.52 65.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.119 -0.697 . . . . 10.0 109.119 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -58.68 -38.37 78.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.514 -0.766 . . . . 10.0 110.255 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -67.04 -58.49 4.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.958 -0.564 . . . . 10.0 111.444 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 1.3 m -61.27 -42.62 98.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.705 -0.68 . . . . 10.0 112.747 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.68 -24.14 59.92 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.96 0.356 . . . . 10.0 111.96 -179.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -59.45 -49.67 76.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.978 0.418 . . . . 10.0 110.605 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -60.69 -32.96 72.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.532 -0.758 . . . . 10.0 111.523 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -78.89 -33.4 45.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.774 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 90.1 mt -81.82 -43.79 17.8 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -179.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 5.3 mmtp -61.79 -36.71 81.88 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 -179.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 3.4 p -72.49 -14.19 16.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.063 0.459 . . . . 10.0 111.459 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 -105.02 -6.58 19.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.215 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 83.9 26.59 40.86 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.803 -0.713 . . . . 10.0 112.478 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 8.1 mp -117.5 158.5 24.42 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.101 -0.333 . . . . 10.0 110.101 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -123.99 164.27 19.69 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -79.32 50.07 1.05 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.897 0.38 . . . . 10.0 110.562 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -102.8 -74.57 0.63 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.462 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 75.3 m -87.03 -16.96 34.09 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.793 -0.639 . . . . 10.0 111.237 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 29.3 m -66.85 134.31 51.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.207 -0.452 . . . . 10.0 111.355 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 7.0 p -130.81 140.42 48.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.452 -0.573 . . . . 10.0 109.452 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 15.4 t -109.67 131.82 59.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.098 0.475 . . . . 10.0 111.584 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -117.48 157.21 26.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.356 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -110.35 153.79 24.44 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.021 -0.733 . . . . 10.0 109.021 178.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 27.3 mt -105.04 51.86 0.75 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.853 0.359 . . . . 10.0 111.856 -178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 18.1 mt -72.29 86.95 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.398 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt 67.29 41.16 2.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.963 -1.017 . . . . 10.0 112.377 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 86.42 -33.17 3.71 Favored Glycine 0 C--N 1.332 0.312 0 CA-C-N 115.914 -0.584 . . . . 10.0 113.852 178.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 23.1 mmt-85 -70.58 114.34 8.58 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.783 0.325 . . . . 10.0 111.376 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.94 100.14 0.7 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.804 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 1.4 m -97.38 112.73 24.43 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.105 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 2.0 t -58.17 150.88 4.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.989 -0.551 . . . . 10.0 110.799 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 4.3 t -137.53 166.72 23.22 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.34 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -106.67 160.25 15.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.681 0.277 . . . . 10.0 110.701 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 73.3 m95 -76.86 -27.65 55.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.014 0.435 . . . . 10.0 110.688 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.33 -36.44 82.19 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.385 -0.825 . . . . 10.0 111.688 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.52 142.16 40.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.928 -0.578 . . . . 10.0 111.53 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -78.16 162.12 26.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.831 -0.433 . . . . 10.0 109.831 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 8.3 tp -87.7 1.66 6.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.118 0.485 . . . . 10.0 111.242 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -60.17 -53.21 67.21 Favored Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 113.688 0.995 . . . . 10.0 113.688 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.68 18.29 1.0 Allowed 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.222 1.948 . . . . 10.0 112.974 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -106.99 20.57 18.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.386 0.612 . . . . 10.0 110.585 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -67.0 107.68 2.34 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.902 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 89.96 15.13 58.29 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.877 -0.677 . . . . 10.0 112.214 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -102.11 148.91 24.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.511 0.196 . . . . 10.0 110.544 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -105.88 109.38 21.31 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 62.3 mt -87.26 118.21 26.53 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.286 0.476 . . . . 10.0 112.286 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 32.3 mt -103.18 114.59 43.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.499 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 18.6 t -102.83 126.31 57.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.978 -0.379 . . . . 10.0 109.978 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -123.66 164.86 18.24 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.162 179.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 48.5 t -112.13 108.63 26.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.856 0.36 . . . . 10.0 110.182 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 68.3 mt . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.266 -0.873 . . . . 10.0 109.798 179.288 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 28.6 mt . . . . . 0 C--O 1.219 -0.517 0 CA-C-O 120.282 0.086 . . . . 10.0 110.96 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 59.5 mtt180 -66.96 -42.14 85.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.934 0.397 . . . . 10.0 110.141 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -67.47 -43.25 81.45 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.108 -0.701 . . . . 10.0 109.108 178.374 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -64.42 -44.95 89.62 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 115.441 -0.799 . . . . 10.0 109.965 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 27.6 mmm -61.7 -30.48 70.78 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.337 179.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 70.7 m -63.91 -48.66 75.74 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 108.272 -1.01 . . . . 10.0 108.272 178.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -66.09 -44.55 84.07 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.07 -60.17 3.69 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 115.398 -0.819 . . . . 10.0 110.076 179.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 82.7 mt -61.64 -50.54 72.13 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.077 -0.51 . . . . 10.0 112.193 -179.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -57.28 -52.23 66.17 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.038 0.385 . . . . 10.0 112.038 -178.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -67.11 -42.19 84.94 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.63 0.233 . . . . 10.0 111.63 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 24.5 t -65.37 -43.03 94.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.365 0 C-N-CA 121.156 -0.218 . . . . 10.0 111.215 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -66.6 -48.53 69.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.772 0.32 . . . . 10.0 110.806 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -60.28 -42.9 96.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.647 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -75.63 -29.06 59.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.41 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -57.82 -31.85 41.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.593 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -60.75 -66.45 1.53 Allowed Pre-proline 0 N--CA 1.448 -0.525 0 CA-C-O 119.036 -0.506 . . . . 10.0 111.132 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.05 -31.95 83.79 Favored 'Trans proline' 0 C--N 1.357 0.998 0 C-N-CA 121.637 1.558 . . . . 10.0 112.053 178.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 5.5 m-30 -61.16 -50.3 73.74 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 120.741 0.305 . . . . 10.0 110.421 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 97.5 mt -80.63 -33.66 35.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.482 . . . . 10.0 111.179 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -64.31 -49.43 71.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.58 -0.282 . . . . 10.0 111.104 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -66.85 -39.19 87.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.06 0.457 . . . . 10.0 109.864 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.35 -31.33 72.49 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.066 -0.716 . . . . 10.0 109.066 178.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -69.0 -40.81 78.48 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.006 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -56.09 -48.05 76.87 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.093 -1.077 . . . . 10.0 108.093 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -63.86 -47.78 79.36 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.564 -1.198 . . . . 10.0 110.157 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -37.22 75.53 Favored 'General case' 0 N--CA 1.464 0.239 0 O-C-N 123.314 0.384 . . . . 10.0 111.204 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -62.99 -49.64 73.87 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.995 -0.743 . . . . 10.0 108.995 178.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -63.47 -38.35 90.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 10.0 109.667 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -60.47 -52.93 63.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.522 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 81.0 mmm -66.18 -42.69 88.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.473 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -65.15 -48.73 72.5 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.549 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 45.5 mt -64.59 -35.85 82.31 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -62.13 -49.93 73.9 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 54.8 mtt85 -65.34 -41.21 94.14 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.709 0.29 . . . . 10.0 110.415 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.39 -31.67 67.89 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.488 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -90.5 -42.25 10.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.021 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 5.6 t -53.53 -44.73 57.5 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.404 0 N-CA-C 112.255 0.465 . . . . 10.0 112.255 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -53.66 -62.0 4.34 Favored Pre-proline 0 CA--C 1.542 0.646 0 N-CA-C 112.556 0.576 . . . . 10.0 112.556 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -65.56 -36.84 31.93 Favored 'Trans proline' 0 C--N 1.353 0.816 0 C-N-CA 121.906 1.737 . . . . 10.0 112.287 178.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 58.1 mt -65.14 -34.22 77.87 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.098 0.475 . . . . 10.0 109.969 179.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 26.2 ttt180 -70.21 -35.13 73.69 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 108.065 -1.087 . . . . 10.0 108.065 178.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.75 -40.77 95.85 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.189 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -62.96 -43.04 99.89 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.704 -0.85 . . . . 10.0 108.704 178.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 63.9 mt -63.36 -37.62 87.99 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.429 -0.805 . . . . 10.0 109.918 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -68.3 -50.69 51.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.442 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -60.98 -43.53 98.67 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.37 -44.63 96.56 Favored Glycine 0 N--CA 1.438 -1.176 0 N-CA-C 110.486 -1.046 . . . . 10.0 110.486 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.82 -37.98 86.43 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 110.545 -0.169 . . . . 10.0 110.545 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -60.66 -42.26 96.66 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.765 -0.457 . . . . 10.0 109.765 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 11.1 tm0? -70.89 -49.82 41.72 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.751 -0.658 . . . . 10.0 109.713 178.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 46.8 mttt -56.68 -41.24 76.98 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.836 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 17.6 mt -70.52 -39.28 74.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.399 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.07 -41.23 99.4 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.4 -34.44 75.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.664 178.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 86.5 mt -75.51 -42.15 53.5 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.441 -0.799 . . . . 10.0 109.55 178.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -62.12 -39.19 91.7 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.393 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -77.5 14.98 0.86 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.745 178.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 23.8 mttp -133.07 -42.14 0.89 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.49 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 93.3 mt -58.05 -32.67 68.23 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.361 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 3.1 m -82.57 -62.32 0.31 Allowed Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.46 -49.92 8.02 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 121.832 1.688 . . . . 10.0 112.597 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 98.2 mt -75.8 -13.12 60.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.006 0.431 . . . . 10.0 110.271 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -83.63 -47.92 5.46 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 109.815 -1.314 . . . . 10.0 109.815 178.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 57.5 mt-10 -61.1 -44.94 96.59 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -64.4 -39.15 93.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.366 179.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 16.2 tpt -64.28 -39.3 93.65 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.228 -0.656 . . . . 10.0 109.228 178.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -70.29 -39.83 74.62 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.284 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -65.07 -43.71 91.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.958 0.408 . . . . 10.0 110.432 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . 0.703 ' CD ' ' CD2' ' C' ' 469' ' ' LEU . 11.7 mtp180 -69.92 -28.67 65.79 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.255 -0.646 . . . . 10.0 109.255 178.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -71.81 -29.82 64.84 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 77.9 mtt180 -62.58 -52.96 61.35 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.437 -0.949 . . . . 10.0 108.437 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -64.18 -35.36 80.53 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -57.08 -56.77 17.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.452 -0.794 . . . . 10.0 110.243 179.01 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 47.6 t -75.65 -39.69 39.76 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 CA-C-N 115.731 -0.668 . . . . 10.0 112.15 -179.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.96 -51.0 71.56 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 122.419 -0.176 . . . . 10.0 111.111 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -64.23 -26.43 68.5 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.351 -0.611 . . . . 10.0 109.351 178.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 5.2 mt -71.79 -37.75 70.38 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 178.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -63.27 -49.94 72.12 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.32 -11.83 45.74 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.779 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -98.34 -41.58 7.77 Favored 'General case' 0 C--O 1.223 -0.331 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 178.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 86.4 mt -65.6 -34.24 77.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.973 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -55.31 -61.66 5.67 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.498 -0.319 . . . . 10.0 111.587 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -66.86 -30.06 40.85 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.597 1.531 . . . . 10.0 111.541 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -63.79 -50.35 69.33 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 110.023 -0.362 . . . . 10.0 110.023 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 18.7 p -70.64 -34.54 72.17 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 110.181 -0.304 . . . . 10.0 110.181 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -59.05 -53.84 53.82 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -70.09 -29.41 66.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.69 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 9.3 mt -63.2 -39.13 93.74 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.422 -0.585 . . . . 10.0 109.422 178.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 38.3 mtt180 -64.56 -35.26 80.4 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 109.492 -0.559 . . . . 10.0 109.492 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -69.84 -45.63 67.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.832 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -63.5 -44.54 94.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.785 -0.643 . . . . 10.0 109.879 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 60.2 mt -65.31 -36.93 85.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.046 178.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -64.43 -44.84 89.91 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.22 -0.659 . . . . 10.0 109.22 178.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -60.45 -44.42 95.84 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.944 178.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -63.33 -52.14 63.09 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-N 115.773 -0.648 . . . . 10.0 110.335 179.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 79.5 mt -60.25 -36.73 78.43 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.853 0.358 . . . . 10.0 111.054 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -67.39 -44.39 78.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.243 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.51 -46.66 72.22 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 82.8 mt -63.99 -19.54 65.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.16 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 12.9 ttmt -67.56 -48.15 67.77 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.671 -0.863 . . . . 10.0 108.671 178.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -77.87 -41.99 34.94 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -56.93 -48.97 77.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.804 -1.089 . . . . 10.0 109.629 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -76.77 -35.79 39.04 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.496 -0.775 . . . . 10.0 111.693 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.25 -47.94 88.6 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.761 -0.733 . . . . 10.0 111.329 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -66.97 -38.78 86.71 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 -61.43 -41.71 97.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.116 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 75.6 mt -63.4 -40.9 98.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.905 -0.589 . . . . 10.0 109.725 179.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -65.47 -41.08 93.72 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -60.48 -53.28 59.4 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.575 -0.739 . . . . 10.0 109.537 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -63.92 -28.92 70.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.444 -0.798 . . . . 10.0 111.636 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.91 -50.42 29.29 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.112 -0.329 . . . . 10.0 110.112 179.05 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.99 98.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.957 0.408 . . . . 10.0 110.09 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 8.1 mtmm -70.13 -23.55 63.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.066 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -70.09 -39.69 75.4 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -38.3 90.58 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.04 -0.726 . . . . 10.0 109.04 178.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -66.87 -38.0 85.5 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.18 -0.674 . . . . 10.0 109.18 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -62.68 -49.49 74.93 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 115.623 -0.717 . . . . 10.0 109.494 178.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 84.5 mt -61.13 -39.65 90.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.343 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 50.3 m -63.46 -52.87 59.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.534 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 3.2 p -67.15 -26.0 66.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.206 0.527 . . . . 10.0 110.751 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 20.6 tp -74.11 -37.63 64.07 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 72.6 m -64.63 -29.88 70.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.11 0.481 . . . . 10.0 109.982 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -70.05 -7.54 42.02 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.122 178.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 34.0 mttp -115.92 -32.87 5.29 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.709 -0.678 . . . . 10.0 109.356 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.38 -24.78 63.01 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.664 -0.698 . . . . 10.0 111.105 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -106.79 -71.72 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 112.134 0.42 . . . . 10.0 112.134 179.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -59.11 -53.87 3.22 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 122.194 1.93 . . . . 10.0 113.028 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -62.77 -48.16 80.36 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.824 0.305 . . . . 10.0 111.824 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 9.9 mt -62.04 -37.29 84.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.804 0.335 . . . . 10.0 110.731 179.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -65.35 -44.62 87.11 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.51 -37.61 88.15 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 42.0 mt -63.32 -43.6 97.34 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 57.7 mtt180 -64.93 -38.21 90.22 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 108.359 -0.978 . . . . 10.0 108.359 178.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -65.61 -21.57 66.59 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.205 -0.907 . . . . 20.0 112.157 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -93.15 -37.35 5.69 Favored Glycine 0 CA--C 1.523 0.594 0 N-CA-C 108.75 -1.74 . . . . 10.0 108.75 178.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 49.1 mt -59.45 -37.8 79.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.811 -0.195 . . . . 10.0 111.433 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 75.8 mt -56.09 -62.43 4.75 Favored Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 112.038 0.384 . . . . 10.0 112.038 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -64.1 -34.81 56.44 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 121.983 1.789 . . . . 10.0 112.037 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 25.3 t -63.66 -54.57 30.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.517 0.199 . . . . 10.0 110.811 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 36.3 mt -63.35 -35.84 81.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.637 0.256 . . . . 10.0 110.921 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -64.5 -51.01 65.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.554 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 12.6 p -65.28 -36.95 85.68 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.768 0.318 . . . . 10.0 110.879 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -68.31 -36.24 79.02 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.69 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 49.6 mttt -65.8 -37.2 85.63 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.682 -0.488 . . . . 10.0 109.682 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 87.2 t -63.49 -44.24 98.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.084 178.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.35 -37.91 71.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.086 -0.507 . . . . 10.0 110.907 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -67.68 -45.9 73.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.516 -0.311 . . . . 10.0 111.139 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 34.6 mt -59.97 -45.38 92.88 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.998 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 77.4 p -70.76 -28.86 65.0 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.715 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -69.2 -38.45 78.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.087 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 95.8 mt -57.51 -40.98 79.92 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.478 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -60.63 -46.02 91.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.667 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -41.51 97.67 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.341 -0.845 . . . . 10.0 111.666 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -60.85 -44.29 97.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.063 0.459 . . . . 10.0 109.788 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 8.9 m -60.46 -39.3 87.08 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.487 -0.779 . . . . 10.0 111.45 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 87.2 mttt . . . . . 0 N--CA 1.465 0.278 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.738 -179.558 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 11.3 mt . . . . . 0 CA--C 1.521 -0.144 0 CA-C-O 120.757 0.313 . . . . 10.0 110.799 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 77.0 mt -62.61 -42.09 99.38 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -71.03 -31.75 68.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.962 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -64.88 -48.23 75.0 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.637 -0.875 . . . . 10.0 108.637 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 47.4 m0 -63.72 -37.01 85.75 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.522 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.18 -45.61 87.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.551 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 31.0 m -63.81 -36.63 84.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.738 -0.664 . . . . 10.0 109.997 178.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 89.3 t -67.46 -33.74 64.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 24.2 m -66.17 -40.17 90.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.736 -0.665 . . . . 10.0 109.215 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 7.4 m -66.78 -37.17 84.04 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.494 -0.928 . . . . 10.0 108.494 177.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 76.6 m -63.18 -44.32 95.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.158 -0.928 . . . . 10.0 109.671 178.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -61.26 -38.35 86.41 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.306 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 32.2 m -62.33 -41.84 98.89 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.802 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -66.11 -31.86 72.97 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.778 178.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.16 -40.23 78.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.059 -0.519 . . . . 10.0 109.688 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -66.55 -44.85 81.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.338 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -64.92 -25.61 67.95 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.956 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.22 -51.86 8.91 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.69 179.213 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 84.4 mt -52.69 -40.0 62.51 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.637 -0.711 . . . . 10.0 112.523 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -48.24 -79.3 0.07 OUTLIER Glycine 0 CA--C 1.523 0.543 0 O-C-N 123.6 0.563 . . . . 10.0 113.679 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -60.14 -35.87 90.8 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.621 2.214 . . . . 10.0 112.212 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 35.9 t -60.56 -49.49 84.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 N-CA-C 112.132 0.419 . . . . 10.0 112.132 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 51.5 p -70.39 -34.58 72.74 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 121.097 -0.241 . . . . 10.0 111.118 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -60.13 -50.6 73.03 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -74.09 -24.72 59.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.511 179.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -68.59 -46.14 70.16 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.276 -0.639 . . . . 10.0 109.276 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -37.35 87.09 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 108.72 -0.844 . . . . 10.0 108.72 178.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -64.5 -44.45 90.91 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.63 -0.878 . . . . 10.0 108.63 177.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.88 -37.06 86.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.495 178.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 44.7 mt -63.13 -41.06 99.25 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -68.18 -35.06 77.42 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.969 -0.559 . . . . 10.0 110.403 178.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 38.0 mttp -62.56 -36.65 83.32 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.861 -1.163 . . . . 10.0 107.861 177.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -69.66 -48.75 58.71 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 114.96 -1.018 . . . . 10.0 110.172 179.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -64.2 -36.01 82.67 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 116.792 -0.185 . . . . 10.0 110.736 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -63.93 -35.12 79.62 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.686 -0.487 . . . . 10.0 109.686 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -69.38 -45.39 60.75 Favored Glycine 0 N--CA 1.445 -0.748 0 N-CA-C 108.807 -1.717 . . . . 10.0 108.807 177.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 87.5 mt -64.32 -24.6 67.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.373 -0.413 . . . . 10.0 110.796 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 39.8 mtt180 -74.77 -3.49 31.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.24 0.543 . . . . 10.0 110.341 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -118.04 -38.37 3.23 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.112 -1.069 . . . . 10.0 108.112 177.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -72.22 -59.8 2.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.092 -0.958 . . . . 10.0 110.73 179.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 93.3 mmm -66.43 -31.35 72.05 Favored 'General case' 0 C--O 1.225 -0.236 0 N-CA-C 112.908 0.706 . . . . 10.0 112.908 -178.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.3 p -62.66 -52.08 64.73 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 179.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -66.73 -40.23 88.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.996 -0.742 . . . . 10.0 108.996 178.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -55.07 -53.83 50.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.705 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 96.6 mt -63.88 -47.09 82.01 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.552 0.575 . . . . 10.0 112.552 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -65.31 -38.46 90.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.903 0.382 . . . . 10.0 110.999 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.79 -42.56 63.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.447 179.295 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 2.3 p -65.55 -35.59 75.62 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.189 0 CA-C-N 116.656 -0.247 . . . . 10.0 110.981 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -66.0 -37.76 86.74 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.779 -0.823 . . . . 10.0 108.779 178.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -72.98 -11.46 60.58 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.322 -0.854 . . . . 10.0 110.033 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 35.9 mmtm -94.66 -40.16 9.96 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 59.5 t -59.62 -42.25 87.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.727 -0.67 . . . . 10.0 111.654 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -54.32 -61.54 5.35 Favored Pre-proline 0 CA--C 1.537 0.468 0 O-C-N 122.97 0.169 . . . . 10.0 111.403 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.78 -28.99 42.99 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 122.171 1.914 . . . . 10.0 111.605 178.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -64.49 -52.02 60.01 Favored 'General case' 0 C--O 1.222 -0.367 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 43.3 mt -65.64 -43.52 89.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.358 179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -58.72 -51.45 69.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.99 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -71.97 -32.17 67.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.766 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -67.7 -48.03 67.7 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 178.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -68.04 -29.58 68.6 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 5.0 ttmt -65.23 -46.69 79.6 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.539 -0.911 . . . . 10.0 108.539 177.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 19.2 mttm -69.37 -38.75 78.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.432 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -31.8 72.82 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 178.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -69.77 -45.59 67.69 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -55.66 -43.55 76.39 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -73.47 -34.1 65.19 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 115.275 -0.875 . . . . 10.0 110.884 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.45 -42.32 99.38 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.553 -0.906 . . . . 10.0 108.553 178.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -66.1 -47.21 74.97 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 107.894 -1.15 . . . . 10.0 107.894 177.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . 0.703 ' CD2' ' CD ' ' A' ' 308' ' ' ARG . 96.2 mt -55.82 -44.62 78.05 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 115.217 -0.901 . . . . 20.0 111.489 178.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -62.6 -41.44 98.97 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 116.361 -0.381 . . . . 10.0 110.135 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 27.0 mtm180 -69.84 -36.93 75.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.964 0.412 . . . . 10.0 110.528 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -79.97 2.76 22.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.092 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 29.3 mttm -120.51 -57.71 1.89 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.367 -0.378 . . . . 10.0 110.55 178.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 84.0 t -62.47 -42.77 97.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 112.752 0.649 . . . . 10.0 112.752 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -61.28 -58.19 20.57 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 112.378 0.51 . . . . 10.0 112.378 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -60.48 -33.86 93.48 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 121.663 1.575 . . . . 10.0 110.51 178.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 12.2 mt -66.61 -44.11 82.96 Favored 'General case' 0 C--O 1.213 -0.828 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 65.4 mtt180 -54.89 -41.39 70.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.886 0.374 . . . . 10.0 110.177 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -67.48 -56.78 8.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.523 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.64 -34.61 77.32 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.148 0.796 . . . . 10.0 113.148 -179.211 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 30.5 mt -68.6 -35.26 77.09 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -69.95 -36.84 75.59 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -67.8 -41.26 83.41 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.609 -0.886 . . . . 10.0 108.609 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -67.58 -35.04 85.62 Favored Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 110.061 -1.215 . . . . 10.0 110.061 177.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -70.32 -38.41 74.92 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 45.8 mtt180 -64.57 -39.4 93.68 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 108.484 -0.932 . . . . 10.0 108.484 177.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -63.81 -48.65 75.98 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.801 -0.815 . . . . 10.0 108.801 177.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -64.8 -35.83 82.37 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.583 179.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 17.4 mt -68.37 -43.27 77.73 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 178.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -62.04 -40.82 97.05 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 107.496 -1.298 . . . . 10.0 107.496 178.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -60.59 -59.63 5.09 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.448 -0.945 . . . . 10.0 108.448 177.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 80.8 mt -52.04 -50.95 60.45 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 115.52 -0.764 . . . . 10.0 112.468 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -61.57 -41.77 97.87 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.689 0.255 . . . . 10.0 111.689 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -75.05 -12.98 60.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.674 0.273 . . . . 10.0 111.429 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 13.5 mttm -97.09 -44.09 7.12 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 178.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 95.1 mt -71.11 -29.66 65.54 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.937 0.717 . . . . 10.0 112.937 -179.096 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 49.3 m -61.21 -60.4 10.69 Favored Pre-proline 0 CA--C 1.537 0.462 0 C-N-CA 120.422 -0.511 . . . . 10.0 111.327 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -65.0 -35.38 43.32 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 121.717 1.611 . . . . 10.0 111.074 178.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 16.2 mt -67.91 -35.35 78.31 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 116.334 -0.393 . . . . 10.0 110.461 179.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -65.43 -45.3 90.95 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.212 -1.155 . . . . 10.0 110.212 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -64.41 -42.88 95.82 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -62.31 -43.83 97.91 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.586 178.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 65.8 mmm -62.29 -38.04 87.84 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.135 -0.484 . . . . 10.0 109.826 178.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 89.9 mtt180 -63.99 -42.46 97.19 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.45 -41.64 88.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.711 -0.677 . . . . 10.0 109.763 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 46.5 mtt180 -62.23 -43.49 98.71 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 108.586 -0.894 . . . . 10.0 108.586 178.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -61.53 -44.22 97.45 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.236 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 50.6 mtt180 -63.65 -42.02 98.17 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -75.9 10.91 1.59 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.192 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -128.97 -55.68 1.2 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.718 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 79.9 t -69.17 -46.41 77.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.826 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -66.81 -35.64 80.52 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.81 -39.2 90.67 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.052 -1.092 . . . . 10.0 108.052 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 32.3 mt -68.67 -23.2 64.37 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.314 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 68.2 mtt180 -64.68 -39.82 94.33 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.641 -0.874 . . . . 10.0 108.641 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -93.19 7.9 42.39 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.474 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 32.3 m170 -113.74 -53.07 2.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.037 -0.528 . . . . 10.0 111.011 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 95.8 mt -77.42 -34.56 54.66 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.7 0.63 . . . . 10.0 112.7 -178.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -57.27 -57.18 26.66 Favored Pre-proline 0 CA--C 1.532 0.26 0 C-N-CA 120.52 -0.472 . . . . 10.0 110.945 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -67.48 -28.84 38.22 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 121.403 1.402 . . . . 10.0 110.628 178.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -63.76 -48.38 77.22 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.004 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 9.1 p -71.01 -29.97 66.07 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.625 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -68.08 -44.0 77.26 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.958 -0.756 . . . . 10.0 108.958 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -66.15 -44.13 85.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.089 177.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 37.7 mt -61.64 -38.36 87.42 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 115.852 -0.613 . . . . 10.0 109.836 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -61.81 -38.99 90.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.141 -0.481 . . . . 10.0 109.911 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -67.81 -39.66 83.93 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 178.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 62.6 mtt180 -68.6 -37.2 79.6 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 178.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 75.0 mt -69.49 -34.98 75.12 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.124 -0.695 . . . . 10.0 109.124 178.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -64.04 -45.5 88.58 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 178.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.33 -40.88 98.54 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 178.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 8.2 ttm180 -60.97 -40.67 94.28 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.273 -0.876 . . . . 10.0 108.884 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 74.7 mt -68.53 -36.15 78.45 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.114 178.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -59.38 -44.02 92.82 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 178.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -68.25 -46.56 70.13 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.356 -0.838 . . . . 10.0 109.445 178.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 58.6 mt -58.57 -30.05 66.87 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.393 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -74.89 -49.85 18.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.66 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -67.02 -49.57 64.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.861 0.362 . . . . 10.0 110.943 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -66.0 -36.6 83.74 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -67.52 -41.8 89.69 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 110.853 -0.899 . . . . 10.0 110.853 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -63.94 -37.65 94.93 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 110.215 -1.154 . . . . 10.0 110.215 178.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -67.89 -44.9 75.93 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.614 -0.884 . . . . 10.0 108.614 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 34.3 mtt180 -56.77 -39.98 75.01 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 115.522 -0.763 . . . . 10.0 110.542 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 81.7 mt -62.61 -41.29 98.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.408 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -69.47 -45.08 69.86 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.457 -0.571 . . . . 10.0 109.457 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -59.84 -49.33 78.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.097 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -64.0 -39.21 93.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.985 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -65.68 -42.96 90.66 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.172 0.511 . . . . 10.0 110.314 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -64.52 -51.82 60.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.616 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -33.77 74.57 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.373 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.41 -45.94 88.69 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.392 -0.595 . . . . 10.0 109.392 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 4.4 m -66.49 -38.1 86.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.726 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -68.96 -25.97 64.81 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.605 -0.725 . . . . 10.0 110.649 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -87.5 -34.24 18.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.766 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 49.0 mt -63.6 -32.45 73.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.856 0.36 . . . . 10.0 110.413 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 1.1 p -76.4 -41.32 48.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.117 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 2.1 p -73.88 -12.75 60.76 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.336 0.588 . . . . 10.0 110.853 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 28.8 mt -91.31 -39.61 11.95 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.056 -0.72 . . . . 10.0 109.056 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.5 p -69.46 -24.88 63.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.784 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -64.11 -19.97 65.64 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.337 0.589 . . . . 10.0 109.967 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -114.53 -29.77 6.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.222 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -73.8 -5.7 42.45 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.143 0.423 . . . . 10.0 112.143 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -119.87 -70.11 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.583 0 CA-C-O 119.446 -0.312 . . . . 10.0 111.323 178.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.6 -51.72 3.83 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.08 1.853 . . . . 10.0 112.242 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -63.6 -40.73 97.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.463 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 6.9 mt -63.96 -41.79 97.47 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 110.063 -0.347 . . . . 10.0 110.063 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -63.56 -38.55 91.54 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 178.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.31 -38.77 81.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.153 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 36.4 mt -62.55 -41.01 98.63 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -68.84 -30.92 69.56 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.468 -0.567 . . . . 10.0 109.468 178.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -70.63 -14.42 62.47 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.337 -0.847 . . . . 20.0 110.47 178.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -98.6 -37.6 4.19 Favored Glycine 0 CA--C 1.523 0.568 0 N-CA-C 108.659 -1.776 . . . . 10.0 108.659 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 73.5 mt -56.34 -45.03 80.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.529 -0.335 . . . . 10.0 111.602 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 86.8 mt -56.97 -62.0 5.96 Favored Pre-proline 0 CA--C 1.537 0.448 0 N-CA-C 112.508 0.559 . . . . 10.0 112.508 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -61.22 -36.97 77.52 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 121.964 1.776 . . . . 10.0 111.948 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 9.6 t -64.38 -45.34 96.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.637 0.256 . . . . 10.0 110.372 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 29.8 mt -62.75 -38.0 88.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.777 0.322 . . . . 10.0 110.145 179.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 62.4 mt-10 -65.72 -48.55 71.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.176 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 26.9 m -63.41 -39.91 95.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.152 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -65.91 -38.31 88.37 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 178.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 64.6 mttt -61.73 -39.49 91.72 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.858 -0.61 . . . . 10.0 109.744 178.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 69.6 t -59.8 -48.83 86.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 108.82 -0.808 . . . . 10.0 108.82 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 12.0 m -61.47 -41.98 98.07 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.386 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -63.47 -47.37 82.08 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.082 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 80.1 mt -57.9 -46.28 85.17 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.306 -0.407 . . . . 10.0 110.406 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 14.7 m -65.33 -44.53 87.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.216 179.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -58.03 -50.5 73.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.285 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.5 mt -56.63 -44.65 81.44 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 116.185 -0.462 . . . . 10.0 110.816 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -63.61 -52.55 60.39 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.065 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -58.78 -39.33 80.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.897 -0.592 . . . . 10.0 112.234 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -73.26 -44.13 59.87 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.001 0.371 . . . . 10.0 112.001 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 14.2 p -64.75 -27.98 69.27 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.507 0.558 . . . . 10.0 112.507 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 45.0 mtmt -65.61 -33.18 75.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.894 0.378 . . . . 10.0 110.924 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 24.0 mttt -85.48 -34.85 21.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.348 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 91.3 mt -85.77 49.46 1.77 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.456 0.646 . . . . 10.0 109.604 178.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.246 0.915 0 CA-C-N 115.487 -0.778 . . . . 10.0 110.123 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.26 0 CA-C-O 120.606 0.241 . . . . 10.0 111.165 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -115.96 125.25 52.28 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 179.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -119.05 101.01 7.71 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.027 0.441 . . . . 10.0 111.165 -179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 5.5 mtpp -81.95 102.71 11.1 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.305 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 21.2 mt -100.92 138.41 38.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.553 -178.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 46.0 t -112.55 126.73 69.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.794 0.33 . . . . 10.0 110.742 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 57.1 t -95.87 118.3 41.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.724 -0.473 . . . . 10.0 109.724 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 35.9 m -112.33 163.21 9.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.773 0.32 . . . . 10.0 110.802 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 148.99 167.49 13.91 Favored Glycine 0 N--CA 1.447 -0.632 0 N-CA-C 111.378 -0.689 . . . . 10.0 111.378 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.59 158.32 35.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.924 0.392 . . . . 10.0 111.724 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.65 92.4 1.0 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 121.019 -0.61 . . . . 10.0 111.867 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 151.12 -10.98 0.77 Allowed Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 111.645 -0.582 . . . . 10.0 111.645 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 17.5 m -73.42 -18.91 17.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.857 0.36 . . . . 10.0 111.666 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 89.59 44.7 4.83 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.82 -0.705 . . . . 10.0 112.927 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -62.26 -49.73 74.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.544 0.211 . . . . 10.0 111.226 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.0 p -62.43 -31.23 71.91 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.686 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.38 98.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.286 -0.415 . . . . 10.0 110.312 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 94.2 mt -68.37 -35.75 78.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.98 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.87 -47.42 53.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.84 0.352 . . . . 10.0 110.953 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 97.5 mt -63.93 -35.75 74.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.766 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -69.58 -14.83 63.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.081 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 15.0 tp -102.23 -34.81 9.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.869 0.366 . . . . 10.0 110.659 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 49.3 mm -79.73 -64.21 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.905 -179.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -93.21 -13.56 28.2 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.724 -178.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 64.48 40.66 6.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.654 -179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -130.65 136.2 48.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.047 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -88.21 137.61 32.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.779 0.323 . . . . 10.0 110.774 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 1.7 m -99.69 151.96 4.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.361 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -121.17 -21.94 6.24 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.183 0.516 . . . . 10.0 111.363 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -77.0 157.22 31.33 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.358 0.599 . . . . 10.0 111.243 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.51 68.23 5.68 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.035 179.252 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.3 134.62 70.21 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.747 -0.66 . . . . 10.0 110.753 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -80.11 -164.72 0.29 Allowed 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.857 2.371 . . . . 10.0 111.783 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -173.33 141.47 0.92 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.279 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 63.8 mt -121.92 -66.56 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 108.217 -1.031 . . . . 10.0 108.217 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -148.11 93.43 2.17 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.702 -0.851 . . . . 10.0 108.702 179.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -114.61 160.56 19.16 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.551 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.1 p -147.28 142.83 27.59 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.715 0.293 . . . . 10.0 111.608 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . 0.44 ' C ' HE22 ' D' ' 818' ' ' GLN . 40.7 m-85 -131.56 141.06 49.62 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.245 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -120.34 131.04 54.68 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 58.1 tttp -139.93 144.15 36.95 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.23 -0.441 . . . . 10.0 109.962 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -113.44 118.23 33.94 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.971 -0.381 . . . . 10.0 109.971 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -143.65 169.09 11.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.012 0.434 . . . . 10.0 111.271 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 19.1 t -107.09 112.85 41.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 179.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 50.3 mt -109.92 112.37 40.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.824 -179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 61.27 34.52 18.59 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.304 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.88 -8.73 78.91 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.927 -0.654 . . . . 10.0 112.791 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -100.52 113.43 26.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.833 0.349 . . . . 10.0 111.267 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 5.3 t -78.83 121.28 24.61 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.489 -0.93 . . . . 10.0 108.489 178.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -140.39 166.68 24.05 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.286 0.565 . . . . 10.0 112.47 -178.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 25.5 tp -107.02 122.1 45.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.256 -0.884 . . . . 10.0 109.112 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 77.7 mt -99.98 117.35 34.08 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.284 -0.416 . . . . 10.0 111.561 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -104.53 89.55 3.25 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.354 -1.35 . . . . 10.0 107.354 178.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 14.8 mt -82.69 136.58 22.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.641 -0.709 . . . . 10.0 112.306 -177.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 47.3 tp -110.3 120.89 43.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.606 -0.725 . . . . 10.0 111.124 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -99.36 96.76 7.94 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.072 -0.714 . . . . 10.0 109.072 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 32.0 p -81.02 162.41 23.82 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.373 -0.83 . . . . 10.0 112.342 -178.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.51 156.47 32.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.905 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -84.31 -67.49 1.43 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.436 -0.888 . . . . 10.0 111.767 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -83.15 102.43 11.86 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.328 0.585 . . . . 20.0 111.257 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -142.59 163.83 31.76 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.374 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -118.67 -161.46 0.84 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.698 -0.683 . . . . 10.0 109.312 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -80.44 110.27 15.74 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.982 0.42 . . . . 10.0 110.173 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 44.2 t -135.56 137.4 41.97 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.028 -0.533 . . . . 10.0 109.933 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.85 -38.46 78.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.055 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 90.4 mmm -60.81 -40.74 93.87 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.407 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -66.58 -48.43 69.61 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.482 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.88 -32.6 70.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.582 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -61.35 -56.3 21.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.98 -0.554 . . . . 10.0 111.523 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -72.55 -27.83 62.46 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.436 0.902 . . . . 10.0 113.436 -178.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 59.7 mtp -68.57 -21.27 64.54 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.939 0.348 . . . . 10.0 111.939 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 66.9 mtt-85 -95.6 11.74 32.11 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.859 0.318 . . . . 10.0 111.859 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.3 m -113.01 18.16 18.29 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.408 0.623 . . . . 10.0 110.749 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -115.94 144.26 18.37 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.521 -0.847 . . . . 10.0 112.693 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -84.99 -67.9 0.76 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.214 -0.291 . . . . 10.0 110.214 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -105.19 152.4 17.27 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 111.149 -0.78 . . . . 10.0 111.149 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -124.75 127.46 47.26 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.116 0.484 . . . . 10.0 111.677 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 55.5 mt -95.33 113.43 25.1 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.883 -0.598 . . . . 10.0 110.03 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 3.2 m -87.37 86.31 7.23 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.934 -0.395 . . . . 10.0 109.934 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 28.6 t -88.31 126.3 41.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.138 0.494 . . . . 10.0 111.837 -178.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 29.4 p90 -133.14 157.9 44.17 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.114 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -94.16 121.71 35.94 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 12.6 pt -68.46 -11.23 14.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 112.129 0.418 . . . . 10.0 112.129 -179.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -100.97 12.06 38.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.911 0.386 . . . . 10.0 110.963 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -137.6 113.13 9.45 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.0 0.428 . . . . 10.0 110.861 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.39 -37.71 88.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.908 -0.587 . . . . 10.0 112.321 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 17.3 tptp -63.79 -30.68 71.75 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.987 0.422 . . . . 10.0 110.878 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 15.2 t -66.42 -40.37 89.5 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.791 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -65.62 -35.67 81.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.356 0.598 . . . . 10.0 110.195 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -80.93 -1.72 44.75 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.679 -0.692 . . . . 10.0 111.574 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.19 -12.1 33.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.146 0.498 . . . . 10.0 110.024 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 43.8 mm -60.26 -42.74 91.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.398 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -64.4 -37.79 88.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.26 -0.427 . . . . 10.0 109.871 179.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -59.03 -43.83 91.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.414 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -77.6 -34.92 53.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.95 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -55.17 -50.58 68.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.406 -0.361 . . . . 10.0 111.335 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -69.46 -35.79 75.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.081 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -63.9 -48.33 77.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.658 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 65.2 mt -66.92 -38.05 80.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.273 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.84 -37.34 78.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.097 0.475 . . . . 10.0 110.422 179.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 64.3 ttp85 -71.43 -42.9 67.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.664 -0.698 . . . . 10.0 111.918 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 28.3 m -72.83 -30.0 31.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 N-CA-C 112.288 0.477 . . . . 10.0 112.288 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 19.8 mmmt -88.0 -22.29 24.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.549 0.214 . . . . 10.0 111.169 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 26.0 t0 57.84 30.32 18.87 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.725 0.774 . . . . 10.0 110.782 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 3.0 m -127.44 143.28 51.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.381 -0.827 . . . . 10.0 109.756 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -75.06 -41.64 58.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.199 0.523 . . . . 10.0 110.487 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -106.24 109.03 20.84 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.573 0.701 . . . . 10.0 110.775 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 78.5 t -118.92 131.67 24.24 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.256 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -59.63 101.76 0.15 Allowed 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.718 2.279 . . . . 10.0 111.381 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 65.8 mtt -127.16 149.67 49.86 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.154 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 98.0 t -132.36 122.57 48.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 12.9 tp -76.87 115.68 16.87 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.274 -0.639 . . . . 10.0 109.274 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 49.3 t -110.58 112.41 40.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.04 0.448 . . . . 10.0 111.425 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -95.56 95.51 1.85 Allowed Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.319 -1.112 . . . . 10.0 110.319 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -85.18 163.48 18.69 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -178.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 92.5 mttt 72.13 33.19 1.62 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 115.38 -0.827 . . . . 10.0 112.208 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 20.4 p -67.31 -17.0 64.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.761 0.315 . . . . 10.0 111.723 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -84.07 -8.93 58.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.464 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 34.2 mt -84.7 124.65 72.77 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 120.762 0.315 . . . . 10.0 111.429 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -75.77 42.67 0.97 Allowed 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.111 2.541 . . . . 10.0 112.248 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 26.7 m -134.75 30.49 3.42 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.899 -0.778 . . . . 10.0 108.899 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 40.8 ttm-85 -57.63 108.93 0.62 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.379 -0.828 . . . . 10.0 111.989 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 2.5 m -98.87 -27.6 13.84 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.635 -0.711 . . . . 10.0 109.151 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 40.4 t -106.96 114.24 45.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.187 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -76.98 154.36 33.62 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.34 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 3.8 m -55.7 -41.06 73.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.921 -0.581 . . . . 10.0 111.517 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 11.0 ttpp -62.21 -45.11 94.81 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.803 0.335 . . . . 10.0 110.973 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -56.91 -46.8 81.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.583 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.77 -40.42 84.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.477 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -63.9 -40.44 96.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.524 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -60.7 -42.31 96.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.094 0.474 . . . . 10.0 110.44 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 42.0 tp -68.39 -44.68 74.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.415 179.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.58 -45.35 92.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.218 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -61.8 -36.01 79.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.255 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 22.9 m -67.66 -25.57 65.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.47 -179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -95.29 -6.01 42.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.453 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 72.59 31.49 62.86 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.865 -0.684 . . . . 10.0 111.75 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 49.5 pt -126.25 153.05 74.48 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 110.295 -0.261 . . . . 10.0 110.295 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -81.14 158.05 20.26 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.586 2.191 . . . . 10.0 112.389 179.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 45.0 t80 -122.8 129.51 51.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.535 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 32.3 mm -128.03 124.42 62.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.418 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -85.15 124.76 32.19 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.669 -0.863 . . . . 10.0 108.669 178.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 82.6 p -128.55 171.5 12.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.792 0.805 . . . . 10.0 112.974 -177.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 7.9 t -154.06 121.12 5.67 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.659 -1.155 . . . . 10.0 108.043 178.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.97 -17.79 62.64 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.864 0.364 . . . . 10.0 111.01 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 29.8 ttmt -81.55 -48.28 12.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.16 -0.473 . . . . 10.0 111.526 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 24.4 p -90.42 -12.8 36.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.802 0.334 . . . . 10.0 111.532 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 40.2 ttt-85 70.04 20.22 6.56 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.694 -0.684 . . . . 10.0 111.531 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -75.7 131.93 40.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.604 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.9 -13.0 5.74 Favored Glycine 0 C--O 1.225 -0.436 0 N-CA-C 114.934 0.734 . . . . 10.0 114.934 177.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 59.7 t -53.55 -56.88 6.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -178.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -45.69 93.03 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.926 -179.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -66.62 -32.67 74.15 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.918 0.71 . . . . 10.0 112.918 -178.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.8 -46.52 84.52 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.074 0.464 . . . . 10.0 110.481 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -68.53 -37.41 79.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.713 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 21.4 m-30 -61.86 -45.3 94.36 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.315 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 12.2 m -61.71 -38.17 86.89 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.901 -0.591 . . . . 10.0 111.004 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 21.5 tp -61.53 -43.58 98.61 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 67.0 t -65.7 -39.06 83.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.115 -0.493 . . . . 10.0 109.809 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 41.5 mtm-85 -61.6 -41.38 97.36 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.938 -0.574 . . . . 10.0 109.987 178.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -63.0 -40.5 97.97 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.202 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 93.1 mt -62.78 -42.07 94.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.444 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 59.1 mtt180 -57.17 -52.23 66.16 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.783 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt -61.07 -39.38 89.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.666 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 -65.07 -36.92 85.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.009 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 7.8 mttt -73.63 -35.1 65.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.933 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 67.2 tt0 -69.15 -33.84 74.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.306 0.574 . . . . 10.0 109.574 179.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 16.2 tttp -64.59 -33.35 75.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.506 -0.77 . . . . 10.0 110.49 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 23.2 ttp -62.48 -25.42 67.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.704 -0.68 . . . . 10.0 112.067 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 39.0 m . . . . . 0 C--N 1.328 -0.347 0 CA-C-O 121.018 0.437 . . . . 10.0 111.299 179.715 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.595 0 N-CA-C 112.084 -0.406 . . . . 10.0 112.084 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.2 134.2 36.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.686 0.279 . . . . 10.0 111.024 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 75.3 t -106.14 133.4 50.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.122 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 26.0 ttmt -87.27 110.31 20.11 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.419 -0.586 . . . . 10.0 109.419 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 57.5 t -99.2 125.4 52.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 120.894 0.378 . . . . 10.0 110.418 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -96.24 142.4 28.44 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.808 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 56.1 mt -107.96 150.09 39.91 Favored Pre-proline 0 C--N 1.318 -0.8 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.07 -179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -61.78 -16.87 51.72 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 123.178 2.585 . . . . 10.0 112.273 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -85.84 34.94 0.61 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.984 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? 52.43 38.25 24.83 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.124 -0.944 . . . . 10.0 112.161 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 818' ' ' GLN . . . . . 0.44 HE22 ' C ' ' B' ' 40' ' ' TYR . 72.0 mt-30 -135.73 -170.5 2.63 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 112.838 0.681 . . . . 10.0 112.838 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.36 168.4 26.75 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.336 0.589 . . . . 10.0 112.148 -178.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 14.1 t -152.38 139.15 18.87 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 107.301 -1.37 . . . . 10.0 107.301 178.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 2.9 t -108.05 114.53 46.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 C-N-CA 120.147 -0.621 . . . . 10.0 112.02 -178.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 3.7 t -110.29 148.33 13.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.939 -178.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.89 146.94 37.33 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.78 0.324 . . . . 10.0 111.564 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 47.7 t -84.68 96.39 4.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.069 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 15.3 mtp85 -99.65 103.46 15.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.52 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -59.3 123.62 17.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.952 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 128.03 -41.67 1.55 Allowed Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 115.665 -0.698 . . . . 10.0 112.041 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 12.7 ptm -81.86 154.89 25.63 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.916 0.389 . . . . 10.0 110.854 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 2.1 m -96.72 168.9 10.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.203 -0.453 . . . . 10.0 111.334 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 69.7 t -54.86 -42.53 63.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.714 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -55.89 -33.07 64.29 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.365 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -73.73 -59.35 2.76 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.367 0.506 . . . . 10.0 112.367 -178.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.99 -39.17 93.51 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 -179.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -75.47 -14.9 60.46 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.429 0.529 . . . . 10.0 112.429 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -60.15 -49.52 77.31 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 179.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 7.6 mmmm -63.65 -32.5 74.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.449 -0.796 . . . . 10.0 111.046 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -70.02 -28.49 65.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.139 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 91.6 mt -87.83 -39.33 14.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.549 179.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 30.9 mmtp -64.99 -31.88 73.33 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.404 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 840' ' ' VAL . . . . . 0.43 ' CG2' ' CE2' ' B' ' 40' ' ' TYR . 2.0 p -58.33 -24.95 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-O 121.426 0.632 . . . . 10.0 111.441 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -100.78 -37.89 8.51 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.314 -0.857 . . . . 10.0 110.154 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 117.01 20.29 4.92 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 111.085 -0.806 . . . . 10.0 111.085 -178.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 59.1 mt -105.32 179.74 4.18 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.775 0.322 . . . . 10.0 110.346 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -140.7 164.47 30.11 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.651 -0.5 . . . . 10.0 109.651 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 22.4 mp0 -72.86 64.87 0.7 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.087 0.47 . . . . 10.0 111.2 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -123.0 -78.13 0.6 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.614 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -92.47 14.27 17.2 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.324 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 14.8 m -111.13 143.74 41.37 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.29 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 7.1 p -138.14 143.56 32.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.383 -0.371 . . . . 10.0 110.489 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 18.8 t -97.13 124.31 49.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.967 0.413 . . . . 10.0 111.618 -179.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 4.4 m-30 -101.96 130.61 48.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.111 179.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 20.0 mtm180 -96.79 146.54 24.81 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.719 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 13.4 mt -90.26 89.33 7.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.103 -0.499 . . . . 10.0 111.876 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 73.5 mt -105.47 106.25 20.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 178.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt 63.35 21.56 12.86 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.161 0.505 . . . . 10.0 110.706 -178.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 93.61 -22.03 37.78 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.571 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 44.2 ttt-85 -81.25 122.45 27.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.718 0.294 . . . . 10.0 111.057 -179.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -65.22 118.65 9.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.07 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 7.2 m -119.76 134.78 55.11 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.433 -0.349 . . . . 10.0 111.26 -179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 17.4 t -71.03 137.17 24.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.833 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 3.0 t -127.1 164.71 20.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.091 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -90.84 159.13 16.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.756 0.312 . . . . 10.0 110.913 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 96.5 m95 -79.53 -23.31 42.98 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.053 0.454 . . . . 10.0 110.801 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -79.75 -13.72 59.24 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.61 -179.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 3.8 m -63.49 139.92 58.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.488 -0.324 . . . . 10.0 110.851 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -74.94 147.42 40.91 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.293 -0.262 . . . . 10.0 110.293 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 5.2 tp -83.75 4.87 2.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.912 0.387 . . . . 10.0 111.599 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -56.0 -58.01 18.7 Favored Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 113.595 0.961 . . . . 10.0 113.595 -179.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -86.56 33.95 0.45 Allowed 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.115 1.877 . . . . 10.0 112.597 -179.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -105.07 -5.4 20.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.943 0.401 . . . . 10.0 111.724 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -70.48 131.97 44.84 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.762 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 103.51 -0.5 46.26 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.527 -0.844 . . . . 10.0 113.542 179.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -136.83 173.75 11.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.449 0.625 . . . . 10.0 111.733 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 69.6 mt-10 -109.9 162.18 14.75 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.066 -0.516 . . . . 10.0 109.973 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 96.7 mt -131.13 119.5 22.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.43 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 3.0 mp -106.65 124.61 62.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 39.0 t -93.02 120.04 41.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 120.895 0.378 . . . . 10.0 110.828 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -106.48 153.73 21.87 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 94.7 t -118.37 118.68 58.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.834 -0.432 . . . . 10.0 109.834 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 37.9 mt . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.406 -0.806 . . . . 10.0 110.246 -179.488 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 26.0 mt . . . . . 0 C--O 1.22 -0.491 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 45.4 mtt85 -72.43 -38.45 68.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.545 0.212 . . . . 10.0 111.364 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -65.12 -24.05 67.31 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.151 -0.685 . . . . 10.0 109.151 178.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -89.83 -43.49 10.6 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.043 -0.98 . . . . 10.0 110.053 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 75.4 mmm -59.38 -30.58 68.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.834 0.35 . . . . 10.0 111.114 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.4 p -66.05 -32.83 74.53 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 42.1 mmtt -81.82 -43.69 17.94 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 108.695 -0.854 . . . . 10.0 108.695 178.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -52.47 -59.09 4.85 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.464 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 71.8 mt -65.19 -33.23 75.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.617 -0.719 . . . . 10.0 111.42 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -60.57 -54.78 41.27 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.924 -0.399 . . . . 10.0 109.924 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -67.46 -37.82 83.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.511 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 25.2 t -65.2 -46.41 90.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.618 -0.265 . . . . 10.0 111.246 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -71.67 -42.25 67.71 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.708 0.262 . . . . 10.0 111.708 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -65.19 -35.25 80.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.845 0.355 . . . . 10.0 110.658 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -88.33 -21.95 24.11 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.678 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.33 -27.83 40.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.743 0.306 . . . . 10.0 110.765 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -64.62 -63.9 3.25 Favored Pre-proline 0 N--CA 1.452 -0.337 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.587 178.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.29 -32.38 72.98 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 121.821 1.681 . . . . 10.0 111.841 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 5.8 m-30 -63.87 -51.12 66.05 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.769 0.319 . . . . 10.0 110.445 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 59.2 mt -73.87 -34.66 64.55 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.032 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -64.06 -48.07 77.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.805 0.336 . . . . 10.0 110.737 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -60.72 -44.45 96.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.069 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -69.09 -34.8 75.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.649 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -63.57 -45.74 89.07 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 21.6 mttt -63.87 -42.66 97.45 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.044 -0.725 . . . . 10.0 109.044 178.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.28 -48.7 80.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.438 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 1.6 m95 -60.75 -37.72 82.78 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.434 179.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -63.19 -50.41 70.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.86 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -62.25 -43.22 99.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -60.74 -48.81 80.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.111 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 67.1 mmm -68.12 -40.48 82.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.499 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -62.69 -49.44 75.09 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.175 -0.305 . . . . 10.0 110.175 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 71.4 mt -64.73 -34.51 78.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.393 -0.595 . . . . 10.0 109.393 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -64.5 -50.86 65.75 Favored 'General case' 0 C--O 1.217 -0.649 0 CA-C-N 115.495 -0.775 . . . . 10.0 109.753 178.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 58.0 mtt180 -62.57 -42.35 99.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.926 0.393 . . . . 10.0 110.492 179.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -59.76 -25.44 64.89 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.956 -179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 73.0 mttt -100.83 -36.45 9.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.435 179.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 3.0 t -51.92 -44.86 38.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 122.394 0.278 . . . . 10.0 111.17 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -60.37 -61.97 6.88 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 112.519 0.563 . . . . 10.0 112.519 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -59.53 -38.63 81.66 Favored 'Trans proline' 0 C--N 1.356 0.973 0 C-N-CA 121.886 1.724 . . . . 10.0 111.954 178.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 44.0 mt -65.66 -32.15 73.56 Favored 'General case' 0 N--CA 1.46 0.07 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -72.07 -33.92 68.3 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 177.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.22 -39.51 89.64 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 178.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 83.4 mt-10 -65.0 -45.88 83.75 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 108.78 -0.822 . . . . 10.0 108.78 178.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 47.8 mt -63.5 -37.82 88.76 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 115.364 -0.835 . . . . 10.0 109.946 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -66.41 -56.46 10.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.48 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -59.03 -46.21 88.79 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.737 -0.468 . . . . 10.0 109.737 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -59.72 -49.94 73.12 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 111.336 -0.706 . . . . 10.0 111.336 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.12 -40.51 94.05 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 110.596 -0.15 . . . . 10.0 110.596 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -61.36 -42.18 98.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.57 -0.286 . . . . 10.0 110.233 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -64.9 -51.14 63.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.31 0.576 . . . . 10.0 109.656 178.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 50.9 mttt -60.2 -46.41 89.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.195 -0.912 . . . . 10.0 110.957 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 19.9 mt -67.05 -39.81 86.99 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.954 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -58.12 -46.55 85.4 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.3 -45.67 83.44 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.86 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 88.8 mt -64.5 -42.64 95.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.43 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -63.47 -42.5 98.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.7 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -77.8 -6.72 55.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.025 0.44 . . . . 10.0 110.932 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 14.1 tptt -94.28 -37.04 11.71 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.19 -1.041 . . . . 10.0 108.19 177.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 79.8 mt -62.93 -24.49 67.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.381 -0.827 . . . . 10.0 111.48 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.79 -65.12 1.4 Allowed Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 121.193 -0.203 . . . . 10.0 111.444 179.232 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -64.56 -42.86 14.95 Favored 'Trans proline' 0 C--N 1.358 1.047 0 C-N-CA 122.13 1.887 . . . . 10.0 111.894 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 45.0 mt -66.5 -29.98 70.21 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 179.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -72.73 -39.58 55.11 Favored Glycine 0 N--CA 1.445 -0.73 0 N-CA-C 110.265 -1.134 . . . . 10.0 110.265 178.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -61.27 -41.57 97.15 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.525 -0.917 . . . . 10.0 108.525 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -62.15 -49.38 76.06 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.27 -0.877 . . . . 10.0 108.905 178.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -59.22 -41.12 87.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.052 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 -62.62 -48.75 78.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.768 0.318 . . . . 10.0 110.332 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.35 -39.82 89.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.003 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . 0.772 ' CG ' ' CD1' ' C' ' 469' ' ' LEU . 2.4 mmt85 -66.9 -37.91 85.27 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.773 -0.455 . . . . 10.0 109.773 178.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -67.89 -36.78 80.84 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.376 -0.972 . . . . 10.0 108.376 177.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 36.0 ttm180 -61.67 -50.49 72.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.352 -0.84 . . . . 10.0 108.896 178.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.08 -41.12 95.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.146 0.498 . . . . 10.0 109.684 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -57.65 -56.21 24.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.487 179.314 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 83.6 t -69.68 -42.24 80.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.475 -0.784 . . . . 10.0 112.306 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.26 -43.2 95.58 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.518 -0.473 . . . . 10.0 111.493 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -65.06 -32.37 74.05 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.491 -0.929 . . . . 10.0 108.491 178.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 12.8 mt -70.5 -32.52 70.05 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.3 -0.864 . . . . 10.0 109.566 178.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -64.69 -52.07 59.14 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 178.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.74 -11.31 58.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.829 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -96.69 -47.47 5.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.975 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 81.4 mt -67.71 -31.57 71.6 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.242 -0.436 . . . . 10.0 112.055 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -55.86 -60.16 9.51 Favored Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 121.29 -0.164 . . . . 10.0 111.293 179.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -70.06 -30.86 20.23 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 121.492 1.461 . . . . 10.0 110.69 178.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -63.19 -43.03 99.37 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 116.544 -0.298 . . . . 10.0 111.379 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 13.6 p -69.88 -30.83 68.38 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.087 -0.708 . . . . 10.0 109.087 178.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -68.5 -39.27 81.34 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.642 -0.873 . . . . 10.0 108.642 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 74.4 mt-10 -67.17 -36.29 81.48 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 107.859 -1.163 . . . . 10.0 107.859 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 70.0 mt -61.82 -38.08 86.82 Favored 'General case' 0 C--O 1.222 -0.361 0 N-CA-C 108.681 -0.859 . . . . 10.0 108.681 178.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 48.6 mtt180 -67.63 -33.28 74.65 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -67.17 -53.67 28.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.763 -0.653 . . . . 10.0 109.455 178.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -63.98 -39.46 94.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.915 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 19.0 mt -61.6 -43.55 98.65 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 178.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.82 -47.47 84.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.674 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.58 -47.37 85.84 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.348 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 8.1 mmt180 -61.69 -44.67 96.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.336 179.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 63.5 mt -65.57 -44.05 87.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.775 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -61.5 -37.04 82.22 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.044 0.45 . . . . 10.0 110.354 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -74.53 -43.31 56.41 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.445 -0.576 . . . . 10.0 109.445 178.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 7.9 mt -63.8 -27.61 69.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.637 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -76.24 -40.35 52.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.893 0.378 . . . . 10.0 110.139 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -71.47 -53.96 12.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.064 -0.516 . . . . 10.0 109.633 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -65.89 -31.21 72.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.629 -0.714 . . . . 10.0 109.724 179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -70.6 -42.61 62.71 Favored Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.141 -0.783 . . . . 10.0 111.141 178.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.18 -40.96 99.66 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 109.637 -1.385 . . . . 10.0 109.637 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -67.84 -43.01 80.5 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.157 -0.683 . . . . 10.0 109.157 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 20.9 mtt180 -54.55 -50.7 67.31 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.406 178.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 87.7 mt -58.98 -42.89 91.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.498 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -64.15 -45.79 86.9 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -60.36 -50.61 72.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.128 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -59.05 -43.72 91.72 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.062 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -68.74 -44.64 73.34 Favored 'General case' 0 C--N 1.33 -0.252 0 O-C-N 123.11 0.257 . . . . 10.0 111.434 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.57 -33.3 73.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.234 0.54 . . . . 10.0 110.688 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 4.9 mtmm -86.75 -20.71 27.25 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.246 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -72.49 -38.74 68.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.086 -0.506 . . . . 10.0 109.764 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -40.63 94.79 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 178.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -69.16 -27.56 65.64 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.671 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -71.33 -47.77 54.52 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 108.159 -1.052 . . . . 10.0 108.159 177.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 84.9 mt -62.26 -43.2 99.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.124 -0.944 . . . . 10.0 111.984 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 10.0 p -60.43 -50.41 73.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.731 0.3 . . . . 10.0 111.095 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 7.5 p -66.38 -35.96 81.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.942 179.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 34.1 mt -67.27 -31.6 72.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.429 -0.35 . . . . 10.0 110.185 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 50.7 m -67.81 -29.34 68.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.147 0.499 . . . . 10.0 109.929 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -76.3 -5.18 45.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.526 0.679 . . . . 10.0 109.73 178.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 39.6 mttm -109.13 -38.92 5.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.83 -0.804 . . . . 10.0 108.83 178.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -71.07 -21.12 62.28 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.502 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -105.62 -74.48 0.02 OUTLIER Pre-proline 0 CA--C 1.537 0.448 0 N-CA-C 112.457 0.54 . . . . 10.0 112.457 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.63 -47.74 15.27 Favored 'Trans proline' 0 C--N 1.357 1.005 0 C-N-CA 122.27 1.98 . . . . 10.0 113.278 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -66.93 -43.19 83.9 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.912 -0.315 . . . . 10.0 111.327 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 1.1 mt -65.92 -39.05 90.18 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 121.03 -0.268 . . . . 10.0 110.901 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -64.43 -38.55 91.42 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.036 -0.728 . . . . 10.0 109.036 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -63.37 -41.44 98.82 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 79.3 mt -62.82 -45.0 94.66 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.362 -0.836 . . . . 10.0 110.006 178.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 72.0 mtt180 -64.95 -40.11 94.52 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.583 -0.525 . . . . 10.0 109.583 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -63.54 -30.97 72.01 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.56 -0.745 . . . . 20.0 112.051 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -85.75 -34.85 12.43 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 109.481 -1.448 . . . . 10.0 109.481 178.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 13.9 mt -57.11 -41.88 79.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.652 -0.274 . . . . 10.0 111.51 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 72.8 mt -54.34 -62.98 3.14 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 112.491 0.552 . . . . 10.0 112.491 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -63.39 -37.52 48.87 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 121.836 1.691 . . . . 10.0 111.657 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 18.3 t -61.66 -49.39 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 O-C-N 122.986 0.179 . . . . 10.0 110.677 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 59.4 mt -61.38 -39.45 90.72 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.503 -0.554 . . . . 10.0 109.503 178.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -63.24 -49.28 74.75 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.678 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 5.1 p -63.02 -38.92 93.11 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 120.928 0.394 . . . . 10.0 110.541 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -65.42 -43.43 90.52 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.737 178.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -61.81 -40.25 94.59 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.357 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 73.2 t -60.43 -44.99 97.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 13.5 m -63.73 -42.66 97.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.706 178.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -64.38 -41.13 96.84 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.941 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 83.6 mt -60.1 -37.95 81.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.37 0.605 . . . . 10.0 110.372 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 13.1 m -77.27 -41.11 42.22 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.681 -0.69 . . . . 10.0 110.002 179.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -62.83 -43.52 98.58 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.692 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 77.6 mt -65.54 -32.46 74.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.852 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -66.14 -49.04 68.84 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 179.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.49 -29.05 70.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.742 -0.663 . . . . 10.0 109.891 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -67.86 -20.87 65.18 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.48 0.712 . . . . 10.0 111.078 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.89 12.07 31.08 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 121.091 0.472 . . . . 10.0 110.705 -179.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt . . . . . 0 C--N 1.316 -0.869 0 CA-C-O 121.09 0.471 . . . . 10.0 111.265 179.101 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.541 0.62 0 CA-C-O 120.783 0.325 . . . . 10.0 111.518 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 12.9 mt -78.08 -31.61 50.27 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.874 -0.417 . . . . 10.0 109.874 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -71.81 -47.87 50.29 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.009 -0.996 . . . . 10.0 111.51 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -62.91 -42.58 99.84 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 114.956 -1.02 . . . . 10.0 110.567 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -37.43 75.98 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 123.337 0.398 . . . . 10.0 110.563 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -62.18 -44.15 97.24 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.326 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 3.1 m -64.89 -36.11 83.3 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.331 0.586 . . . . 10.0 109.582 178.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 62.4 t -67.47 -46.95 82.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.06 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 52.6 m -60.83 -43.58 98.07 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.441 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 28.7 m -62.71 -40.41 97.05 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 120.846 0.355 . . . . 10.0 110.633 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 10.9 p -76.65 -11.23 59.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 10.0 111.057 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 45.8 t80 -85.6 -38.59 18.27 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 108.667 -0.864 . . . . 10.0 108.667 177.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 24.9 m -62.25 -39.91 94.42 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.616 -0.883 . . . . 10.0 108.616 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -66.49 -19.81 65.88 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.284 -0.871 . . . . 10.0 110.451 178.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 30.1 mt -76.37 -32.97 58.91 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 108.529 -0.915 . . . . 10.0 108.529 177.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 -74.16 -42.59 59.68 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 178.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -68.17 -14.09 62.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.624 -0.717 . . . . 10.0 109.852 178.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -94.67 -53.72 3.77 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.171 -0.922 . . . . 10.0 108.989 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 43.5 mt -60.32 -28.92 68.52 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.711 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -54.19 -73.03 0.45 Allowed Glycine 0 CA--C 1.518 0.256 0 N-CA-C 111.37 -0.692 . . . . 10.0 111.37 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.32 -34.9 98.67 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.391 2.061 . . . . 10.0 111.177 178.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 12.6 t -58.87 -50.0 81.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.273 -0.422 . . . . 10.0 111.08 179.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 18.4 p -70.22 -38.2 75.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.66 0.267 . . . . 10.0 110.805 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -60.52 -48.32 82.27 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.816 -0.439 . . . . 10.0 109.816 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -67.39 -37.75 83.61 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.077 -0.511 . . . . 10.0 109.624 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -63.19 -36.91 85.2 Favored 'General case' 0 C--O 1.225 -0.188 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 28.4 m95 -66.27 -42.9 87.79 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 178.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -65.17 -37.31 86.98 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.972 -0.751 . . . . 10.0 108.972 178.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -65.28 -44.79 86.9 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.702 -0.851 . . . . 10.0 108.702 177.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 46.9 mt -62.38 -32.43 73.24 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.469 -0.787 . . . . 10.0 109.371 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -66.37 -41.6 89.23 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 178.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 53.0 mttp -64.72 -45.27 87.22 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 108.423 -0.954 . . . . 10.0 108.423 178.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -61.2 -48.42 81.63 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.051 -0.977 . . . . 10.0 110.734 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 10.7 p -66.17 -38.6 88.44 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.826 -0.17 . . . . 10.0 111.195 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -61.59 -47.59 84.76 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.843 -0.799 . . . . 10.0 108.843 178.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -63.87 -46.5 91.49 Favored Glycine 0 N--CA 1.443 -0.889 0 N-CA-C 110.048 -1.221 . . . . 10.0 110.048 177.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 34.6 mt -58.61 -33.26 69.81 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-O 120.517 0.199 . . . . 10.0 110.925 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -70.32 -38.29 74.9 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 178.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -71.39 -30.54 66.24 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.017 -0.735 . . . . 10.0 109.017 178.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -75.29 -57.56 3.82 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.253 -0.885 . . . . 10.0 109.782 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 95.7 mmm -61.71 -29.21 69.95 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 113.743 1.016 . . . . 10.0 113.743 -178.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 5.5 p -63.15 -51.87 64.72 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -71.62 -36.23 70.71 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.587 -0.733 . . . . 10.0 109.531 178.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -57.29 -57.72 11.39 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.503 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 24.9 mt -64.18 -37.13 86.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.568 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -62.67 -49.94 73.16 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 178.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -66.14 -34.02 77.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.661 -0.7 . . . . 10.0 109.662 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 2.6 t -60.96 -46.93 95.63 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.232 0 N-CA-C 109.367 -0.605 . . . . 10.0 109.367 178.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 83.9 mttt -67.21 -38.38 85.21 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 178.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -70.35 -11.69 61.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.318 178.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 43.3 mttm -98.76 -50.1 4.35 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 63.0 t -58.22 -41.71 81.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.688 -0.687 . . . . 10.0 111.998 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -53.95 -63.52 2.57 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 112.213 0.449 . . . . 10.0 112.213 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -70.98 -20.9 28.5 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 121.643 1.562 . . . . 10.0 111.789 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -70.0 -50.85 37.4 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 17.5 mt -69.47 -36.31 76.45 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.061 -0.518 . . . . 10.0 109.915 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -62.13 -40.45 95.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.286 0.565 . . . . 10.0 110.558 179.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -79.33 -42.67 25.16 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.621 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -63.31 -40.89 98.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.662 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -62.44 -36.61 82.97 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.446 179.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 17.9 mttp -67.35 -40.6 85.84 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.054 -0.721 . . . . 10.0 109.054 178.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 15.5 mtmm -65.7 -43.74 88.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.324 178.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 23.6 m0 -66.39 -34.4 77.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.15 178.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -67.0 -53.03 35.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.281 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . 0.517 ' O ' ' CG ' ' C' ' 469' ' ' LEU . 4.1 pt-20 -63.3 -31.61 72.8 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.076 0.465 . . . . 10.0 110.295 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -73.83 -37.82 64.72 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.188 -0.671 . . . . 10.0 109.188 178.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -45.73 88.9 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.743 -0.836 . . . . 10.0 108.743 178.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -62.42 -40.45 96.58 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.498 -0.927 . . . . 10.0 108.498 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . 0.772 ' CD1' ' CG ' ' A' ' 308' ' ' ARG . 96.4 mt -61.92 -40.16 94.53 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 115.169 -0.923 . . . . 20.0 110.0 178.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 13.8 m-30 -67.23 -41.26 86.0 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.501 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -60.82 -48.57 81.21 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.34 28.12 0.47 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.595 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.99 -62.78 0.71 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.383 -0.826 . . . . 10.0 109.028 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 61.8 t -65.66 -39.11 83.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.26 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -62.42 -58.62 16.18 Favored Pre-proline 0 CA--C 1.535 0.394 0 N-CA-C 112.061 0.393 . . . . 10.0 112.061 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -63.52 -37.88 45.39 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 121.649 1.566 . . . . 10.0 111.389 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 29.2 mt -66.98 -31.38 71.91 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.49 179.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -63.56 -36.19 82.98 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -70.89 -43.31 68.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.492 178.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.95 -43.61 95.29 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 59.1 mt -68.95 -30.48 68.94 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.551 -0.75 . . . . 10.0 110.195 178.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -66.97 -47.54 71.27 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -69.26 -34.27 74.51 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -68.21 -40.94 87.56 Favored Glycine 0 N--CA 1.445 -0.724 0 N-CA-C 109.873 -1.291 . . . . 10.0 109.873 177.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.41 76.72 Favored 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 44.8 mtt180 -61.73 -41.56 97.8 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.69 -44.22 94.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.363 178.007 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -67.14 -40.4 86.74 Favored 'General case' 0 C--N 1.33 -0.249 0 O-C-N 123.276 0.36 . . . . 10.0 110.355 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 45.6 mt -64.76 -44.51 89.83 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.349 -0.611 . . . . 10.0 109.349 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.04 -39.19 91.48 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 108.795 -0.817 . . . . 10.0 108.795 178.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -61.71 -49.97 74.31 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 108.133 -1.062 . . . . 10.0 108.133 177.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 90.3 mt -58.89 -37.34 76.36 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.872 -0.603 . . . . 10.0 110.674 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -63.69 -37.05 85.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.91 0.386 . . . . 10.0 110.151 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -88.93 -0.88 57.78 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.626 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 12.3 mttm -113.37 -55.75 2.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.817 0.341 . . . . 10.0 110.998 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 90.8 mt -64.96 -31.52 72.8 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.913 0.709 . . . . 10.0 112.913 -178.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 12.8 m -68.14 -59.09 6.69 Favored Pre-proline 0 CA--C 1.537 0.459 0 C-N-CA 120.722 -0.391 . . . . 10.0 112.005 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -62.63 -36.63 62.8 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.745 1.63 . . . . 10.0 110.866 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 34.5 mt -71.04 -34.96 71.77 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.095 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -65.7 -49.56 58.96 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 110.725 -0.95 . . . . 10.0 110.725 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.11 -41.63 97.03 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 178.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -64.84 -47.61 77.34 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.493 -0.776 . . . . 10.0 109.819 179.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 62.9 mmm -59.44 -38.05 79.7 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.752 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 20.5 mtt85 -64.98 -40.47 95.03 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 178.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.63 -36.1 73.27 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 178.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 44.3 mtt180 -62.87 -45.86 90.57 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 107.442 -1.318 . . . . 10.0 107.442 177.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -62.21 -38.73 90.29 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 114.857 -1.065 . . . . 10.0 109.361 178.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 78.7 mtt180 -58.3 -53.57 56.81 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -60.08 -36.14 76.73 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.485 -0.78 . . . . 10.0 111.144 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 16.2 m-70 -74.47 -49.64 21.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.577 0.227 . . . . 10.0 111.549 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 79.2 t -65.74 -41.67 90.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 120.715 0.293 . . . . 10.0 110.509 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -63.97 -37.41 87.32 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.48 -44.78 86.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.344 -0.984 . . . . 10.0 108.344 177.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 89.2 mt -58.99 -32.67 69.89 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.372 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 66.4 mtt180 -65.04 -34.7 79.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.326 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.3 5.19 46.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.684 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 44.2 m170 -117.22 -43.97 2.81 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.848 0.314 . . . . 10.0 111.848 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 92.1 mt -90.07 -47.83 7.57 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.409 0.522 . . . . 10.0 112.409 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -50.54 -55.37 26.68 Favored Pre-proline 0 N--CA 1.468 0.472 0 N-CA-C 112.904 0.705 . . . . 10.0 112.904 -179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -64.91 -31.8 56.0 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 121.692 1.595 . . . . 10.0 110.701 178.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -64.11 -43.85 94.06 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.725 -0.67 . . . . 10.0 109.786 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.85 -31.24 71.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.001 0.429 . . . . 10.0 109.968 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -70.02 -39.14 75.97 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.425 -0.583 . . . . 10.0 109.425 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -72.38 -33.23 67.05 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 177.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 25.3 mt -66.89 -29.13 68.94 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.541 -0.754 . . . . 10.0 109.23 177.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -60.91 -38.62 86.37 Favored 'General case' 0 C--O 1.224 -0.249 0 N-CA-C 109.681 -0.489 . . . . 10.0 109.681 178.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -66.95 -44.47 80.5 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.831 -0.803 . . . . 10.0 108.831 178.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 77.6 mtt180 -63.85 -41.77 97.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 114.849 -1.069 . . . . 10.0 110.662 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 62.1 mt -68.09 -43.18 79.08 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.256 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.87 -43.51 98.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.922 179.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.3 -45.1 77.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.361 -0.381 . . . . 10.0 110.153 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 1.1 ttm180 -61.9 -40.58 95.96 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 18.9 mt -64.29 -36.6 84.64 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.021 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -66.37 -40.92 90.02 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.839 -0.43 . . . . 10.0 109.839 178.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.26 -45.8 86.49 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 178.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 91.6 mt -69.94 -19.05 63.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.539 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 64.7 tttt -82.23 -44.37 16.42 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.662 -0.496 . . . . 10.0 109.662 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -68.6 -50.23 53.17 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -67.97 -37.58 81.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.727 -0.669 . . . . 10.0 109.388 179.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -65.75 -43.04 94.84 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.251 -0.74 . . . . 10.0 111.251 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -63.18 -42.54 99.39 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 110.399 -1.08 . . . . 10.0 110.399 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -64.3 -42.69 96.24 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 44.4 mtt85 -60.14 -39.54 86.71 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.367 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 79.8 mt -58.62 -42.23 87.76 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.92 -45.33 74.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.754 -0.657 . . . . 10.0 109.437 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -60.0 -48.49 81.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.318 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -59.72 -39.84 86.03 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.261 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 40.5 m170 -65.98 -43.26 88.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.449 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.48 -44.8 85.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.091 -0.504 . . . . 10.0 109.876 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.85 -27.33 66.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.256 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.62 -44.7 73.66 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.163 -0.68 . . . . 10.0 109.163 178.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.94 -38.19 85.71 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.702 -0.481 . . . . 10.0 109.702 178.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -63.86 -36.71 84.83 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -72.05 -45.65 59.97 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.105 178.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 63.1 mt -61.68 -38.74 88.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.099 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 33.9 m -64.4 -46.35 83.68 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.5 -0.318 . . . . 10.0 110.38 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 1.1 p -69.47 -26.94 64.81 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.103 0.477 . . . . 10.0 110.694 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 54.2 mt -77.91 -25.84 48.68 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.391 178.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 56.7 m -64.59 -41.24 96.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.042 0.449 . . . . 10.0 111.112 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -72.96 -11.47 60.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.176 0.512 . . . . 10.0 111.005 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -104.51 -28.13 11.48 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.792 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -83.96 -18.49 37.09 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.433 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -112.29 -74.9 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.348 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -52.92 -49.19 18.45 Favored 'Trans proline' 0 C--N 1.359 1.081 0 C-N-CA 122.171 1.914 . . . . 10.0 112.517 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.18 95.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.698 0.285 . . . . 10.0 110.923 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 49.5 tp -66.78 -38.87 87.41 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.579 -0.282 . . . . 10.0 110.46 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . 0.524 ' O ' ' CG ' ' C' ' 571' ' ' GLN . 4.0 mm-40 -59.06 -45.56 90.46 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.671 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -68.91 -41.59 77.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.449 178.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 43.6 mt -58.98 -44.93 91.66 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.837 0.351 . . . . 10.0 110.123 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -68.85 -35.54 77.07 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.576 -0.528 . . . . 10.0 109.576 178.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . 0.524 ' CG ' ' O ' ' C' ' 567' ' ' GLU . 98.6 mt-30 -66.28 -30.68 71.16 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.447 -0.797 . . . . 20.0 111.346 179.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -84.02 -35.76 14.73 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 109.429 -1.468 . . . . 10.0 109.429 178.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 17.8 mt -62.28 -34.47 76.63 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 122.044 0.138 . . . . 10.0 111.302 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 91.4 mt -55.63 -63.25 3.34 Favored Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 112.003 0.372 . . . . 10.0 112.003 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -67.38 -29.25 38.34 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.877 1.718 . . . . 10.0 111.708 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 4.7 t -64.9 -45.21 95.49 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 N-CA-C 109.343 -0.614 . . . . 10.0 109.343 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 26.7 mt -64.5 -39.51 93.93 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.614 -0.513 . . . . 10.0 109.614 178.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -63.17 -51.19 67.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.056 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 4.7 p -62.19 -41.33 98.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.779 0.323 . . . . 10.0 110.343 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -61.7 -48.27 81.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.072 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -58.75 -46.77 86.7 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.406 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.95 -48.49 83.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.887 0.375 . . . . 10.0 110.286 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 16.2 m -61.62 -44.06 97.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.109 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -66.97 -41.18 87.3 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.521 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 73.2 mt -59.28 -51.28 70.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.875 0.369 . . . . 10.0 110.483 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 13.1 m -63.87 -35.23 79.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.652 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -67.8 -45.35 75.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.574 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 86.2 mt -65.11 -37.03 86.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.011 0.434 . . . . 10.0 110.311 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -66.6 -29.77 69.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.461 179.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -79.5 -44.66 20.81 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.046 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -63.59 -41.89 98.32 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.805 0.669 . . . . 10.0 112.805 -179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 2.1 p -60.69 -28.59 68.74 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.836 0.31 . . . . 10.0 111.836 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -69.19 -40.21 78.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.043 0.449 . . . . 10.0 110.499 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 5.1 mptt -76.68 -37.61 55.9 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.96 -0.564 . . . . 10.0 111.105 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 90.1 mt -85.36 34.53 0.57 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.649 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.515 -0.755 . . . . 10.0 110.007 -179.445 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 14.6 t . . . . . 0 C--O 1.237 0.405 0 CA-C-O 120.774 0.321 . . . . 10.0 110.601 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -116.29 101.37 8.62 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.884 -0.413 . . . . 10.0 109.884 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -73.7 144.49 45.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.676 -178.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 4.0 mptt -100.37 113.91 27.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.493 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 34.3 mt -110.01 108.9 19.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.49 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 58.8 t -101.89 115.09 43.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-O 120.961 0.41 . . . . 10.0 110.918 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 21.3 t -91.73 117.74 35.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 26.8 m -112.88 165.45 7.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 120.995 0.426 . . . . 10.0 111.327 -179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 151.07 174.23 21.8 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.21 -0.756 . . . . 10.0 111.21 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.16 177.29 6.01 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.922 0.391 . . . . 10.0 111.271 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.84 125.64 8.48 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.873 -0.679 . . . . 10.0 111.775 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 115.24 -12.98 19.19 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.775 -0.726 . . . . 10.0 112.514 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 20.9 m -72.54 -31.73 38.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 112.003 0.371 . . . . 10.0 112.003 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 93.65 43.4 3.94 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.54 -0.838 . . . . 10.0 113.204 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 42.0 mtmt -62.13 -46.88 87.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.854 0.359 . . . . 10.0 111.64 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.5 p -63.26 -36.52 83.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.465 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.48 -47.15 82.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.653 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 45.1 mt -62.69 -44.27 96.67 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.918 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 12.7 m -64.88 -50.15 67.67 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.672 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 97.4 mt -65.43 -28.26 43.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-O 120.782 0.325 . . . . 10.0 110.999 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -68.29 -22.62 64.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.153 0.501 . . . . 10.0 110.8 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.7 tp -96.93 -41.48 8.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.306 0.574 . . . . 10.0 110.481 179.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 51.1 mm -73.88 -49.16 35.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.691 -0.686 . . . . 10.0 112.506 -178.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -107.83 -18.92 13.69 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.092 0.404 . . . . 10.0 112.092 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 66.61 35.22 5.45 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.468 -0.938 . . . . 10.0 108.468 -177.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -124.53 130.99 53.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 114.183 -1.371 . . . . 10.0 109.628 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -93.51 134.76 35.45 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.456 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 16.7 m -100.43 138.41 24.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.996 0.427 . . . . 10.0 111.031 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -103.46 -26.57 12.82 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.508 0.671 . . . . 10.0 109.838 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -78.38 148.31 33.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.384 -0.826 . . . . 10.0 110.726 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -91.47 77.64 5.74 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.651 -0.5 . . . . 10.0 109.651 178.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.85 134.91 68.06 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.094 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.49 177.17 3.48 Favored 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 123.081 2.521 . . . . 10.0 112.849 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -166.72 135.37 2.82 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.199 0.523 . . . . 10.0 112.163 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 4.3 mt -119.98 -67.01 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 108.551 -0.907 . . . . 10.0 108.551 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -146.08 92.39 2.19 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.372 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 -111.79 160.84 16.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.379 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.7 p -148.1 139.89 23.88 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.643 -0.253 . . . . 10.0 111.594 -179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . 0.417 ' CE2' ' CG2' ' D' ' 840' ' ' VAL . 24.3 m-85 -125.53 145.28 50.18 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -178.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -126.81 127.98 45.85 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.754 0.311 . . . . 10.0 111.561 -178.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 37.9 tttp -151.24 150.69 30.87 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.589 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -114.07 125.2 53.71 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 110.326 -0.249 . . . . 10.0 110.326 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 10.3 m -136.19 158.83 38.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.965 0.412 . . . . 10.0 110.848 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 47.2 t -99.77 107.11 20.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.414 -0.587 . . . . 10.0 109.414 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 72.7 mt -106.19 120.01 56.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.82 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.88 16.1 7.71 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.808 0.67 . . . . 10.0 112.808 178.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.21 -9.03 45.64 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.755 -0.736 . . . . 10.0 112.666 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -106.97 124.33 49.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.037 0.446 . . . . 10.0 110.665 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 9.5 t -85.75 128.1 34.71 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.101 -0.499 . . . . 10.0 109.742 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 1.6 p -144.71 163.05 35.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.866 0.365 . . . . 10.0 111.42 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 15.1 tp -97.5 135.75 38.91 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.09 -0.708 . . . . 10.0 109.09 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 90.6 mt -113.6 122.72 48.06 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 111.986 0.365 . . . . 10.0 111.986 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -103.53 102.33 12.23 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.103 -1.073 . . . . 10.0 108.103 177.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 44.8 mt -93.58 129.52 43.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.447 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 53.4 tp -105.94 116.0 31.2 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.943 -0.572 . . . . 10.0 111.206 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -92.97 93.2 8.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.236 179.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 48.7 p -72.61 162.71 29.13 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.203 -0.908 . . . . 10.0 112.155 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.6 159.07 32.68 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.232 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -80.05 -32.07 37.03 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.747 -0.739 . . . . 10.0 111.918 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -139.24 128.45 23.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.618 0.247 . . . . 20.0 110.541 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -169.92 142.88 2.46 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.591 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -100.98 -141.33 0.34 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.252 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -68.22 122.43 18.3 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 13.5 t -144.99 125.08 13.61 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.172 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.27 -31.79 72.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.111 0.482 . . . . 10.0 109.909 179.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 40.7 mmm -70.86 -44.52 66.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.691 -0.686 . . . . 10.0 109.599 179.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 47.9 ttt85 -63.27 -44.86 93.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.71 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.25 -20.84 57.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.677 -0.692 . . . . 10.0 111.593 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.93 -47.92 6.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.114 179.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . 0.253 0.5 OUTLIER -66.01 -28.52 68.94 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 113.121 0.786 . . . . 10.0 113.121 -178.968 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 2.7 mtp -91.82 4.07 53.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.185 0.517 . . . . 10.0 110.609 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 11.7 ttm180 -98.33 -28.35 13.7 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.135 0.493 . . . . 10.0 110.402 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.6 -5.7 53.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.615 -0.72 . . . . 10.0 112.119 -179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -83.15 144.16 22.46 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.552 -0.832 . . . . 10.0 112.701 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -96.68 -49.28 5.16 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.033 0.444 . . . . 10.0 110.005 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -112.19 139.61 15.73 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 111.203 -0.759 . . . . 10.0 111.203 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -121.25 123.58 42.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.166 0.507 . . . . 10.0 111.999 -179.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 45.0 mt -95.4 108.72 20.94 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.107 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 11.4 m -84.58 88.93 7.36 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.991 -0.374 . . . . 10.0 109.991 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 43.7 t -90.52 127.72 42.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.78 -178.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -132.78 159.38 39.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.108 178.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -96.04 119.86 35.29 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.993 -0.373 . . . . 10.0 109.993 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 13.1 pt -69.6 -5.45 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 112.231 0.456 . . . . 10.0 112.231 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -94.33 -1.8 53.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.984 0.421 . . . . 10.0 110.949 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -138.86 112.34 8.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.244 -0.434 . . . . 10.0 110.693 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.18 -33.73 72.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.024 -0.535 . . . . 10.0 111.939 -179.519 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 38.6 tptt -62.07 -34.56 76.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.108 0.48 . . . . 10.0 110.368 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 31.8 t -67.27 -30.21 70.03 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.091 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -80.72 -38.6 28.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.372 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -72.02 -23.26 61.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.833 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.43 -3.57 53.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.525 -0.307 . . . . 10.0 111.549 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 22.4 mm -61.48 -39.73 83.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.278 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 28.9 t60 -64.16 -33.57 76.1 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 5.1 t-160 -60.95 -39.91 91.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.443 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -74.66 -39.84 61.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.654 179.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -56.2 -44.57 79.58 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.185 -0.462 . . . . 10.0 110.359 179.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -66.34 -40.27 89.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.883 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -64.81 -47.9 76.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.482 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 58.6 mt -62.89 -44.71 99.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.883 0.373 . . . . 10.0 110.25 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 13.1 tttp -59.37 -37.84 78.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.302 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 65.4 ttp85 -67.5 -47.21 70.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.779 -0.646 . . . . 10.0 112.109 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 34.1 m -71.35 -25.85 25.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 112.672 0.619 . . . . 10.0 112.672 -178.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -95.14 -10.28 31.07 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 25.8 t0 58.79 22.88 10.59 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.486 0.66 . . . . 10.0 111.309 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 4.6 m -144.47 151.88 39.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.85 -0.613 . . . . 10.0 110.647 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -92.76 -38.49 11.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.147 0.498 . . . . 10.0 110.895 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -81.43 62.54 5.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.459 0.647 . . . . 10.0 112.382 -178.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 49.1 t -101.46 132.92 21.22 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.74 -0.664 . . . . 10.0 109.243 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -57.11 104.7 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.94 2.426 . . . . 10.0 112.382 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 43.2 mtt -130.88 143.63 50.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.881 -0.599 . . . . 10.0 109.695 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 92.4 t -128.29 127.67 67.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.612 -0.514 . . . . 10.0 109.612 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 18.9 tp -81.0 120.91 25.38 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 40.3 t -118.52 117.66 55.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.904 0.383 . . . . 10.0 111.426 -178.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.71 99.59 2.1 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 110.237 -1.145 . . . . 10.0 110.237 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -88.9 163.71 15.49 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.889 0.329 . . . . 10.0 111.889 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 30.4 mtpt 70.83 38.87 1.12 Allowed 'General case' 0 C--O 1.231 0.096 0 CA-C-N 115.257 -0.883 . . . . 10.0 112.258 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 28.2 p -76.21 2.0 14.37 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.077 -0.511 . . . . 10.0 111.441 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -95.18 -4.58 45.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.458 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 46.7 mt -80.89 139.21 49.87 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.846 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -68.72 -27.81 31.39 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.757 2.305 . . . . 10.0 112.583 -179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 2.1 m -85.07 59.01 5.36 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.388 0.514 . . . . 10.0 112.388 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 36.7 ttm-85 -72.11 100.62 2.57 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.217 -0.66 . . . . 10.0 109.217 178.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.7 m -88.75 -31.54 18.36 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.618 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 25.0 t -102.08 117.59 47.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.051 179.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -79.35 151.34 31.06 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.366 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 6.7 m -56.84 -37.12 70.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.416 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -64.29 -42.24 96.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.86 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -62.04 -47.75 83.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.202 0.525 . . . . 10.0 110.305 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -62.98 -44.49 95.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.653 -0.703 . . . . 10.0 111.269 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -68.15 -33.1 73.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.539 -0.3 . . . . 10.0 111.427 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.94 -43.0 99.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.392 0.615 . . . . 10.0 109.852 178.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 14.5 tp -67.21 -46.76 72.89 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.476 -0.784 . . . . 10.0 110.014 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.51 -43.06 99.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.833 -0.621 . . . . 10.0 110.844 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -60.59 -34.14 73.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.947 -0.569 . . . . 10.0 110.8 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 20.7 m -73.14 -27.13 61.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.47 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -90.41 -14.52 32.76 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.131 0.491 . . . . 10.0 110.957 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 79.97 32.33 36.49 Favored Glycine 0 N--CA 1.446 -0.661 0 N-CA-C 111.351 -0.699 . . . . 10.0 111.351 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 45.8 pt -127.38 153.98 77.2 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 110.164 -0.31 . . . . 10.0 110.164 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -79.49 157.26 25.33 Favored 'Trans proline' 0 CA--C 1.531 0.351 0 C-N-CA 122.593 2.195 . . . . 10.0 112.408 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -127.27 126.72 43.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.373 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 34.4 mm -121.19 124.69 72.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.317 -0.402 . . . . 10.0 110.164 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -86.63 125.44 33.84 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 107.525 -1.287 . . . . 10.0 107.525 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 71.5 p -134.96 173.82 11.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.51 0.93 . . . . 10.0 113.51 -176.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 13.3 t -155.97 108.39 2.62 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.347 -1.297 . . . . 10.0 108.054 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -61.85 -27.07 68.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.275 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -68.69 -41.69 78.82 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.457 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 27.3 p -98.57 -4.83 33.24 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.869 0.322 . . . . 10.0 111.869 -178.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 26.5 ttt-85 66.33 14.37 9.65 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.904 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.11 116.72 16.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.563 -178.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 82.53 5.29 89.64 Favored Glycine 0 N--CA 1.452 -0.299 0 N-CA-C 114.517 0.567 . . . . 10.0 114.517 177.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 67.8 t -58.83 -50.71 78.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 117.187 0.494 . . . . 10.0 111.713 -179.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -69.71 -42.33 74.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.789 0.328 . . . . 10.0 110.362 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.52 -45.48 69.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.726 -0.67 . . . . 10.0 112.235 -178.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.84 -50.58 73.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.833 0.349 . . . . 10.0 111.652 -179.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -67.48 -42.49 82.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.264 -0.426 . . . . 10.0 111.609 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -61.99 -40.25 94.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.845 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 46.9 m -66.61 -36.39 82.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.615 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 32.8 tp -60.46 -48.56 81.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.353 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 46.6 t -62.55 -35.83 72.03 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.153 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 22.7 ttm-85 -63.77 -45.32 90.33 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.609 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -63.09 -39.33 94.4 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.997 0.427 . . . . 10.0 110.343 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 85.9 mt -61.21 -49.32 85.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.172 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -62.51 -46.67 87.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.895 -0.593 . . . . 10.0 111.957 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -59.12 -43.58 91.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.976 0.417 . . . . 10.0 110.937 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 48.5 t-80 -63.92 -40.92 97.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.704 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -66.14 -43.36 87.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.372 -0.376 . . . . 10.0 111.031 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -62.48 -37.3 85.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.034 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 41.4 tttp -65.73 -35.11 79.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.055 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 80.1 mtp -64.81 -23.82 67.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.183 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 1.9 m . . . . . 0 C--N 1.331 -0.234 0 CA-C-O 121.376 0.608 . . . . 10.0 109.88 179.127 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.506 0 N-CA-C 112.291 -0.323 . . . . 10.0 112.291 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 1.5 p -132.91 164.82 26.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.461 0.172 . . . . 10.0 110.593 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 91.5 t -118.64 123.23 71.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 120.756 0.312 . . . . 10.0 110.488 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -87.95 107.88 18.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.278 -0.419 . . . . 10.0 109.883 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 43.5 t -94.9 129.33 45.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.477 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -96.3 136.24 37.04 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.61 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 58.4 mt -107.32 153.23 41.3 Favored Pre-proline 0 C--N 1.319 -0.73 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.155 -178.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.82 56.64 4.2 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.929 2.419 . . . . 10.0 111.111 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -157.2 32.6 0.29 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.227 -0.897 . . . . 10.0 109.998 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 9.8 ttpt 58.29 28.31 16.49 Favored 'General case' 0 CA--C 1.529 0.163 0 O-C-N 123.788 0.68 . . . . 10.0 110.311 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -138.44 -177.58 4.91 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 114.421 1.267 . . . . 10.0 114.421 -177.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.88 171.11 18.28 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.01 -0.996 . . . . 10.0 112.01 -177.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 14.6 t -152.22 138.81 18.69 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 107.449 -1.315 . . . . 10.0 107.449 178.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 4.0 t -104.53 114.2 43.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 120.059 -0.656 . . . . 10.0 111.553 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 35.2 m -103.31 162.38 4.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.761 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 5.2 m -96.23 140.4 30.97 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.532 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 6.4 t -68.17 121.65 17.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 110.132 -0.322 . . . . 10.0 110.132 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -126.34 113.01 16.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.451 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -67.27 145.55 55.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.285 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 90.29 -38.99 3.14 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.827 -0.701 . . . . 10.0 112.08 -179.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 57.6 ttm -68.39 144.82 54.6 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.651 0.262 . . . . 10.0 110.702 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.77 162.8 12.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.556 -0.293 . . . . 10.0 111.279 -179.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 86.0 t -55.17 -41.51 60.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.186 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -56.35 -32.99 65.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.941 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -75.87 -57.49 3.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.502 -0.317 . . . . 10.0 111.634 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.44 -42.72 99.66 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.688 -179.106 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -74.24 -17.78 60.83 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 113.089 0.774 . . . . 10.0 113.089 -179.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -61.71 -50.12 73.73 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.641 -0.424 . . . . 10.0 109.973 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 35.4 tttt -68.46 -26.96 65.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.648 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -77.22 -22.27 52.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.07 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 37.3 mt -94.52 -43.85 8.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.044 0.449 . . . . 10.0 110.452 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -63.91 -18.39 64.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.857 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 840' ' ' VAL . . . . . 0.417 ' CG2' ' CE2' ' B' ' 40' ' ' TYR . 3.2 p -52.69 -22.96 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 O-C-N 123.801 0.688 . . . . 10.0 112.321 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 15.9 ptp180 -139.15 17.09 2.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.01 0.433 . . . . 10.0 111.809 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 82.05 35.89 19.95 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.955 -0.641 . . . . 10.0 114.592 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 98.7 mt -99.78 149.64 23.15 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 117.427 0.614 . . . . 10.0 110.326 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -119.53 148.55 43.16 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.04 0.448 . . . . 10.0 111.661 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -67.29 -9.1 37.43 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.454 -0.794 . . . . 10.0 112.835 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -94.87 -2.55 50.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.026 0.441 . . . . 10.0 111.901 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 91.3 m -129.17 5.16 5.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.237 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 67.5 m -142.84 147.83 36.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.697 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 12.8 p -130.01 151.05 35.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 17.4 t -108.07 134.06 51.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.059 0.456 . . . . 10.0 111.764 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -109.22 141.97 40.72 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.816 -0.629 . . . . 10.0 109.721 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 31.7 mtm-85 -98.67 135.12 40.63 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.968 -0.752 . . . . 10.0 108.968 178.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 1.7 mt -82.25 81.39 8.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.92 0.39 . . . . 10.0 111.702 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 37.7 mt -88.08 87.78 2.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.549 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 23.0 mmtt 50.83 55.89 8.84 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.438 0.903 . . . . 10.0 113.438 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 86.53 -0.77 87.05 Favored Glycine 0 CA--C 1.518 0.255 0 C-N-CA 120.84 -0.695 . . . . 10.0 114.116 178.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -115.11 135.76 53.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 117.406 0.603 . . . . 10.0 111.011 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -92.92 99.69 12.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.528 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 4.5 m -98.34 134.0 41.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.702 -0.226 . . . . 10.0 110.744 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 43.0 t -66.19 130.5 31.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.643 0.258 . . . . 10.0 110.845 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 1.8 t -108.12 153.05 23.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.857 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -88.53 149.84 23.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.155 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 99.8 m95 -73.5 -30.06 62.89 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.655 0.613 . . . . 10.0 112.655 -179.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -80.3 -10.65 59.76 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.821 0.675 . . . . 10.0 112.821 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 5.3 m -67.89 143.79 55.55 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.15 -0.315 . . . . 10.0 110.15 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -74.93 149.56 39.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.74 0.305 . . . . 10.0 110.684 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 7.9 tp -88.16 2.62 5.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.615 0.721 . . . . 10.0 110.498 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -63.53 -51.54 66.18 Favored Pre-proline 0 CA--C 1.539 0.543 0 N-CA-C 113.162 0.801 . . . . 10.0 113.162 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -76.53 14.44 1.21 Allowed 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.162 1.908 . . . . 10.0 112.961 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -98.18 33.0 2.28 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.368 0.604 . . . . 10.0 110.761 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -72.41 116.55 13.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.809 -0.632 . . . . 10.0 111.2 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 73.52 32.0 60.18 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 121.039 -0.6 . . . . 10.0 112.5 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -119.89 152.85 36.72 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.19 -0.3 . . . . 10.0 110.19 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -108.69 135.18 50.36 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.007 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 77.3 mt -113.55 127.47 56.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.55 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 6.3 mt -118.4 117.63 55.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.107 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 12.9 t -87.89 137.69 20.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 109.96 -0.385 . . . . 10.0 109.96 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -135.0 154.98 51.54 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.371 -0.603 . . . . 10.0 109.371 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 10.3 m -80.56 153.58 4.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 116.537 -0.302 . . . . 10.0 110.291 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 50.8 mt . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.365 -0.826 . . . . 10.0 110.863 -179.85 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 85.5 mt . . . . . 0 C--O 1.219 -0.524 0 CA-C-O 120.39 0.138 . . . . 10.0 111.172 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 29.8 mtm180 -70.65 -42.0 71.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.995 0.426 . . . . 10.0 110.818 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -71.04 -32.93 69.8 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.459 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -80.64 -41.98 22.93 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.712 -0.677 . . . . 10.0 111.011 179.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 1.6 mmm -63.24 -33.49 75.61 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.62 0.248 . . . . 10.0 111.176 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.8 p -65.36 -41.53 93.75 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.106 -0.701 . . . . 10.0 109.106 178.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -71.44 -43.96 65.72 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.7 -0.852 . . . . 10.0 108.7 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.77 -57.69 9.95 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.419 -0.81 . . . . 10.0 109.564 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 47.1 mt -60.33 -44.74 95.21 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.738 -0.665 . . . . 10.0 111.459 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -59.78 -52.32 65.97 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.475 0.178 . . . . 10.0 111.319 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -63.1 -45.66 91.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.365 -0.38 . . . . 10.0 110.389 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 36.1 t -61.92 -44.33 98.73 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.399 0 CA-C-N 116.447 -0.342 . . . . 10.0 111.455 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -70.54 -48.02 57.52 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.811 0.3 . . . . 10.0 111.811 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -60.52 -40.61 92.06 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.913 0.387 . . . . 10.0 110.829 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt -82.55 -22.33 34.99 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.156 -0.474 . . . . 10.0 111.719 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.91 -26.08 39.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 C-N-CA 121.152 -0.219 . . . . 10.0 110.842 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 20.5 mt-30 -63.08 -61.62 7.06 Favored Pre-proline 0 CA--C 1.531 0.225 0 CA-C-N 116.257 -0.429 . . . . 10.0 109.865 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -62.32 -30.56 81.15 Favored 'Trans proline' 0 C--N 1.359 1.092 0 C-N-CA 121.778 1.652 . . . . 10.0 110.96 177.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -61.74 -54.21 45.62 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.225 0.536 . . . . 10.0 109.7 178.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 79.6 mt -67.95 -46.32 71.75 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 115.397 -0.82 . . . . 10.0 111.207 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -60.18 -39.77 87.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.822 0.344 . . . . 10.0 111.766 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -62.07 -50.63 71.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.112 0.482 . . . . 10.0 110.021 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -69.71 -30.38 68.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.819 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -66.15 -48.08 71.95 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.582 179.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 11.4 mtmt -59.21 -43.08 92.28 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.206 -0.665 . . . . 10.0 109.206 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -65.64 -46.39 79.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.234 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -34.61 74.66 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.535 -0.302 . . . . 10.0 110.404 179.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -65.17 -49.3 70.35 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.058 -0.719 . . . . 10.0 109.058 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -61.7 -41.77 98.03 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -61.68 -46.63 88.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.767 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 5.6 mmt -65.05 -43.87 90.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.652 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 79.8 mt-10 -62.01 -48.6 79.59 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.738 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 66.3 mt -66.61 -35.1 79.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.667 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -63.43 -52.34 61.9 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 46.6 mtt180 -63.12 -39.52 94.94 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 179.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -56.55 -32.93 65.64 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.472 -0.786 . . . . 10.0 110.096 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -90.0 -35.23 15.64 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.478 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 7.6 t -54.45 -40.5 49.49 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.168 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -57.58 -63.29 3.95 Favored Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 111.966 0.358 . . . . 10.0 111.966 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -63.42 -37.23 50.46 Favored 'Trans proline' 0 C--N 1.357 1.018 0 C-N-CA 121.956 1.77 . . . . 10.0 111.798 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 29.4 mt -65.69 -36.55 83.97 Favored 'General case' 0 C--N 1.334 -0.088 0 C-N-CA 121.052 -0.259 . . . . 10.0 110.676 179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -71.53 -34.67 70.26 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.124 -1.065 . . . . 10.0 108.124 178.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -63.83 -41.91 97.75 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.38 -0.97 . . . . 10.0 108.38 177.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -61.22 -46.19 91.45 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.064 -0.717 . . . . 10.0 109.064 177.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 97.0 mt -60.9 -43.62 98.26 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.163 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -63.03 -53.49 52.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.172 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -57.95 -51.12 70.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.287 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -60.53 -46.4 94.47 Favored Glycine 0 N--CA 1.443 -0.837 0 CA-C-N 115.604 -0.726 . . . . 10.0 112.248 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.96 -38.76 89.73 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.644 0.222 . . . . 10.0 110.573 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -59.25 -42.97 92.35 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -71.87 -55.6 7.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.614 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 34.4 mttt -54.87 -46.6 74.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.922 -0.581 . . . . 10.0 111.957 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 78.4 mt -70.8 -32.37 69.43 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 121.259 -0.176 . . . . 10.0 111.023 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.25 -41.51 94.23 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -64.44 -35.15 79.99 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.852 -0.796 . . . . 10.0 108.852 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 79.2 mt -68.43 -38.54 81.3 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.585 -0.734 . . . . 10.0 109.923 178.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -63.18 -37.75 88.47 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.217 -0.661 . . . . 10.0 109.217 178.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -72.23 5.65 2.7 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.094 -0.957 . . . . 10.0 111.117 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -125.02 -36.55 2.53 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.254 178.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 76.8 mt -60.53 -41.81 95.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.399 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 19.5 m -81.38 -64.38 0.28 Allowed Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -55.7 -58.35 1.15 Allowed 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 122.306 2.004 . . . . 10.0 112.853 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 81.3 mt -67.36 -31.16 71.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.699 0.285 . . . . 10.0 110.673 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -65.95 -44.7 91.21 Favored Glycine 0 N--CA 1.449 -0.479 0 N-CA-C 111.334 -0.706 . . . . 10.0 111.334 178.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -60.63 -37.79 82.63 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -64.25 -44.9 90.35 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 178.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 5.6 tpt -62.96 -42.97 99.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.222 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -64.56 -38.13 89.94 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 109.122 -0.696 . . . . 10.0 109.122 178.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -66.56 -43.66 84.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.196 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 11.3 mmt180 -68.76 -26.75 65.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.736 -0.665 . . . . 10.0 109.361 178.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -69.97 -32.0 70.0 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 15.6 mtp180 -62.89 -46.4 88.0 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 107.906 -1.146 . . . . 10.0 107.906 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -66.85 -41.11 87.91 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.434 -0.803 . . . . 10.0 109.633 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -56.14 -49.1 74.9 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.123 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 97.2 t -73.91 -39.76 52.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 115.762 -0.653 . . . . 10.0 111.419 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.87 -42.88 98.76 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.249 0.547 . . . . 10.0 110.232 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -65.1 -33.39 75.91 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.212 178.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 40.5 mt -71.15 -37.66 72.23 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.712 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 81.1 mtt180 -61.02 -53.41 57.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.138 0.494 . . . . 10.0 110.207 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.98 2.69 6.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.337 -0.847 . . . . 10.0 112.245 -179.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.42 -51.64 2.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.65 0.262 . . . . 10.0 110.771 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 91.5 mt -65.04 -35.82 82.4 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.374 -0.375 . . . . 10.0 111.547 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -57.19 -60.4 9.78 Favored Pre-proline 0 CA--C 1.536 0.432 0 C-N-CA 121.138 -0.225 . . . . 10.0 111.316 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -65.0 -33.36 51.51 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 121.603 1.535 . . . . 10.0 111.214 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -62.25 -50.58 71.17 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-N 116.594 -0.276 . . . . 10.0 110.866 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 21.1 p -68.8 -34.25 75.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.356 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -66.03 -41.01 91.5 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -68.87 -36.0 77.58 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.315 -0.995 . . . . 10.0 108.315 177.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 29.3 mt -60.72 -35.05 75.36 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 109.302 -0.629 . . . . 10.0 109.302 178.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 -63.56 -40.81 97.95 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.941 -0.763 . . . . 10.0 108.941 178.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -70.22 -41.98 72.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.027 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 13.6 mtp180 -63.89 -45.75 87.95 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.8 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 64.6 mt -65.85 -37.56 86.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.1 179.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.9 -46.73 88.09 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -60.83 -44.98 96.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.956 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 20.5 mtt180 -62.86 -47.73 82.1 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.144 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 68.1 mt -64.39 -33.82 76.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 10.0 111.432 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -69.81 -44.05 70.81 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.913 -0.403 . . . . 10.0 109.913 178.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.73 -44.33 77.86 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 71.0 mt -66.09 -20.89 66.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.765 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -75.58 -49.06 19.71 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -67.59 -39.06 84.83 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 36.3 t-20 -67.22 -42.61 83.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.285 -0.87 . . . . 10.0 108.921 178.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -62.16 -42.94 99.73 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.564 -0.744 . . . . 10.0 111.566 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.93 -40.75 97.28 Favored Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 110.445 -1.062 . . . . 10.0 110.445 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -67.78 -42.85 81.02 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 178.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 23.5 mtt180 -62.86 -43.54 98.54 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.736 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 13.5 mt -65.02 -46.64 80.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.504 -0.317 . . . . 10.0 110.861 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.02 -43.99 97.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.036 0.446 . . . . 10.0 110.105 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -67.09 -47.48 71.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.142 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -62.05 -33.48 74.46 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 121.115 -0.234 . . . . 10.0 110.445 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.22 -40.84 86.46 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.818 -0.808 . . . . 10.0 108.818 178.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -66.13 -46.16 78.49 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.426 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 19.4 mttm -63.3 -29.51 70.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.761 -0.654 . . . . 10.0 109.946 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.95 -46.37 74.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.988 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.8 -37.17 85.65 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 121.015 0.436 . . . . 10.0 109.891 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -67.74 -41.54 83.25 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -60.63 -48.29 82.45 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 108.841 -0.8 . . . . 10.0 108.841 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 84.3 mt -59.62 -37.81 79.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.986 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 53.9 m -61.87 -56.78 15.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.231 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 17.8 m -63.17 -35.35 79.99 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.41 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 19.7 mt -65.89 -36.4 83.31 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.453 -0.34 . . . . 10.0 110.24 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 70.2 m -65.76 -31.53 72.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.095 0.474 . . . . 10.0 110.524 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -73.93 -8.16 55.05 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 121.377 0.608 . . . . 10.0 109.928 179.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 44.7 mttm -107.93 -38.31 5.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.104 178.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.74 -26.01 63.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.564 -0.743 . . . . 10.0 111.897 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -106.46 -74.29 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 112.794 0.664 . . . . 10.0 112.794 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -56.91 -53.17 5.36 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 122.115 1.876 . . . . 10.0 113.175 -178.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -61.56 -43.77 98.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.674 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 6.5 mt -65.57 -36.26 83.26 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.979 -0.288 . . . . 10.0 110.791 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -63.36 -41.4 98.84 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.88 -39.84 94.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.352 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 84.9 mt -65.63 -40.73 92.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.406 178.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -67.28 -40.78 86.17 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -66.2 -26.73 67.53 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.22 -0.9 . . . . 20.0 111.222 178.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -81.67 -40.3 11.03 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 109.261 -1.536 . . . . 10.0 109.261 178.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 14.2 mt -61.55 -31.65 71.69 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.963 0.357 . . . . 10.0 111.963 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 38.3 mt -54.55 -64.62 1.81 Allowed Pre-proline 0 CA--C 1.537 0.479 0 O-C-N 122.969 0.168 . . . . 10.0 111.027 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -69.26 -32.45 20.64 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.866 1.711 . . . . 10.0 111.364 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 3.9 t -59.38 -49.11 84.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.721 -0.218 . . . . 10.0 110.453 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 37.1 mt -63.92 -31.82 73.13 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.179 -0.464 . . . . 10.0 109.92 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -67.41 -50.91 57.46 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 178.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 1.2 p -59.99 -34.86 73.9 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 120.952 0.406 . . . . 10.0 110.06 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 5.9 m-30 -69.71 -44.7 69.84 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 115.892 -0.594 . . . . 10.0 110.043 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -61.81 -42.46 99.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.491 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 74.7 t -59.58 -43.31 90.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.745 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.4 p -75.04 -37.87 61.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.582 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 14.3 m-30 -66.42 -44.21 83.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.691 0.282 . . . . 10.0 110.489 179.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 51.5 mt -59.17 -43.07 92.12 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.549 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 1.8 p -71.33 -46.63 60.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.229 -0.442 . . . . 10.0 110.769 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -56.66 -41.15 76.74 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.143 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 58.4 mt -59.33 -41.53 89.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.016 0.436 . . . . 10.0 110.378 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -71.78 -37.91 70.38 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.78 -46.16 78.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.442 178.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -65.59 -44.37 86.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.112 0.482 . . . . 10.0 110.432 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 55.8 m -60.17 -45.14 94.11 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.641 -0.709 . . . . 10.0 111.81 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 30.1 mtmt . . . . . 0 CA--C 1.531 0.228 0 N-CA-C 112.678 0.622 . . . . 10.0 112.678 -178.753 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 15.6 tp . . . . . 0 C--O 1.228 -0.055 0 N-CA-C 111.802 0.297 . . . . 10.0 111.802 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 92.2 mt -61.32 -44.18 97.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.995 0.426 . . . . 10.0 110.078 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -74.87 -38.51 61.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.748 179.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -58.01 -47.0 84.35 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.959 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 13.0 m95 -59.59 -36.26 75.92 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.478 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -64.42 -46.9 81.21 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 109.483 -0.562 . . . . 10.0 109.483 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.16 -40.65 90.65 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.862 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.05 -37.93 81.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.74 178.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 63.0 m -64.44 -49.5 71.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.238 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 7.3 m -63.74 -25.39 68.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.911 0.386 . . . . 10.0 111.799 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 18.0 p -92.74 -5.36 51.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.829 0.347 . . . . 10.0 111.029 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -98.37 -37.72 9.51 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.92 -0.77 . . . . 10.0 108.92 178.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 2.5 p -62.58 -47.32 84.35 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 109.151 -0.685 . . . . 10.0 109.151 178.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 23.3 mttm -63.18 -29.25 70.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.551 -0.749 . . . . 10.0 110.33 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 9.0 mt -66.5 -43.3 85.71 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -69.14 -40.67 78.1 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.628 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -58.81 -42.8 90.0 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -43.23 74.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.459 -0.791 . . . . 10.0 109.953 178.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 37.7 mt -57.5 -33.14 67.73 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.893 -0.594 . . . . 10.0 112.062 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -53.09 -78.52 0.11 Allowed Glycine 0 CA--C 1.521 0.455 0 C-N-CA 121.34 -0.457 . . . . 10.0 112.079 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -53.42 -38.14 82.5 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 122.941 2.427 . . . . 10.0 111.829 178.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 16.0 t -58.96 -46.86 91.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-N 116.548 -0.297 . . . . 10.0 111.342 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 27.9 p -72.49 -33.5 66.99 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 120.84 -0.344 . . . . 10.0 110.459 179.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -56.51 -54.38 46.5 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.033 0.444 . . . . 10.0 109.825 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -71.47 -31.31 67.0 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.43 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -62.6 -39.1 92.66 Favored 'General case' 0 N--CA 1.461 0.114 0 N-CA-C 109.433 -0.58 . . . . 10.0 109.433 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 23.2 m95 -67.95 -35.48 78.46 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.021 -0.733 . . . . 10.0 109.021 178.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -67.85 -35.4 78.5 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.454 -0.943 . . . . 10.0 108.454 177.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -66.5 -39.96 88.97 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.312 -0.996 . . . . 10.0 108.312 177.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.68 -33.47 75.71 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.689 -0.856 . . . . 10.0 108.689 177.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -70.01 -41.01 74.89 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.193 -0.669 . . . . 10.0 109.193 177.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 18.0 mttt -61.68 -40.25 94.31 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.325 -0.991 . . . . 10.0 108.325 177.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -68.51 -48.8 63.45 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.94 -1.027 . . . . 10.0 111.022 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 3.3 p -64.01 -47.5 80.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.787 -0.188 . . . . 10.0 111.118 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -61.23 -41.26 96.57 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 110.448 -0.204 . . . . 10.0 110.448 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -66.3 -47.88 68.13 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.481 -1.048 . . . . 10.0 110.481 178.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 20.2 mt -63.89 -28.66 69.99 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 115.734 -0.233 . . . . 10.0 110.603 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 37.4 mtt180 -67.98 -33.42 74.6 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -72.9 -42.79 63.19 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 108.382 -0.97 . . . . 10.0 108.382 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.48 -55.35 16.02 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.159 -0.928 . . . . 10.0 110.957 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 69.5 mmm -58.18 -41.5 84.04 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 113.57 0.952 . . . . 10.0 113.57 -178.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 10.9 p -61.14 -52.54 64.45 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.513 -0.475 . . . . 10.0 109.934 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.99 -41.44 99.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.594 -0.73 . . . . 10.0 109.869 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -60.08 -50.81 72.23 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.393 -0.821 . . . . 10.0 110.29 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 43.5 mt -64.55 -46.29 83.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.941 -0.572 . . . . 10.0 112.153 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -59.5 -47.97 83.44 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.94 -0.304 . . . . 10.0 111.004 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 73.1 mt-10 -74.9 -17.33 60.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.921 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -86.06 -37.6 11.88 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 C-N-CA 120.899 -0.321 . . . . 10.0 110.715 178.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -68.65 -38.35 80.37 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.079 -0.711 . . . . 10.0 109.079 178.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -77.1 -0.87 26.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.526 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.0 -35.15 6.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.372 -0.831 . . . . 10.0 109.451 179.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 41.8 t -67.31 -37.08 78.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.069 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -56.09 -60.19 9.59 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.788 178.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -68.52 -20.6 41.16 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.572 1.514 . . . . 10.0 111.323 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -50.75 38.02 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.983 -0.747 . . . . 10.0 108.983 178.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 57.1 mt -66.45 -39.13 88.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.415 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -62.28 -49.13 76.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.247 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -67.06 -41.41 86.49 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.681 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.89 -47.64 82.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 10.0 109.939 179.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.36 -26.04 65.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.326 -0.397 . . . . 10.0 111.177 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 20.1 ttmt -67.92 -46.32 71.89 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.121 -1.066 . . . . 10.0 108.121 178.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 20.8 mtmm -71.59 -36.64 70.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.108 -0.951 . . . . 10.0 109.781 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 1.1 m0 -63.48 -44.0 95.65 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.575 -0.738 . . . . 10.0 109.927 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -65.7 -40.28 92.13 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 178.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . 0.761 ' O ' ' CG ' ' C' ' 469' ' ' LEU . 31.9 tt0 -58.19 -48.37 80.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.489 -0.778 . . . . 10.0 109.697 178.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -72.51 -36.49 68.37 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.388 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 3.8 mmt -61.66 -51.77 67.08 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 110.285 -0.265 . . . . 10.0 110.285 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.76 -39.08 93.39 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.618 -0.882 . . . . 10.0 108.618 178.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . 0.761 ' CG ' ' O ' ' C' ' 465' ' ' GLU . 96.5 mt -57.7 -50.09 74.34 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.369 -0.832 . . . . 20.0 109.602 178.251 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 18.3 m-30 -60.71 -40.04 90.79 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.132 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -64.51 -31.95 73.38 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.541 -0.299 . . . . 10.0 111.211 179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -92.93 -2.03 56.18 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.988 0.366 . . . . 10.0 111.988 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 53.8 mttm -114.28 -45.66 3.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.898 0.38 . . . . 10.0 111.213 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 88.0 t -69.23 -32.44 53.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.519 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -59.44 -59.98 12.05 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 121.066 -0.254 . . . . 10.0 110.723 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.0 -31.95 84.18 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 121.589 1.526 . . . . 10.0 110.458 177.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 8.0 mt -65.7 -37.89 87.71 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -64.81 -41.57 95.67 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 108.577 -0.897 . . . . 10.0 108.577 178.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.57 89.87 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.846 -0.616 . . . . 10.0 109.616 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.18 -41.58 98.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.67 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 22.9 mt -69.26 -30.32 68.42 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.993 -0.548 . . . . 10.0 109.837 178.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 -69.64 -60.07 2.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.09 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -62.95 -35.24 79.49 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -66.61 -43.21 92.63 Favored Glycine 0 N--CA 1.446 -0.666 0 N-CA-C 110.949 -0.86 . . . . 10.0 110.949 178.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -70.82 -35.76 72.62 Favored 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 109.308 -0.627 . . . . 10.0 109.308 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 66.1 mtt180 -62.45 -41.48 98.77 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 109.453 -0.573 . . . . 10.0 109.453 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -66.44 -46.67 75.66 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.809 -0.812 . . . . 10.0 108.809 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -63.47 -37.63 88.02 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.654 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 37.2 mt -68.46 -43.96 75.9 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -62.93 -37.6 87.69 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.408 -0.96 . . . . 10.0 108.408 178.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -62.04 -50.24 72.8 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 107.711 -1.218 . . . . 10.0 107.711 176.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 48.2 mt -58.01 -33.14 68.62 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 115.424 -0.807 . . . . 10.0 111.152 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -65.06 -40.88 95.35 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.936 -0.764 . . . . 10.0 108.936 178.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.54 7.61 16.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.291 179.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 16.1 mttm -116.88 -48.74 2.65 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 95.4 mt -71.58 -37.26 71.03 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.65 0.611 . . . . 10.0 112.65 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 4.9 m -65.51 -58.86 10.7 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 112.17 0.433 . . . . 10.0 112.17 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -62.93 -45.65 12.52 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 122.113 1.875 . . . . 10.0 111.621 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 18.7 mt -67.49 -35.01 78.32 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 121.1 -0.24 . . . . 10.0 110.656 179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.67 -48.35 62.62 Favored Glycine 0 N--CA 1.451 -0.314 0 N-CA-C 110.317 -1.113 . . . . 10.0 110.317 178.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -61.26 -38.21 85.89 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -68.29 -45.57 72.71 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.387 -0.824 . . . . 10.0 109.674 178.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 78.3 mmm -60.17 -34.43 73.58 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.887 -0.412 . . . . 10.0 109.887 179.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -66.63 -39.9 88.5 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.56 -0.533 . . . . 10.0 109.56 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -69.01 -42.09 76.91 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.787 -0.82 . . . . 10.0 108.787 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 -61.84 -44.7 96.31 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.341 -0.845 . . . . 10.0 108.858 178.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.9 -44.77 94.07 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.063 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 46.3 mtt85 -62.08 -44.41 96.72 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -69.15 -19.62 64.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.711 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 8.9 m170 -94.23 -57.81 2.4 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.94 0.4 . . . . 10.0 111.225 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 25.8 t -66.37 -43.36 91.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.985 -0.552 . . . . 10.0 112.375 -178.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -66.17 -33.0 74.77 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 120.194 -0.602 . . . . 10.0 109.919 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.65 -37.5 84.93 Favored 'General case' 0 C--O 1.222 -0.344 0 N-CA-C 107.606 -1.257 . . . . 10.0 107.606 177.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 84.6 mt -67.73 -27.93 67.22 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.566 178.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -70.56 -33.53 71.22 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.564 -0.532 . . . . 10.0 109.564 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.32 3.78 54.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.817 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 62.7 m170 -119.61 -49.72 2.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.844 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 79.7 mt -77.48 -36.34 52.82 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.46 0.541 . . . . 10.0 112.46 -179.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -57.37 -57.17 26.89 Favored Pre-proline 0 C--N 1.331 -0.211 0 C-N-CA 120.747 -0.381 . . . . 10.0 110.973 179.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -62.96 -34.36 71.33 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.21 1.273 . . . . 10.0 110.166 177.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 35.2 t80 -61.55 -45.81 92.59 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.767 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 12.1 p -63.86 -34.75 78.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.969 0.414 . . . . 10.0 110.392 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -70.79 -40.22 72.68 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.455 -0.572 . . . . 10.0 109.455 178.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -64.26 -40.3 95.7 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 108.451 -0.944 . . . . 10.0 108.451 178.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 35.6 mt -62.89 -38.53 91.27 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 115.3 -0.864 . . . . 10.0 109.655 178.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -58.3 -40.2 81.38 Favored 'General case' 0 C--O 1.226 -0.174 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.322 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -64.94 -49.35 70.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.979 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 44.4 mtt180 -64.25 -39.95 95.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.109 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 60.0 mt -70.22 -30.34 67.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.055 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -61.89 -48.09 82.04 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.78 -40.69 92.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.422 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -59.44 -46.76 87.84 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.669 -0.696 . . . . 10.0 109.94 178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 65.1 mt -66.15 -39.77 90.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.813 -0.631 . . . . 10.0 110.125 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -62.57 -39.41 93.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 10.0 109.935 178.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.41 -42.72 92.26 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.669 -0.863 . . . . 10.0 108.669 177.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.5 -24.45 67.14 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.1 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -79.18 -45.63 19.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.843 178.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -63.22 -52.17 63.3 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 54.2 m-20 -68.34 -30.71 69.73 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.569 -0.741 . . . . 10.0 109.519 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -65.79 -51.91 42.61 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.21 -0.756 . . . . 10.0 111.21 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -60.48 -38.25 94.55 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 110.734 -0.947 . . . . 10.0 110.734 178.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -63.42 -54.28 39.04 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.845 -0.798 . . . . 10.0 108.845 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 50.0 mtt180 -55.14 -41.76 72.16 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.61 179.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 55.8 mt -56.57 -50.43 71.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.667 0.27 . . . . 10.0 110.808 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.85 -47.53 68.69 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.023 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -60.72 -44.52 96.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.879 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -69.85 -37.89 76.3 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.015 -0.365 . . . . 10.0 110.015 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.4 m170 -63.5 -46.64 85.15 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.864 -0.421 . . . . 10.0 109.864 179.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -63.1 -45.6 91.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.978 -0.556 . . . . 10.0 109.527 178.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.12 -35.57 80.71 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.772 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -67.57 -36.8 81.63 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.28 -0.637 . . . . 10.0 109.28 178.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 18.1 m -63.06 -48.19 79.71 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 108.174 -1.047 . . . . 10.0 108.174 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -59.47 -43.49 93.24 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.023 178.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 39.6 t-80 -63.87 -31.79 73.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.63 -0.714 . . . . 10.0 111.397 179.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 60.4 mt -73.72 -49.02 27.71 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.167 -0.308 . . . . 10.0 110.167 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 5.5 m -62.12 -33.73 75.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.033 0.444 . . . . 10.0 110.629 179.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 33.2 p -83.45 -9.7 58.83 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.107 0.479 . . . . 10.0 110.944 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.51 -47.75 8.98 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.459 -1.311 . . . . 10.0 107.459 177.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 1.7 p -67.83 -23.22 65.14 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.442 -0.947 . . . . 10.0 108.442 177.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -57.92 -25.69 61.22 Favored 'General case' 0 CA--C 1.524 -0.045 0 CA-C-N 114.907 -1.042 . . . . 10.0 109.505 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -112.4 -33.94 6.03 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.571 -0.741 . . . . 10.0 110.35 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -61.16 -11.47 9.12 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.948 0.404 . . . . 10.0 111.896 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -98.09 -67.07 0.06 OUTLIER Pre-proline 0 C--N 1.325 -0.496 0 C-N-CA 120.913 -0.315 . . . . 10.0 111.316 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.92 -40.92 4.53 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 121.887 1.725 . . . . 10.0 113.467 -179.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -68.07 -42.78 79.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.496 0.189 . . . . 10.0 110.702 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 8.0 mt -64.01 -39.44 94.11 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.723 -0.391 . . . . 10.0 109.958 178.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -68.96 -33.32 73.51 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.855 -0.424 . . . . 10.0 109.855 178.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.04 -44.93 91.0 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.341 -0.985 . . . . 10.0 108.341 178.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 83.2 mt -67.19 -38.17 84.89 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.131 -0.94 . . . . 10.0 110.356 178.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -64.25 -38.18 90.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.452 0.644 . . . . 10.0 109.605 178.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -81.69 -10.31 59.42 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.408 -0.815 . . . . 20.0 111.285 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -92.23 -47.96 3.18 Favored Glycine 0 CA--C 1.521 0.432 0 N-CA-C 108.993 -1.643 . . . . 10.0 108.993 178.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 75.0 mt -61.54 -25.03 67.03 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.572 -0.314 . . . . 10.0 111.45 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 4.7 mt -60.07 -66.34 1.55 Allowed Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 121.191 -0.204 . . . . 10.0 111.038 178.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.98 -28.73 57.76 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 121.711 1.607 . . . . 10.0 111.094 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 5.7 t -64.39 -47.07 91.05 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 178.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 34.0 mt -67.38 -34.93 78.3 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.919 -0.4 . . . . 10.0 109.919 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -62.9 -47.85 81.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.315 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 4.2 p -71.21 -36.57 71.92 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.917 -0.401 . . . . 10.0 109.917 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.7 -43.65 98.44 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 178.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -62.06 -44.99 95.49 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 178.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 50.8 t -59.29 -44.24 91.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.204 0.526 . . . . 10.0 109.624 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 15.2 m -65.98 -45.18 82.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.706 -0.679 . . . . 10.0 111.05 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -69.68 -40.91 76.09 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.375 0.509 . . . . 10.0 112.375 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 52.7 mt -61.29 -40.27 93.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.865 0.364 . . . . 10.0 110.049 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 19.1 m -73.47 -37.43 65.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.078 -0.712 . . . . 10.0 109.078 178.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -58.89 -50.52 73.71 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.674 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.9 mt -62.82 -37.61 87.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.29 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -62.64 -46.5 87.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.337 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -63.81 -40.99 97.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.78 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -64.54 -42.99 95.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.879 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 1.6 p -69.49 -21.93 63.65 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.562 0.579 . . . . 10.0 112.562 -179.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -84.94 -14.86 46.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.306 0.574 . . . . 10.0 110.586 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.19 -48.98 4.22 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.76 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 89.2 mt -94.2 48.94 1.27 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.143 0.497 . . . . 10.0 110.478 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 . . . . . 0 C--O 1.251 1.146 0 CA-C-O 118.652 -0.69 . . . . 10.0 110.825 -179.067 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 120.643 0.258 . . . . 10.0 110.749 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.63 138.84 26.21 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.878 -0.786 . . . . 10.0 108.878 -179.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -140.16 127.28 20.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.061 0.457 . . . . 10.0 111.91 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -93.22 117.9 30.61 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.846 -0.798 . . . . 10.0 108.846 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 68.8 mt -110.69 118.24 35.64 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.206 0.527 . . . . 10.0 111.663 -178.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 39.6 t -95.71 112.05 27.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.437 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 38.6 t -94.32 116.0 34.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 109.596 -0.52 . . . . 10.0 109.596 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 21.2 m -105.33 167.54 2.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.425 -0.352 . . . . 10.0 111.336 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 150.56 165.69 12.92 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 111.458 -0.657 . . . . 10.0 111.458 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.26 169.06 14.15 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.726 0.298 . . . . 10.0 111.025 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -77.75 61.32 3.67 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.298 -0.477 . . . . 10.0 112.373 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -153.83 -32.06 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 111.027 -0.829 . . . . 10.0 111.027 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 21.4 m -77.2 166.68 2.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 110.205 -0.294 . . . . 10.0 110.205 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -83.77 54.96 5.0 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.756 -0.735 . . . . 10.0 113.498 -179.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 18.5 mtmt -60.62 -61.99 2.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.989 0.423 . . . . 10.0 111.204 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.8 p -63.99 -36.27 83.41 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.82 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.58 -50.0 75.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.113 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 63.8 mt -61.31 -42.68 99.07 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.831 0.348 . . . . 10.0 110.767 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 13.7 m -61.24 -49.21 78.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.953 -0.567 . . . . 10.0 111.002 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 67.4 mt -67.39 -32.49 57.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.79 0.328 . . . . 10.0 110.591 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -67.68 -18.61 65.0 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.121 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.8 tp -99.11 -37.88 9.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.208 0.528 . . . . 10.0 110.656 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 45.8 mm -76.04 -68.92 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.408 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -85.89 -21.55 27.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.061 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 66.97 34.53 5.17 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.971 -178.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -127.45 126.97 43.29 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.252 -0.886 . . . . 10.0 109.277 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -78.19 133.44 37.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.93 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 3.4 m -107.62 123.71 63.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.762 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -89.08 -29.32 19.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.589 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -68.31 135.01 51.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.463 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -87.33 94.42 9.67 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.979 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -98.11 130.68 28.0 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 109.486 -0.561 . . . . 10.0 109.486 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -64.14 178.08 1.69 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.97 2.447 . . . . 10.0 112.454 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.2 m -163.69 141.73 7.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.225 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 5.3 mt -118.7 -65.19 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 108.654 -0.869 . . . . 10.0 108.654 179.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -148.77 93.45 2.12 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.093 -0.706 . . . . 10.0 109.093 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -114.13 160.95 18.38 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.654 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 4.5 m -146.53 140.41 26.14 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.971 0.415 . . . . 10.0 112.021 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . 0.476 ' CE2' ' CG2' ' D' ' 840' ' ' VAL . 2.8 m-85 -129.67 152.43 49.19 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 109.336 -0.616 . . . . 10.0 109.336 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -141.47 137.25 31.99 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 122.076 -0.39 . . . . 10.0 110.826 -178.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -155.92 147.51 22.87 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -102.16 125.62 48.9 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.782 -0.451 . . . . 10.0 109.782 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 15.6 m -136.97 158.26 36.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.847 0.356 . . . . 10.0 111.074 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 24.7 t -95.63 101.71 12.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 109.179 -0.674 . . . . 10.0 109.179 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 54.5 mt -92.26 105.28 16.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.453 -178.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 57.25 36.63 27.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.5 -0.773 . . . . 10.0 111.728 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.1 -15.32 62.67 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.772 -0.728 . . . . 10.0 113.611 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -106.13 109.05 20.86 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.874 0.337 . . . . 10.0 111.07 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 11.1 t -76.04 143.52 41.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.561 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 1.4 p -165.0 162.41 20.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.378 -179.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 17.6 mt -95.06 129.49 42.13 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 89.6 mt -110.03 122.09 46.77 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.958 -0.297 . . . . 10.0 111.552 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.404 ' CG ' HE21 ' D' ' 818' ' ' GLN . 7.8 t70 -99.25 100.9 12.05 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.067 -1.086 . . . . 10.0 108.067 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 32.1 mt -88.86 126.02 41.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.346 -178.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 33.0 tp -101.1 116.31 32.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.778 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -92.48 98.94 11.78 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 40.1 p -77.92 164.92 24.7 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 113.004 0.742 . . . . 10.0 113.004 -178.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.63 163.59 23.41 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.219 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.63 -32.04 47.77 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.73 -0.747 . . . . 10.0 112.675 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -150.28 131.85 14.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.823 0.344 . . . . 20.0 111.218 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -133.46 158.35 43.32 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.527 -0.546 . . . . 10.0 109.527 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -92.68 -74.38 0.52 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.127 0.489 . . . . 10.0 109.722 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -162.99 61.01 0.19 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.364 -0.834 . . . . 10.0 109.096 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.49 126.82 31.58 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.415 -0.812 . . . . 10.0 111.486 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.07 -37.44 87.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.255 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 7.9 tmm? -63.11 -34.32 77.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.287 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 32.3 ttt85 -61.86 -46.7 88.31 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.396 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.61 -24.65 67.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.633 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -78.54 -44.4 24.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.767 -0.651 . . . . 10.0 111.115 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -70.95 -29.27 65.24 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 120.363 -0.535 . . . . 10.0 112.183 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 76.5 mtp -79.42 -15.22 58.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 10.0 109.996 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -74.01 -27.01 60.75 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.18 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 m -82.8 -33.2 27.32 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.689 0.625 . . . . 10.0 112.689 -178.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -57.29 148.28 33.7 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 114.445 0.538 . . . . 10.0 114.445 -178.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -111.21 -39.71 4.65 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-O 121.112 0.482 . . . . 10.0 109.8 178.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -118.51 138.11 13.47 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 110.998 -0.841 . . . . 10.0 110.998 179.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -129.58 143.08 50.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.051 0.453 . . . . 10.0 111.949 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 58.7 mt -99.85 122.21 42.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.144 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 6.7 m -88.87 78.88 7.49 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 21.5 t -82.91 118.66 30.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.547 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 18.8 p90 -134.75 158.93 42.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.855 -0.612 . . . . 10.0 109.712 178.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -97.29 130.69 44.45 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 27.7 pt -73.31 -5.25 6.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.015 0.436 . . . . 10.0 111.372 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.08 3.5 28.19 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.027 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -126.62 116.81 21.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.915 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.41 -32.36 71.29 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.283 0.475 . . . . 10.0 112.283 -178.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -60.97 -46.19 91.73 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 111.654 0.242 . . . . 10.0 111.654 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.73 -26.32 65.55 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.43 0.53 . . . . 10.0 112.43 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -70.54 -34.01 71.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.041 0.448 . . . . 10.0 110.138 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -85.71 -26.99 25.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.738 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.71 -17.07 64.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.439 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 43.6 mm -60.69 -45.82 96.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -67.71 -37.13 81.83 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 8.7 t-160 -61.42 -39.32 90.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.396 -0.82 . . . . 10.0 110.195 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -74.83 -46.72 34.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.526 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.97 -40.76 85.75 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.673 0.273 . . . . 10.0 111.27 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -65.32 -34.41 78.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.758 0.313 . . . . 10.0 111.144 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -69.25 -46.23 67.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.224 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 41.8 mt -68.29 -33.96 63.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.115 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 29.2 ttpt -60.43 -31.41 70.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.984 0.421 . . . . 10.0 110.642 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 44.9 ttp85 -78.21 -34.05 49.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.009 -0.542 . . . . 10.0 111.852 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 19.9 m -77.39 -32.11 18.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 112.405 0.52 . . . . 10.0 112.405 -179.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -95.92 -14.66 22.93 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.682 -0.407 . . . . 10.0 111.379 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 26.2 t0 58.85 48.15 11.6 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.496 0.665 . . . . 10.0 110.995 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 32.5 t -178.23 153.59 0.78 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.445 -0.798 . . . . 10.0 110.336 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 17.1 mp0 -91.82 -8.17 47.39 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 108.715 -0.846 . . . . 10.0 108.715 178.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -83.82 64.02 7.82 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 114.969 -1.014 . . . . 10.0 110.568 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 50.5 t -121.15 116.95 30.88 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.226 -0.897 . . . . 10.0 109.797 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.77 113.14 1.29 Allowed 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.927 2.418 . . . . 10.0 111.555 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 65.3 mtt -133.28 150.95 51.89 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.293 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 95.1 t -132.0 124.96 54.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 179.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 15.0 tp -75.6 121.09 21.91 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.8 -0.815 . . . . 10.0 108.8 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 60.8 t -114.8 111.5 36.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 112.026 0.38 . . . . 10.0 112.026 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -89.38 100.12 2.63 Favored Glycine 0 N--CA 1.449 -0.486 0 N-CA-C 109.746 -1.341 . . . . 10.0 109.746 178.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -86.67 153.13 21.99 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 112.544 0.572 . . . . 10.0 112.544 -177.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 77.4 mttt 70.38 46.39 0.58 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 114.919 -1.037 . . . . 10.0 113.442 178.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 15.5 p -78.78 -2.53 39.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.986 0.422 . . . . 10.0 111.404 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -92.67 0.56 57.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.967 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 17.7 mt -97.13 127.08 39.82 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.838 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.68 -26.59 68.7 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.999 2.466 . . . . 10.0 111.286 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.35 70.4 4.7 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.589 -0.732 . . . . 10.0 110.001 179.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 24.6 ttt180 -101.41 122.46 43.79 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.579 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.21 -49.43 4.48 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.361 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 62.1 t -78.67 116.51 22.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.665 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -73.3 153.48 40.54 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.028 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 2.3 m -60.15 -37.41 80.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.229 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 16.4 tttm -68.25 -36.93 80.21 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 121.174 -0.211 . . . . 10.0 111.092 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -60.26 -39.65 87.55 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.058 0.456 . . . . 10.0 110.188 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -71.93 -41.22 68.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.114 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -61.64 -37.09 82.71 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.895 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.89 -46.76 80.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.149 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 32.8 tp -64.36 -42.13 96.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.451 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.76 -44.56 95.89 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.967 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.59 -27.53 69.01 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.071 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.9 m -71.21 -25.73 62.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.074 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -99.8 -20.0 16.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.975 0.416 . . . . 10.0 110.376 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.89 21.49 52.82 Favored Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 111.018 -0.833 . . . . 10.0 111.018 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 49.1 pt -109.58 155.78 40.76 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.732 -0.234 . . . . 10.0 110.654 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -79.9 158.01 24.16 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.341 2.027 . . . . 10.0 111.97 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -120.76 122.95 41.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.553 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 24.0 mm -122.0 116.52 49.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.715 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -83.19 128.13 34.22 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.74 -0.837 . . . . 10.0 108.74 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 81.4 p -135.66 167.82 20.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.884 0.85 . . . . 10.0 112.987 -177.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 5.6 t -157.55 131.81 8.32 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.471 -1.24 . . . . 10.0 108.173 178.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -76.71 -14.56 59.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.842 0.353 . . . . 10.0 110.639 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -85.48 -44.43 12.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.954 -0.566 . . . . 10.0 111.111 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 48.9 p -86.05 -25.83 25.68 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.992 0.425 . . . . 10.0 110.368 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 14.2 ttt-85 66.07 27.55 10.55 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.435 -0.802 . . . . 10.0 110.682 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -91.9 127.53 37.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.262 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.35 7.22 67.49 Favored Glycine 0 C--O 1.228 -0.268 0 CA-C-N 115.977 -0.556 . . . . 10.0 113.939 178.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 95.3 t -66.57 -55.36 18.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.72 0.295 . . . . 10.0 111.63 -179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.46 -42.46 98.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.672 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -65.05 -31.77 73.16 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.319 0.489 . . . . 10.0 112.319 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.91 -46.67 89.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.107 0.48 . . . . 10.0 109.868 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -70.94 -40.03 72.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.384 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -62.92 -44.36 96.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.228 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 70.7 m -63.91 -33.68 76.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.859 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 58.1 tp -60.9 -42.82 98.76 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 47.8 t -69.76 -32.96 54.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.74 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 72.8 mtt180 -63.4 -41.19 98.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.557 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -64.65 -38.17 90.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 97.1 mt -67.02 -40.12 84.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.477 178.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 30.1 ttm180 -58.17 -46.52 85.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.584 -0.735 . . . . 10.0 109.701 179.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -70.39 -33.32 71.25 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.291 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -59.93 -41.79 92.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.756 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -68.22 -43.66 77.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.691 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -67.83 -33.52 74.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.078 0.466 . . . . 10.0 110.201 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -67.78 -28.92 68.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.704 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 54.8 ttp -62.01 -38.01 87.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.95 0.405 . . . . 10.0 111.233 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 49.9 m . . . . . 0 C--N 1.327 -0.398 0 CA-C-O 121.191 0.519 . . . . 10.0 111.077 179.634 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.134 -0.386 . . . . 10.0 112.134 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 11.8 p -122.7 145.83 48.04 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.667 0.27 . . . . 10.0 110.562 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 51.0 t -121.88 136.19 59.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.639 -0.255 . . . . 10.0 110.359 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 80.2 mttt -86.55 120.79 28.24 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.19 0.519 . . . . 10.0 110.862 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 44.7 t -105.65 123.55 60.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.493 179.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -91.15 137.26 32.5 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.038 0.447 . . . . 10.0 110.785 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 13.3 mt -105.46 153.22 39.91 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.388 -178.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -65.01 -13.71 41.29 Favored 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 123.263 2.642 . . . . 10.0 113.428 -179.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -90.27 37.92 0.92 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.967 -0.383 . . . . 10.0 109.967 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp 51.94 39.43 26.03 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.207 -0.906 . . . . 10.0 111.646 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 818' ' ' GLN . . . . . 0.475 HE22 ' C ' ' B' ' 40' ' ' TYR . 84.1 mt-30 -136.63 -169.51 2.48 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 114.515 1.302 . . . . 10.0 114.515 -177.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.85 167.73 27.36 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.123 -0.944 . . . . 10.0 111.539 -178.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 14.7 t -154.03 139.12 17.36 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.949 -1.13 . . . . 10.0 107.949 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 3.2 t -107.87 112.79 41.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 C-N-CA 120.443 -0.503 . . . . 10.0 111.202 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 5.6 t -110.22 148.91 13.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.54 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 2.6 m -88.68 108.33 19.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.115 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 61.5 t -77.7 121.18 29.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.942 0.401 . . . . 10.0 110.636 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 21.6 mtp85 -122.41 156.14 34.63 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.186 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -73.54 139.4 45.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.811 0.338 . . . . 10.0 110.766 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 110.82 -36.91 3.98 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.781 -0.724 . . . . 10.0 112.252 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 12.0 ptm -81.42 149.74 28.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.741 0.305 . . . . 10.0 110.61 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 97.9 p -100.03 176.3 5.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.952 0.406 . . . . 10.0 110.657 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 16.1 t -63.2 -36.82 77.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.193 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -62.47 -44.87 95.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.484 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -65.21 -47.52 76.58 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.048 0.452 . . . . 10.0 111.072 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 3.1 m -64.89 -43.0 94.33 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.769 -0.651 . . . . 10.0 112.416 -178.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.87 -16.63 56.8 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.31 0.856 . . . . 10.0 113.31 -178.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -59.23 -50.78 72.68 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.031 0.443 . . . . 10.0 111.01 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 5.5 mmmm -66.3 -25.92 67.08 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.387 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -80.11 -18.02 51.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.533 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 78.2 mt -100.68 -48.66 4.43 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.236 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -58.26 -33.16 69.08 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.983 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 840' ' ' VAL . . . . . 0.476 ' CG2' ' CE2' ' B' ' 40' ' ' TYR . 9.6 p -56.03 -22.63 13.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 115.805 -0.634 . . . . 10.0 112.096 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -119.53 13.23 12.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.586 -179.381 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 75.95 19.33 78.87 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.68 -0.771 . . . . 10.0 112.526 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 58.5 mt -92.65 175.51 6.79 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.935 -0.394 . . . . 10.0 109.935 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -152.22 155.15 37.19 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.382 -0.229 . . . . 10.0 110.382 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 22.4 mp0 -75.6 71.01 2.48 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.995 0.426 . . . . 10.0 111.054 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -129.4 -70.45 0.65 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.669 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -104.62 15.31 28.26 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.395 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 16.0 m -111.5 129.74 55.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.198 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 6.1 p -121.69 153.12 25.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.486 -0.324 . . . . 10.0 110.517 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 20.1 t -100.16 136.28 32.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.132 0.492 . . . . 10.0 111.523 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -112.83 135.01 54.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.687 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 61.1 mtp180 -78.97 131.4 36.32 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 178.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -106.73 114.12 28.03 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.121 0.486 . . . . 10.0 111.746 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 2.4 pt -150.75 141.21 16.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt 68.47 -53.29 0.55 Allowed 'General case' 0 N--CA 1.472 0.631 0 O-C-N 123.653 0.596 . . . . 10.0 112.567 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 167.09 -30.56 0.19 Allowed Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 111.21 -0.756 . . . . 10.0 111.21 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 11.9 mmt180 -83.68 150.64 25.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.749 0.309 . . . . 10.0 110.629 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 7.6 mptt -108.71 114.67 28.67 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.26 -0.427 . . . . 10.0 109.927 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.02 138.75 42.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.574 0.226 . . . . 10.0 111.212 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 1.6 t -62.99 146.9 12.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.95 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 1.8 t -134.2 160.59 37.39 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.165 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -99.35 157.62 16.28 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.502 -0.317 . . . . 10.0 110.417 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -78.79 -29.6 45.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.931 0.395 . . . . 10.0 111.127 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -89.25 50.03 1.86 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.992 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 1.3 m -123.91 153.1 41.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.823 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -67.59 141.49 56.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.83 0.348 . . . . 10.0 110.811 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 9.9 tp -91.86 -14.4 8.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.183 0.516 . . . . 10.0 111.08 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -55.28 -49.37 92.79 Favored Pre-proline 0 CA--C 1.541 0.62 0 N-CA-C 113.795 1.035 . . . . 10.0 113.795 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -68.89 -13.35 36.58 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 122.143 1.895 . . . . 10.0 113.058 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 8.8 mp -85.94 81.93 8.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.257 0.551 . . . . 10.0 110.557 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -139.52 123.4 17.63 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.107 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 87.68 15.6 61.36 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.911 -0.662 . . . . 10.0 112.02 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -127.09 159.44 34.2 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 122.871 -0.194 . . . . 10.0 110.613 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -102.47 174.07 6.07 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.092 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 93.1 mt -136.56 131.41 33.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.71 -0.223 . . . . 10.0 110.568 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 6.5 mt -117.11 129.09 74.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.585 -0.279 . . . . 10.0 110.301 179.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 24.3 t -102.64 126.92 56.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -140.79 179.22 6.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.95 0.405 . . . . 10.0 111.112 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 20.1 m -81.39 148.11 5.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.55 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 15.3 mt . . . . . 0 C--O 1.254 1.335 0 CA-C-O 118.402 -0.809 . . . . 10.0 111.063 -179.984 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 75.2 mt . . . . . 0 C--O 1.227 -0.131 0 CA-C-O 120.446 0.165 . . . . 10.0 111.153 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 54.2 mtm-85 -65.35 -50.03 67.14 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.648 -0.871 . . . . 10.0 108.648 178.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -64.73 -40.62 95.63 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.53 -0.915 . . . . 10.0 108.53 178.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -58.94 -51.9 68.05 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.202 -0.908 . . . . 10.0 110.715 179.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 62.3 mtm -63.84 -28.0 69.56 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.795 0.331 . . . . 10.0 110.818 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 56.6 m -70.78 -13.46 62.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.296 178.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 41.8 mttm -109.43 -53.31 2.67 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 108.64 -0.874 . . . . 10.0 108.64 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -52.14 -64.5 0.79 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.078 -0.965 . . . . 10.0 111.395 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 95.8 mt -57.98 -39.61 78.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.977 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -65.72 -44.45 86.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.682 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -64.85 -40.53 95.31 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.518 -0.549 . . . . 10.0 109.518 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 54.2 t -62.08 -51.36 73.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.451 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.016 178.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -66.16 -46.6 76.86 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.593 0.59 . . . . 10.0 112.593 -179.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.12 -43.87 97.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.187 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -80.32 -24.78 39.7 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.302 0.482 . . . . 10.0 112.302 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -62.64 -27.52 43.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.924 -0.31 . . . . 10.0 110.728 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -61.31 -62.0 6.8 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-N 116.526 -0.306 . . . . 10.0 110.591 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -67.56 -28.51 38.04 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 121.73 1.62 . . . . 10.0 111.569 178.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -66.1 -50.37 64.29 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 109.524 -0.547 . . . . 10.0 109.524 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 41.7 mt -68.92 -37.75 79.13 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.009 -0.542 . . . . 10.0 110.058 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -61.48 -44.55 96.88 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.497 -0.557 . . . . 10.0 109.497 178.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -58.57 -49.08 78.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.506 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -65.39 -46.39 80.26 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 115.466 -0.788 . . . . 10.0 110.934 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -58.93 -52.47 65.61 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 111.888 0.329 . . . . 10.0 111.888 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -57.05 -46.39 82.47 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 120.782 0.325 . . . . 10.0 111.289 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.08 -38.28 75.68 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.639 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 15.3 t90 -66.43 -36.58 83.17 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 179.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -63.23 -42.21 99.21 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.465 -0.939 . . . . 10.0 108.465 178.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -66.56 -39.78 88.69 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.855 -0.795 . . . . 10.0 108.855 178.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -60.21 -49.65 76.77 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.818 178.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 79.4 mmm -65.29 -44.67 87.22 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.703 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.91 -49.74 76.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.917 179.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 59.4 mt -64.2 -44.03 93.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.298 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -60.67 -47.35 86.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.222 -0.444 . . . . 10.0 109.979 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 32.1 ttm105 -65.14 -37.34 87.11 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.125 0.488 . . . . 10.0 110.083 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -35.81 81.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.403 -0.817 . . . . 10.0 109.559 178.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp -80.84 -34.57 33.74 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.138 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 12.0 t -51.78 -44.92 37.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 N-CA-C 112.112 0.412 . . . . 10.0 112.112 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -50.6 -64.05 1.52 Allowed Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 112.613 0.597 . . . . 10.0 112.613 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -70.89 -35.93 8.57 Favored 'Trans proline' 0 C--N 1.355 0.91 0 C-N-CA 121.846 1.698 . . . . 10.0 113.031 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 28.5 mt -63.71 -39.78 95.15 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 121.031 -0.268 . . . . 10.0 111.0 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -73.86 -29.72 62.27 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.952 -0.759 . . . . 10.0 108.952 178.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.45 -44.52 90.85 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.89 -0.782 . . . . 10.0 108.89 178.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -58.9 -42.27 89.16 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 108.711 -0.848 . . . . 10.0 108.711 178.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 95.0 mt -63.36 -46.16 87.81 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.244 -0.889 . . . . 10.0 110.431 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 16.6 mt-30 -62.27 -54.1 45.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.897 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -60.82 -44.74 96.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.08 0.467 . . . . 10.0 110.504 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.02 -44.07 97.91 Favored Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.689 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.83 -39.39 93.49 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 109.919 -0.4 . . . . 10.0 109.919 179.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -60.07 -42.57 94.83 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.476 179.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 14.1 tm0? -67.07 -49.69 64.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.176 -0.466 . . . . 10.0 109.999 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 33.6 mttp -59.42 -47.1 86.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.501 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 77.8 mt -66.31 -35.42 80.34 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.455 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -60.41 -50.17 74.64 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.12 -36.47 84.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.854 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 83.0 mt -71.51 -38.64 71.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.995 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -66.83 -41.93 86.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.473 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -77.72 2.37 17.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.268 0.556 . . . . 10.0 110.24 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 29.3 tttp -105.25 -37.45 6.88 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.859 -0.793 . . . . 10.0 108.859 178.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 13.7 mt -68.45 -24.57 64.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.359 -0.837 . . . . 10.0 111.053 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -62.59 1.71 Allowed Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.495 -0.32 . . . . 10.0 111.851 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -68.06 -51.55 0.61 Allowed 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 122.055 1.837 . . . . 10.0 112.445 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 60.2 mt -66.98 -26.65 66.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.704 0.287 . . . . 10.0 111.171 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -75.81 -40.11 31.98 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 109.35 -1.5 . . . . 10.0 109.35 177.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -64.65 -43.86 92.3 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.767 -0.827 . . . . 10.0 108.767 178.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -62.62 -40.15 96.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.441 -0.799 . . . . 10.0 108.909 178.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 14.7 tpt -61.75 -41.82 98.17 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 115.693 -0.685 . . . . 10.0 109.368 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 -64.78 -42.88 94.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.473 . . . . 10.0 109.963 178.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -63.44 -46.84 84.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.251 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -68.19 -33.67 74.87 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.406 179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -65.5 -39.34 91.77 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 178.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 44.8 mtt85 -60.22 -47.22 86.91 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.031 -0.729 . . . . 10.0 109.031 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -64.68 -43.09 94.68 Favored 'General case' 0 C--O 1.226 -0.184 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 178.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -53.45 -54.42 37.3 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.424 -0.807 . . . . 10.0 110.331 179.052 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 39.9 t -73.84 -38.68 50.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.396 -0.82 . . . . 10.0 112.053 -178.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.51 -40.95 98.41 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.889 0.376 . . . . 10.0 110.632 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -66.76 -28.99 68.85 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 177.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . 0.408 ' O ' ' N ' ' A' ' 320' ' ' LEU . 19.2 mt -74.28 -40.65 62.17 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.191 -0.913 . . . . 10.0 109.131 178.09 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -62.19 -47.1 85.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.975 0.416 . . . . 10.0 110.345 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 1.4 p -66.9 -15.24 63.52 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.618 -0.719 . . . . 10.0 111.664 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -103.27 -38.19 7.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.087 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . 0.408 ' N ' ' O ' ' A' ' 316' ' ' LEU . 39.9 mt -64.82 -34.72 79.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.387 -0.369 . . . . 10.0 111.19 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.94 -60.82 8.37 Favored Pre-proline 0 CA--C 1.535 0.395 0 O-C-N 123.213 0.32 . . . . 10.0 110.541 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -65.16 -30.06 55.51 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 121.524 1.482 . . . . 10.0 111.08 177.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -61.8 -56.42 19.67 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 110.249 -0.278 . . . . 10.0 110.249 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 17.0 p -66.72 -36.55 82.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.924 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -63.07 -48.61 77.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.3 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -71.57 -22.53 61.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.889 0.376 . . . . 10.0 110.009 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 14.2 mt -69.98 -28.09 65.24 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 177.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -65.0 -39.73 93.9 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 107.323 -1.362 . . . . 10.0 107.323 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -64.93 -39.56 93.69 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.007 -0.997 . . . . 10.0 108.729 177.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 10.5 mmt180 -62.19 -53.4 55.84 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 108.658 -0.867 . . . . 10.0 108.658 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 95.6 mt -54.59 -44.01 72.65 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.454 -0.793 . . . . 10.0 110.366 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -62.97 -48.55 78.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.412 -0.358 . . . . 10.0 110.522 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.18 -45.64 90.5 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.592 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 4.0 mmt85 -66.68 -46.2 76.41 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.942 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 5.2 mt -60.43 -41.37 93.85 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.797 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -58.72 -44.53 90.42 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.901 -0.407 . . . . 10.0 109.901 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -68.77 -42.53 77.31 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.662 -0.496 . . . . 10.0 109.662 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 71.6 mt -65.49 -24.38 67.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.398 179.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -89.5 -38.28 14.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.883 0.373 . . . . 10.0 110.841 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -72.94 -53.78 10.38 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.128 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -71.06 -32.52 69.23 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.509 -0.922 . . . . 10.0 108.509 178.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -63.46 -46.37 92.71 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.344 -0.844 . . . . 10.0 111.121 179.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.72 -41.2 98.92 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 109.975 -1.25 . . . . 10.0 109.975 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.62 -44.18 91.36 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -58.57 -45.07 89.81 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.397 179.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 87.4 mt -63.09 -51.25 67.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.816 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.24 -44.64 95.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.155 0.502 . . . . 10.0 110.373 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -65.5 -43.34 90.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.88 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -62.48 -36.22 81.79 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -64.86 -46.94 79.72 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.548 -0.538 . . . . 10.0 109.548 178.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -65.1 -41.46 94.95 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.246 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 16.1 mtmm -71.82 -16.91 62.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.481 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -86.67 -42.43 13.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.55 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.63 -40.29 96.52 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.948 -0.39 . . . . 10.0 109.948 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -71.14 -27.79 63.81 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.419 0.628 . . . . 10.0 109.461 178.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -73.75 -33.75 64.44 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.467 -0.938 . . . . 10.0 108.467 178.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 82.4 mt -78.68 -38.23 39.8 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.136 -0.938 . . . . 10.0 111.747 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 1.9 p -63.11 -45.89 89.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.923 0.392 . . . . 10.0 109.967 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 17.6 p -71.96 -15.98 62.08 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.473 0.654 . . . . 10.0 109.256 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 18.6 tp -84.32 -28.87 26.78 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.396 -0.82 . . . . 10.0 109.118 178.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 3.1 m -64.71 -34.27 77.92 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.107 -1.071 . . . . 10.0 108.107 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -73.55 -0.08 14.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.703 -1.135 . . . . 10.0 110.538 178.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -115.38 -37.06 4.13 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.548 -0.908 . . . . 10.0 108.548 177.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -75.29 -14.78 60.53 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.591 -0.731 . . . . 10.0 111.72 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -110.64 -71.19 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 120.73 -0.388 . . . . 10.0 112.028 179.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -59.4 -52.22 5.11 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.06 1.84 . . . . 10.0 112.322 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -62.82 -40.24 96.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.561 0.22 . . . . 10.0 111.468 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.75 -43.21 94.06 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.975 -0.38 . . . . 10.0 109.975 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -65.34 -34.82 79.22 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 109.744 -0.465 . . . . 10.0 109.744 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -44.7 91.96 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 178.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 82.5 mt -62.29 -40.71 97.16 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.333 178.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 65.0 mtt180 -62.91 -43.68 98.14 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.249 -0.648 . . . . 10.0 109.249 178.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -62.33 -26.61 68.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.257 -0.883 . . . . 20.0 112.564 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -89.23 -38.63 6.67 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 109.684 -1.366 . . . . 10.0 109.684 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 31.9 mt -58.1 -35.88 72.08 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.706 0.262 . . . . 10.0 111.706 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 35.3 mt -55.96 -65.38 1.56 Allowed Pre-proline 0 CA--C 1.538 0.507 0 N-CA-C 111.612 0.227 . . . . 10.0 111.612 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.9 -30.53 39.86 Favored 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 122.069 1.846 . . . . 10.0 111.783 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 4.3 t -64.89 -48.91 82.35 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 CA-C-O 120.514 0.197 . . . . 10.0 110.567 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 41.6 mt -64.22 -35.61 81.39 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -66.25 -53.7 33.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.799 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 5.5 p -60.54 -38.05 83.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.861 0.362 . . . . 10.0 110.464 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -63.12 -49.32 74.89 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.923 -0.58 . . . . 10.0 109.835 178.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -62.89 -42.22 99.69 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 116.483 -0.326 . . . . 10.0 110.863 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 48.0 t -58.43 -47.3 88.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 12.7 m -69.42 -38.96 78.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.148 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -67.36 -49.46 63.89 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.688 0.255 . . . . 10.0 111.688 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 92.1 mt -59.82 -41.34 91.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.49 -0.323 . . . . 10.0 111.233 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 22.6 p -72.23 -31.45 65.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.112 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -73.39 -33.89 65.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.904 0.383 . . . . 10.0 110.087 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 83.4 mt -60.2 -28.35 67.9 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.331 0.586 . . . . 10.0 109.913 179.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -65.78 -40.19 91.73 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.365 -0.834 . . . . 10.0 109.688 178.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.37 -47.4 84.34 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 120.86 0.362 . . . . 10.0 110.43 179.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -58.1 -46.32 85.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.465 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 10.5 m -65.21 -41.85 94.08 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.224 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt . . . . . 0 C--O 1.234 0.237 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.631 179.997 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 82.1 mt . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 120.712 0.291 . . . . 10.0 110.24 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 81.5 mt -66.04 -42.81 89.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.699 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -46.46 85.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.453 0.644 . . . . 10.0 109.857 179.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -62.92 -48.19 80.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.969 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 16.4 t90 -58.08 -37.74 75.05 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.104 -0.498 . . . . 10.0 112.173 -179.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -60.47 -41.39 94.09 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.071 0.462 . . . . 10.0 110.378 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 6.1 m -73.69 -19.93 60.68 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.595 -0.729 . . . . 10.0 110.623 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 54.6 t -74.19 -34.12 36.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.262 -0.644 . . . . 10.0 109.262 178.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.83 -39.37 83.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.188 178.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -44.46 84.3 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.176 -0.465 . . . . 10.0 109.949 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 2.2 p -66.49 -32.45 73.82 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.168 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.37 -39.32 92.13 Favored 'General case' 0 CA--C 1.521 -0.172 0 N-CA-C 108.494 -0.928 . . . . 10.0 108.494 177.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 73.5 m -64.9 -38.13 89.93 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -72.97 10.42 0.91 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.801 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 69.3 mt -124.78 -48.74 1.77 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.335 -0.987 . . . . 10.0 108.335 178.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -65.9 -49.69 67.14 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.231 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -69.14 -22.7 63.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.272 0.558 . . . . 10.0 109.883 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.93 -36.77 30.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.61 -0.723 . . . . 10.0 109.654 179.386 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 22.9 mt -60.69 -29.61 69.42 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.96 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -51.48 -73.85 0.34 Allowed Glycine 0 CA--C 1.519 0.332 0 C-N-CA 121.272 -0.49 . . . . 10.0 112.145 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.91 -36.06 98.85 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.629 2.219 . . . . 10.0 111.738 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 38.8 t -60.61 -49.8 82.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.795 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 23.9 p -70.89 -36.28 72.68 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.405 0.145 . . . . 10.0 110.728 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -55.94 -50.14 71.56 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.785 -0.821 . . . . 10.0 108.785 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 63.0 mt-10 -69.0 -40.76 78.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.18 -0.918 . . . . 10.0 109.93 178.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -58.54 -44.09 89.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.096 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 62.9 m95 -64.81 -38.93 92.63 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 178.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -63.53 -41.49 98.47 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.756 -0.831 . . . . 10.0 108.756 178.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -64.82 -43.66 92.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.337 -0.847 . . . . 10.0 109.463 178.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 33.4 mt -60.22 -35.06 74.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.052 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -65.94 -45.3 82.34 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 178.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 32.0 mttt -57.35 -46.33 83.44 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 108.57 -0.9 . . . . 10.0 108.57 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -60.11 -49.06 79.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.025 -0.988 . . . . 10.0 110.652 179.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 27.0 m -61.36 -44.75 96.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.438 -0.346 . . . . 10.0 111.002 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -64.79 -40.8 95.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.909 0.385 . . . . 10.0 110.215 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.94 -47.36 83.56 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.045 -1.222 . . . . 10.0 110.045 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 71.0 mt -60.71 -33.0 72.23 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -64.65 -48.79 73.53 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -62.99 -37.68 88.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.183 0.516 . . . . 10.0 110.08 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -67.66 -55.75 12.04 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.685 -0.688 . . . . 10.0 110.38 179.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 71.6 mtm -68.13 -28.37 67.26 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 114.555 1.317 . . . . 10.0 114.555 -177.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.8 p -62.48 -43.6 98.41 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.013 -0.675 . . . . 10.0 109.642 179.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -78.22 -42.28 31.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.165 178.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -57.62 -58.1 9.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.206 -0.906 . . . . 10.0 111.448 -179.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 93.0 mt -64.39 -41.58 96.59 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.077 0.399 . . . . 10.0 112.077 -178.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -62.57 -48.17 80.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.027 0.441 . . . . 10.0 110.021 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -68.61 -25.17 64.73 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 179.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 1.1 t -64.75 -42.84 96.08 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 N-CA-C 108.842 -0.799 . . . . 10.0 108.842 177.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -65.91 -34.53 78.33 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.225 -0.657 . . . . 10.0 109.225 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -81.0 0.21 36.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.4 -0.818 . . . . 10.0 111.265 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 56.7 mttm -117.47 -37.66 3.46 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.625 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 25.2 t -62.76 -41.41 92.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.28 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -57.93 -58.52 18.01 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 116.665 -0.243 . . . . 10.0 110.701 178.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -60.32 -36.44 87.5 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 122.199 1.932 . . . . 10.0 110.931 178.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -60.9 -49.38 77.71 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.876 179.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 53.8 mt -70.54 -37.78 74.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.985 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -63.66 -47.61 80.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.096 0.474 . . . . 10.0 109.97 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -68.73 -32.91 73.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.688 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -66.13 -42.75 88.69 Favored 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 108.446 -0.946 . . . . 10.0 108.446 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -62.74 -46.17 89.3 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.039 -0.726 . . . . 10.0 109.039 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 12.9 mtmt -57.13 -42.42 80.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.604 179.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 13.7 mtmm -72.57 -40.55 66.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.358 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -22.3 65.01 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.882 179.401 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 64.3 mt-30 -69.92 -44.2 70.12 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 107.949 -1.13 . . . . 10.0 107.949 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . 1.262 ' O ' ' CG ' ' C' ' 469' ' ' LEU . 26.0 mt-10 -68.72 -32.07 71.59 Favored 'General case' 0 C--O 1.226 -0.165 0 N-CA-C 108.895 -0.78 . . . . 10.0 108.895 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -69.78 -55.27 10.31 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.564 -0.743 . . . . 10.0 109.989 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 45.1 tpp -61.26 -56.95 14.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.628 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -63.63 -40.69 97.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.642 0.258 . . . . 10.0 110.478 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . 1.262 ' CG ' ' O ' ' C' ' 465' ' ' GLU . 96.4 mt -59.04 -47.4 85.35 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 115.836 -0.62 . . . . 20.0 110.438 179.087 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -68.02 -34.58 76.76 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.493 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -65.89 -43.61 87.78 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.21 -0.663 . . . . 10.0 109.21 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -69.24 -8.77 48.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.076 179.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -101.99 -51.76 3.33 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.048 178.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 69.3 t -67.16 -39.87 84.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.599 -0.728 . . . . 10.0 112.876 -178.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -54.4 -58.88 11.92 Favored Pre-proline 0 N--CA 1.464 0.264 0 C-N-CA 120.916 -0.314 . . . . 10.0 111.693 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -68.64 -28.01 31.67 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 121.378 1.385 . . . . 10.0 110.555 178.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.76 -40.83 92.46 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.631 -0.507 . . . . 10.0 109.631 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -62.95 -34.67 77.99 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.02 -0.733 . . . . 10.0 109.02 179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -70.12 -49.55 49.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.004 -0.543 . . . . 10.0 109.948 178.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -62.83 -46.49 87.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.235 179.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 31.9 mt -66.08 -32.68 74.28 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.951 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -68.59 -41.46 79.59 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -70.43 -38.36 74.55 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 178.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -67.12 -32.89 81.63 Favored Glycine 0 N--CA 1.442 -0.909 0 N-CA-C 109.757 -1.337 . . . . 10.0 109.757 177.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -73.09 -43.47 61.74 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 178.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 64.5 mtt180 -63.28 -38.65 91.99 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.847 -0.797 . . . . 10.0 108.847 178.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -50.41 64.24 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.49 177.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -62.83 -32.7 73.96 Favored 'General case' 0 C--O 1.225 -0.193 0 O-C-N 123.292 0.37 . . . . 10.0 110.252 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 30.9 mt -69.56 -38.39 77.42 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -68.12 -41.97 80.91 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.204 -1.036 . . . . 10.0 108.204 177.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -61.27 -47.17 87.24 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.134 -0.939 . . . . 10.0 108.63 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 43.1 mt -65.79 -40.56 92.07 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.918 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -60.4 -45.5 93.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.013 0.435 . . . . 10.0 110.467 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -80.25 10.9 3.94 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.882 -179.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -120.13 -46.06 2.43 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.525 -0.761 . . . . 10.0 108.979 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 94.1 mt -69.67 -34.82 74.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.701 -0.681 . . . . 10.0 111.719 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 13.3 m -65.3 -58.25 12.75 Favored Pre-proline 0 CA--C 1.537 0.467 0 C-N-CA 120.682 -0.407 . . . . 10.0 111.297 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.56 -47.44 11.49 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 121.727 1.618 . . . . 10.0 111.588 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 73.3 mt -66.63 -31.51 72.23 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-O 120.679 0.276 . . . . 10.0 111.213 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.29 -48.77 61.68 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 110.038 -1.225 . . . . 10.0 110.038 178.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -65.92 -39.88 90.94 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.244 -0.65 . . . . 10.0 109.244 178.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -60.31 -52.79 63.77 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.602 178.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 42.8 mmm -57.95 -36.45 72.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.679 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 74.4 mtt180 -66.46 -43.48 85.39 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.898 -0.408 . . . . 10.0 109.898 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.73 -41.16 88.31 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 178.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 41.1 mtt180 -62.01 -42.98 99.74 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 178.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -63.79 -36.45 83.92 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.409 -0.814 . . . . 10.0 110.114 178.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 67.5 mtt180 -62.58 -42.59 99.65 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.878 -0.786 . . . . 10.0 108.878 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -86.5 19.52 2.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.962 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -131.15 -53.43 1.04 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.996 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 86.5 t -68.12 -47.61 77.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.164 -0.471 . . . . 10.0 109.999 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.23 -33.44 75.76 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 108.874 -0.788 . . . . 10.0 108.874 178.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -64.86 -50.07 68.06 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 107.671 -1.233 . . . . 10.0 107.671 177.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 21.2 mt -59.26 -35.52 73.85 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.736 178.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -59.34 -53.75 54.6 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.779 -0.823 . . . . 10.0 108.779 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.59 14.56 0.99 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.608 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -126.43 -38.03 2.14 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 122.136 -0.353 . . . . 10.0 110.363 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 84.6 mt -87.69 -33.97 18.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.56 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -58.28 -57.88 22.99 Favored Pre-proline 0 C--N 1.33 -0.272 0 C-N-CA 121.174 -0.211 . . . . 10.0 111.499 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.61 -36.52 63.75 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 121.444 1.429 . . . . 10.0 110.613 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -61.46 -46.46 89.95 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.895 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 6.3 p -67.6 -31.1 70.9 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.969 -0.382 . . . . 10.0 109.969 179.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -67.76 -41.92 82.58 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.884 -0.784 . . . . 10.0 108.884 178.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -67.12 -37.8 84.49 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 177.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 21.3 mt -62.58 -32.26 73.22 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.401 -0.818 . . . . 10.0 109.809 178.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -65.74 -37.99 87.89 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.386 -0.598 . . . . 10.0 109.386 178.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -68.64 -43.59 75.98 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.593 -0.891 . . . . 10.0 108.593 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 80.8 mtt180 -61.54 -43.95 97.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.808 -1.087 . . . . 10.0 109.466 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 30.2 mt -65.16 -35.99 82.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.719 -0.673 . . . . 10.0 109.793 178.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.86 -46.65 86.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.095 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.66 -44.65 77.35 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.53 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 10.2 mtt180 -62.14 -46.0 90.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.672 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 47.9 mt -67.52 -32.69 73.66 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.505 -0.316 . . . . 10.0 110.537 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -64.68 -44.62 89.77 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.224 -0.658 . . . . 10.0 109.224 178.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.59 -41.53 96.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.428 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 83.9 mt -65.49 -28.97 69.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.67 178.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -77.57 -43.89 30.29 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.86 -0.422 . . . . 10.0 109.86 178.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -62.33 -48.58 79.19 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.714 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -71.21 -35.3 71.48 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 115.479 -0.782 . . . . 10.0 109.458 178.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -60.27 -45.98 95.11 Favored Glycine 0 N--CA 1.445 -0.737 0 N-CA-C 111.279 -0.728 . . . . 10.0 111.279 178.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.85 99.69 Favored Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 111.048 -0.821 . . . . 10.0 111.048 179.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.81 -45.26 82.98 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 53.4 mtt180 -61.5 -39.7 91.9 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.715 179.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 75.4 mt -60.1 -42.26 94.29 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -68.51 -45.36 72.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.754 -0.657 . . . . 10.0 109.323 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.03 -51.88 67.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.522 -0.763 . . . . 10.0 110.208 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -60.45 -38.8 85.31 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.162 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -67.66 -41.72 83.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.054 0.454 . . . . 10.0 110.703 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.62 -50.54 64.66 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -32.96 74.44 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.885 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.21 -43.15 92.45 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.647 -0.501 . . . . 10.0 109.647 178.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 25.3 m -63.52 -45.0 92.62 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.489 -0.56 . . . . 10.0 109.489 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -64.41 -39.62 94.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.46 178.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -64.3 -41.55 96.79 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.616 -0.72 . . . . 10.0 110.124 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 79.7 mt -68.6 -38.23 80.44 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.483 -0.326 . . . . 10.0 110.429 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 19.3 m -66.91 -39.05 87.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.396 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 3.2 p -73.95 -25.37 59.91 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.36 179.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 32.8 mt -75.84 -41.27 52.99 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 108.738 -0.838 . . . . 10.0 108.738 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 47.0 m -61.53 -25.95 67.62 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.526 -0.761 . . . . 10.0 110.819 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -61.29 -21.94 64.4 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.839 -0.619 . . . . 10.0 110.51 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -117.43 -21.72 8.52 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.886 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -66.42 -21.72 66.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.87 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -109.89 -67.59 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.596 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.25 -54.56 1.7 Allowed 'Trans proline' 0 C--N 1.357 0.982 0 C-N-CA 122.164 1.91 . . . . 10.0 113.098 -179.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -63.04 -44.64 95.32 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.925 -0.31 . . . . 10.0 111.685 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 4.1 mt -60.63 -40.94 93.81 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-O 120.756 0.312 . . . . 10.0 110.356 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -64.79 -37.62 88.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.306 178.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.29 -39.96 78.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.942 178.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 78.2 mt -61.6 -44.7 96.52 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.25 -0.648 . . . . 10.0 109.25 178.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -65.0 -38.6 91.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.514 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -70.05 -18.24 63.28 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.745 -0.661 . . . . 20.0 112.584 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -94.2 -35.55 5.99 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 108.961 -1.656 . . . . 10.0 108.961 178.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 63.5 mt -67.51 -40.92 85.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.366 -0.417 . . . . 10.0 111.82 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 94.5 mt -53.79 -60.75 6.48 Favored Pre-proline 0 CA--C 1.534 0.364 0 N-CA-C 112.418 0.525 . . . . 10.0 112.418 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -66.34 -36.41 27.64 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 121.744 1.629 . . . . 10.0 112.401 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 1.9 p -67.3 -37.43 79.05 Favored 'Isoleucine or valine' 0 C--N 1.34 0.165 0 C-N-CA 120.434 -0.506 . . . . 10.0 111.411 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 6.2 mt -63.31 -41.14 98.92 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.178 -0.675 . . . . 10.0 109.178 178.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -64.5 -45.45 87.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.515 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 3.9 p -67.28 -31.15 71.28 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 121.165 0.507 . . . . 10.0 110.14 178.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.06 -35.98 74.65 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.764 -0.828 . . . . 10.0 108.764 178.276 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -63.97 -37.92 89.19 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.383 178.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 58.4 t -62.59 -43.26 98.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 N-CA-C 108.895 -0.78 . . . . 10.0 108.895 178.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 8.6 m -66.07 -40.01 90.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.407 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -69.36 -48.61 60.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.109 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 76.9 mt -57.63 -47.79 81.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.626 -0.261 . . . . 10.0 110.706 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 25.9 p -61.45 -42.39 98.68 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -62.31 -44.0 97.53 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.235 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 91.5 mt -57.63 -44.98 85.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.471 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -67.08 -53.14 33.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.977 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -58.09 -47.03 84.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.208 -0.451 . . . . 10.0 112.075 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -63.03 -43.68 98.05 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.355 0.502 . . . . 10.0 112.355 -179.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 10.2 p -65.11 -29.28 70.13 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.807 -0.357 . . . . 10.0 111.427 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -68.67 -22.45 64.38 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.082 0.467 . . . . 10.0 110.371 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.06 -4.65 31.93 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.491 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 86.2 mt -95.68 -40.98 9.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.395 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 . . . . . 0 C--O 1.252 1.224 0 CA-C-O 118.411 -0.804 . . . . 10.0 110.468 -179.865 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 5.5 t . . . . . 0 N--CA 1.453 -0.319 0 CA-C-O 120.904 0.383 . . . . 10.0 110.602 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -86.97 118.96 26.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.236 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -108.58 120.02 41.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.021 0.438 . . . . 10.0 111.811 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 2.8 mtmt -109.59 116.2 31.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.53 179.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 45.3 mt -110.73 117.98 34.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.44 -0.345 . . . . 10.0 111.197 -178.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 47.6 t -104.69 118.19 51.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.026 0.441 . . . . 10.0 110.686 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 23.4 t -92.21 116.64 33.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 17.2 m -108.47 170.09 2.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.909 0.385 . . . . 10.0 111.256 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 150.39 170.95 18.2 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.901 -0.666 . . . . 10.0 111.581 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -87.9 -174.24 4.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.878 0.371 . . . . 10.0 111.371 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.38 141.58 21.43 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.004 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 108.6 -21.52 28.01 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.647 -0.787 . . . . 10.0 112.18 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 21.9 m -80.04 162.4 3.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 120.938 0.399 . . . . 10.0 110.854 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -90.2 52.14 3.47 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.809 -0.71 . . . . 10.0 113.451 -179.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt -60.73 -58.71 7.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.12 0.486 . . . . 10.0 110.34 179.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -65.93 -32.04 73.32 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.266 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.02 -50.21 69.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.908 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 86.0 mt -59.54 -42.27 91.94 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 121.03 0.443 . . . . 10.0 110.076 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 14.4 m -61.37 -53.68 53.54 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.569 -0.741 . . . . 10.0 111.423 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 96.3 mt -61.43 -32.69 54.04 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-O 120.759 0.314 . . . . 10.0 111.115 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -67.09 -27.84 67.69 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.142 0.496 . . . . 10.0 110.62 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 23.6 tp -88.58 -33.32 17.73 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.827 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 42.5 mm -81.1 -69.48 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.935 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -84.17 -14.19 50.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.77 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 68.18 29.09 6.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.588 0.709 . . . . 10.0 109.129 -178.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 74.9 t60 -124.97 144.64 50.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.987 -1.006 . . . . 10.0 110.165 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -103.09 131.71 49.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.657 0.265 . . . . 10.0 110.899 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 4.3 m -91.84 125.76 44.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.144 178.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.35 -11.25 26.07 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.281 0.562 . . . . 10.0 110.689 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -87.5 146.13 25.95 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.877 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -88.5 64.83 7.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.963 0.411 . . . . 10.0 110.224 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.14 140.0 76.39 Favored Pre-proline 0 C--O 1.237 0.432 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.065 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -71.57 -179.51 3.77 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 122.777 2.318 . . . . 10.0 113.007 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -166.9 136.0 2.85 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.846 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 3.5 mt -117.21 -66.3 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 179.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -147.79 94.92 2.42 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -118.89 150.21 40.25 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.094 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.19 141.02 46.9 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.883 -0.327 . . . . 10.0 111.397 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . 0.41 ' CE2' ' CG2' ' D' ' 840' ' ' VAL . 30.1 m-85 -124.29 147.26 48.25 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.53 -0.304 . . . . 10.0 111.811 -178.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.11 136.44 53.64 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 112.891 0.7 . . . . 10.0 112.891 -178.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 28.8 tttm -158.72 157.89 32.62 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.226 -0.897 . . . . 10.0 109.626 178.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -133.86 123.31 24.53 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.142 -0.318 . . . . 10.0 110.142 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 10.0 m -138.36 165.65 24.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.847 0.356 . . . . 10.0 111.101 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 16.0 t -90.32 97.06 6.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.667 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 46.1 mt -86.45 120.13 35.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.674 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 51.7 m-20 68.53 -67.26 0.21 Allowed 'General case' 0 N--CA 1.465 0.293 0 O-C-N 123.766 0.667 . . . . 10.0 111.291 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . -155.12 -12.25 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 121.039 -0.6 . . . . 10.0 112.871 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -121.81 132.99 54.9 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 117.145 0.472 . . . . 10.0 111.769 -179.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 9.9 t -79.83 130.76 35.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.993 -0.548 . . . . 10.0 110.605 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -142.45 150.79 41.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.888 0.375 . . . . 10.0 111.602 -179.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 26.6 tp -79.86 129.29 34.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.158 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 82.6 mt -111.99 123.03 49.38 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.939 -179.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -103.04 103.16 13.23 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.027 -1.101 . . . . 10.0 108.027 177.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 26.9 mt -92.94 138.86 19.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.959 -0.564 . . . . 10.0 111.502 -177.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 37.2 tp -114.01 121.14 42.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.882 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -98.72 96.22 7.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.433 -0.803 . . . . 10.0 108.888 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 47.5 p -80.64 163.52 23.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.721 -0.672 . . . . 10.0 112.689 -178.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.73 158.37 30.39 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.734 -0.666 . . . . 10.0 111.102 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -83.62 -53.58 3.35 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.8 -0.714 . . . . 10.0 111.776 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -113.31 135.51 53.77 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.054 -0.35 . . . . 20.0 110.054 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -158.66 -178.26 7.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.687 0.279 . . . . 10.0 110.843 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -113.94 -91.77 0.5 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.153 0.501 . . . . 10.0 109.968 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -159.85 78.99 0.7 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.652 -0.704 . . . . 10.0 109.915 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 48.6 m -91.46 130.86 37.24 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.586 -0.734 . . . . 10.0 111.056 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.36 -34.5 73.96 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 121.245 0.545 . . . . 10.0 109.834 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 83.9 mmm -62.7 -40.29 96.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.412 -0.813 . . . . 10.0 109.81 178.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -66.18 -44.97 82.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.437 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -58.4 -32.24 68.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.811 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -61.67 -58.36 8.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.998 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 21.0 p90 -70.61 -11.95 61.26 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 113.146 0.795 . . . . 10.0 113.146 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 66.3 mmm -75.6 -16.52 60.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.27 -0.423 . . . . 10.0 109.992 178.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 20.0 mtt180 -95.18 -17.5 21.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.44 . . . . 10.0 111.245 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -87.18 13.33 9.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.319 -0.4 . . . . 10.0 111.68 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -104.73 138.25 14.06 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.61 -0.805 . . . . 10.0 111.656 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -91.38 -37.4 13.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.268 0.556 . . . . 10.0 110.74 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -132.09 143.55 15.14 Favored Glycine 0 N--CA 1.444 -0.782 0 N-CA-C 110.82 -0.912 . . . . 10.0 110.82 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -124.62 123.35 39.86 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.242 0.544 . . . . 10.0 112.111 -178.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 97.5 mt -92.18 115.77 28.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.602 -0.726 . . . . 10.0 109.666 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 9.8 m -86.37 85.59 7.33 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.783 -0.451 . . . . 10.0 109.783 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 39.6 t -82.93 119.36 32.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.005 -0.543 . . . . 10.0 112.099 -178.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 19.3 p90 -133.81 135.34 43.75 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.047 178.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -79.07 128.46 33.3 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.652 -0.249 . . . . 10.0 110.437 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 34.0 pt -70.89 -13.26 16.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.815 0.34 . . . . 10.0 111.899 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -94.17 -2.76 52.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.05 0.453 . . . . 10.0 110.023 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -126.25 102.51 7.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.034 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.29 -37.39 69.81 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.094 -0.503 . . . . 10.0 112.331 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 23.5 tptp -57.87 -34.94 70.3 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 111.928 0.344 . . . . 10.0 111.928 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 62.1 m -66.56 -35.63 80.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.652 -0.249 . . . . 10.0 111.015 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -68.22 -39.18 82.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.246 0.546 . . . . 10.0 109.971 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -73.55 -34.42 65.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.922 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.84 -14.02 62.62 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.959 -0.564 . . . . 10.0 111.965 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 32.9 mm -58.6 -42.48 84.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.903 0.382 . . . . 10.0 110.322 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -66.7 -32.49 73.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.252 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -66.98 -38.14 85.51 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.193 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -80.41 -32.27 37.51 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.123 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -56.96 -48.03 79.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.766 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -65.78 -35.74 81.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.224 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -62.05 -44.55 96.45 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.476 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 53.0 mt -66.86 -39.21 83.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.277 0.561 . . . . 10.0 110.337 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -68.54 -20.95 64.58 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.465 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 1.6 ttp-105 -84.48 -38.94 19.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.607 -0.27 . . . . 10.0 111.589 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 34.7 m -71.79 -26.02 25.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 112.391 0.515 . . . . 10.0 112.391 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 66.5 mmtt -107.27 -9.6 16.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.447 179.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 5.8 t70 54.06 38.15 28.4 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.514 -0.766 . . . . 10.0 112.351 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 22.7 t -156.49 156.66 34.1 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.421 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -95.42 -17.17 21.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.051 -0.522 . . . . 10.0 109.647 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -85.71 74.78 10.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.352 -0.84 . . . . 10.0 110.298 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 44.4 t -129.37 132.82 24.52 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.795 -0.639 . . . . 10.0 109.903 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -64.04 103.3 0.41 Allowed 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.935 2.424 . . . . 10.0 112.241 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 38.3 mtt -126.29 153.27 45.03 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.305 -0.628 . . . . 10.0 109.305 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 96.9 t -135.5 130.56 50.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 18.2 tp -80.75 114.42 19.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.496 -0.927 . . . . 10.0 108.496 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 19.4 t -111.66 110.83 33.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.073 0.463 . . . . 10.0 112.185 -177.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -82.75 136.19 15.0 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 109.011 -1.635 . . . . 10.0 109.011 177.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -121.55 153.52 37.89 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 117.557 0.679 . . . . 10.0 112.366 -178.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 90.4 mttt 69.65 44.19 0.91 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.256 -0.884 . . . . 10.0 112.615 178.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 18.7 p -79.58 -4.12 50.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.376 0.608 . . . . 10.0 110.172 178.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -93.39 1.31 56.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.342 -0.845 . . . . 10.0 110.19 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 40.5 mt -99.92 141.5 22.88 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.172 -0.467 . . . . 10.0 109.741 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -81.19 7.99 4.63 Favored 'Trans proline' 0 CA--C 1.529 0.25 0 C-N-CA 122.701 2.267 . . . . 10.0 112.284 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.49 35.43 1.64 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.943 0.402 . . . . 10.0 111.042 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 4.7 ttt180 -60.92 105.28 0.45 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.136 0.493 . . . . 10.0 112.296 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.1 m -94.56 -41.62 9.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.902 -0.59 . . . . 10.0 109.617 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 38.3 t -93.93 111.24 24.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.695 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.16 158.08 36.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.055 0.455 . . . . 10.0 111.272 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.93 -40.11 75.74 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.768 -0.651 . . . . 10.0 112.381 -179.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 19.8 tptt -59.85 -46.41 89.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.497 0.189 . . . . 10.0 111.239 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -55.67 -43.12 76.05 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.205 0.526 . . . . 10.0 110.438 178.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.48 -44.32 83.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.545 -0.752 . . . . 10.0 111.539 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -64.61 -35.13 79.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.802 0.334 . . . . 10.0 110.992 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -61.05 -49.72 76.23 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.74 -0.663 . . . . 10.0 110.656 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 13.7 tp -67.24 -42.2 84.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.766 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.23 74.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.673 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 21.5 tpt180 -60.3 -38.24 83.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.354 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 38.2 m -70.79 -24.57 62.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.655 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -93.72 -7.97 42.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.019 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 72.25 26.78 71.32 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.825 -0.625 . . . . 10.0 111.697 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 47.7 pt -122.83 149.76 57.11 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.668 0.27 . . . . 10.0 110.672 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -77.34 151.81 29.94 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.629 2.219 . . . . 10.0 111.602 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -111.78 126.83 55.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.367 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 41.3 mm -126.22 126.18 68.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.061 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -90.46 125.3 35.53 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 74.0 p -132.29 160.26 36.73 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.662 0.986 . . . . 10.0 113.662 -177.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -155.36 123.68 5.9 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.224 -1.353 . . . . 10.0 107.98 178.096 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -74.28 -30.39 62.08 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.344 0.498 . . . . 10.0 112.344 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 33.1 tttp -64.93 -45.92 83.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.485 -0.325 . . . . 10.0 111.458 -179.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.75 -0.93 36.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.956 -179.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 16.9 ttt85 57.28 47.49 16.71 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.426 0.631 . . . . 10.0 110.924 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 33.8 tp60 -83.53 106.52 15.33 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.054 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 59.05 22.13 54.6 Favored Glycine 0 CA--C 1.52 0.377 0 N-CA-C 114.742 0.657 . . . . 10.0 114.742 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 60.9 t -64.69 -48.28 85.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 117.273 0.536 . . . . 10.0 110.23 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -64.49 -46.36 83.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.186 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -63.61 -31.23 72.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.57 -0.741 . . . . 10.0 112.525 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.68 -44.12 85.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.069 0.462 . . . . 10.0 110.444 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -72.02 -37.31 69.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.55 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -64.47 -40.44 95.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.969 0.414 . . . . 10.0 110.782 179.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 46.9 m -61.54 -40.56 95.14 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.004 179.055 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 30.9 tp -62.17 -45.57 92.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.396 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 89.7 t -60.21 -41.97 88.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.308 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 67.6 mtm-85 -62.66 -37.92 88.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.108 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -67.71 -39.09 84.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.914 0.388 . . . . 10.0 110.284 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 71.7 mt -66.75 -39.57 83.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 178.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -61.99 -42.74 99.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.183 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 21.9 mtmm -67.68 -32.68 73.51 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.123 179.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 -61.99 -45.61 92.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.355 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -63.8 -36.14 82.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.479 179.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -63.24 -41.83 99.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.781 -0.645 . . . . 10.0 109.397 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 56.7 tttp -68.34 -39.71 81.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.965 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 97.2 mtp -65.15 -20.81 66.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.969 0.414 . . . . 10.0 111.524 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 13.5 m . . . . . 0 C--N 1.325 -0.488 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.735 179.795 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.248 0 N-CA-C 112.031 -0.427 . . . . 10.0 112.031 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 9.6 p -136.97 146.73 45.74 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.707 0.289 . . . . 10.0 110.958 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 92.5 t -106.74 133.15 52.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.283 -0.417 . . . . 10.0 109.888 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -85.98 106.87 17.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.285 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 46.9 t -95.84 124.21 48.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.334 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -101.56 130.93 47.96 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.969 -0.382 . . . . 10.0 109.969 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 45.2 mt -103.42 155.98 36.08 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.555 -178.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.58 53.38 3.13 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 123.424 2.75 . . . . 10.0 112.036 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -152.63 31.86 0.51 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 88.4 mttt 53.96 32.54 15.56 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 114.675 -1.148 . . . . 10.0 111.439 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -136.99 -179.2 5.56 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 114.13 1.159 . . . . 10.0 114.13 -177.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.02 171.44 15.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.16 -0.927 . . . . 10.0 112.178 -178.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 45.2 m -155.01 131.52 10.51 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.623 -1.251 . . . . 10.0 107.623 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 4.0 t -97.28 113.26 31.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 120.562 -0.455 . . . . 10.0 111.081 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 26.1 t -105.61 137.82 33.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.883 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 1.2 m -72.95 144.62 47.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.766 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 45.2 t -76.19 119.47 24.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.552 -0.295 . . . . 10.0 110.403 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -114.08 130.42 56.57 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.917 0.389 . . . . 10.0 111.063 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -75.28 129.86 38.13 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.979 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 82.88 2.2 90.65 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.971 -0.558 . . . . 10.0 112.582 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 7.1 ttt -89.44 126.97 35.78 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 122.726 -0.279 . . . . 10.0 110.39 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.11 150.68 27.36 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.391 -0.226 . . . . 10.0 110.391 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 92.9 t -54.05 -38.85 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 O-C-N 123.228 0.33 . . . . 10.0 110.885 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -57.13 -31.05 64.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.319 -0.4 . . . . 10.0 111.396 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -82.98 -45.67 13.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.509 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.33 -42.68 78.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.031 0.443 . . . . 10.0 111.352 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -80.28 -8.57 59.53 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.855 -179.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -61.45 -61.19 2.71 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 110.051 -0.352 . . . . 10.0 110.051 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 39.3 mttt -62.77 -29.81 70.98 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.885 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -69.05 -25.77 64.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.942 0.401 . . . . 10.0 110.762 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 40.0 mt -93.07 -44.3 8.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.149 179.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 10.5 mmtt -61.27 -23.63 65.81 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.668 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 840' ' ' VAL . . . . . 0.41 ' CG2' ' CE2' ' B' ' 40' ' ' TYR . 1.4 p -49.66 -20.88 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 N-CA-C 112.916 0.71 . . . . 10.0 112.916 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -140.59 23.17 2.31 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.368 0.604 . . . . 10.0 111.721 177.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 75.59 28.41 61.4 Favored Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 115.601 -0.727 . . . . 10.0 114.654 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 96.6 mt -92.4 154.26 18.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 117.598 0.699 . . . . 10.0 110.215 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -121.68 143.28 49.44 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.815 0.341 . . . . 10.0 111.602 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -60.64 -28.69 68.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.813 -0.63 . . . . 10.0 111.822 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -76.81 -4.34 43.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.468 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 2.2 t -131.95 18.16 4.61 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 120.966 0.412 . . . . 10.0 110.972 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 79.6 m -142.65 153.29 43.3 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.485 -0.325 . . . . 10.0 110.472 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 14.6 p -130.6 141.81 45.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.42 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 26.0 t -109.75 122.96 65.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.351 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -103.8 142.85 33.66 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.953 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 42.3 mmm-85 -82.89 164.78 20.27 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.333 -0.849 . . . . 10.0 109.819 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 16.2 tp -124.52 62.07 1.13 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.469 0.652 . . . . 10.0 110.551 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 44.3 mt -84.4 102.25 10.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.28 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp 61.44 17.07 8.07 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.431 -0.804 . . . . 10.0 112.194 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 105.05 -18.32 42.99 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.94 -0.648 . . . . 10.0 112.412 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -81.35 138.45 35.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.968 0.413 . . . . 10.0 110.897 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -88.34 122.36 31.77 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.466 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 3.7 m -122.53 136.1 54.8 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.037 -0.529 . . . . 10.0 109.787 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 6.4 t -75.74 123.91 32.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 110.391 -0.225 . . . . 10.0 110.391 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 3.2 t -104.6 160.7 14.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.544 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -99.1 149.63 22.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.569 -0.287 . . . . 10.0 110.914 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -70.55 -27.42 64.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.924 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.16 1.61 39.63 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.532 0.567 . . . . 10.0 112.532 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 23.5 m -84.98 148.2 26.32 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 179.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -82.48 150.33 27.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.026 0.441 . . . . 10.0 111.622 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 8.8 tp -84.7 -10.32 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.845 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -58.11 -55.6 43.64 Favored Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 113.024 0.75 . . . . 10.0 113.024 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -77.81 13.21 1.74 Allowed 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 122.345 2.03 . . . . 10.0 112.161 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.83 -8.0 20.1 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.094 -0.503 . . . . 10.0 109.983 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -58.01 127.28 31.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.78 -0.646 . . . . 10.0 111.285 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 121.85 -16.43 8.87 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.479 -0.867 . . . . 10.0 113.402 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -126.95 -170.58 2.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.11 0.455 . . . . 10.0 112.115 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -113.26 170.24 8.37 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.991 -0.549 . . . . 10.0 110.784 -178.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 36.8 mt -130.83 129.74 42.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.671 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 17.5 mt -114.38 112.73 41.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.312 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 24.4 t -97.74 137.08 26.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 120.728 0.299 . . . . 10.0 110.615 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.55 171.05 14.66 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.091 -0.504 . . . . 10.0 109.909 179.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 5.8 m -105.11 149.15 8.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.076 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 92.3 mt . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.739 -0.648 . . . . 10.0 111.495 -179.197 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 94.3 mt . . . . . 0 C--O 1.223 -0.319 0 CA-C-O 120.527 0.204 . . . . 10.0 111.167 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 49.2 mtt180 -66.18 -41.13 90.7 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.484 -0.562 . . . . 10.0 109.484 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -78.52 -25.01 45.46 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.259 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -76.68 -62.62 1.57 Allowed 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.473 -0.785 . . . . 10.0 110.199 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 93.1 mmm -56.79 -30.56 63.8 Favored 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 113.25 0.833 . . . . 10.0 113.25 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 3.1 p -63.38 -50.97 67.82 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.404 -0.518 . . . . 10.0 109.761 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -74.98 -33.1 61.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.044 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -59.74 -59.38 5.53 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.125 178.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.25 -35.42 78.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.878 -0.601 . . . . 10.0 111.114 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -61.89 -45.82 92.09 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 120.67 0.271 . . . . 10.0 110.585 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -72.19 -38.36 69.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.05 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 41.3 t -61.81 -39.33 83.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.92 -0.4 . . . . 10.0 109.92 178.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -75.29 -46.61 32.4 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.869 0.366 . . . . 10.0 110.769 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.33 74.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.526 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -90.2 -20.08 23.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.327 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.23 -29.9 47.67 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.206 0 N-CA-C 109.997 -0.371 . . . . 10.0 109.997 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -64.2 3.36 Favored Pre-proline 0 C--O 1.219 -0.513 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.147 178.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -59.87 -31.76 94.29 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 121.73 1.62 . . . . 10.0 111.548 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -61.21 -57.7 11.35 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.008 0.432 . . . . 10.0 109.895 178.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 96.3 mt -73.1 -38.56 66.3 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.822 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -58.42 -49.18 78.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.761 0.315 . . . . 10.0 110.448 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.48 -45.53 92.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.839 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -63.72 -37.56 87.83 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 116.059 -0.518 . . . . 10.0 111.106 179.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -69.6 -39.94 76.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.682 0.277 . . . . 10.0 110.266 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 48.7 mttp -64.27 -42.88 96.24 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 177.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -65.05 -44.5 88.8 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 178.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 6.7 t90 -60.6 -36.62 79.01 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.685 -0.689 . . . . 10.0 110.24 179.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -61.99 -49.89 74.27 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.733 -0.84 . . . . 10.0 108.733 178.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -59.85 -43.79 94.45 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.753 -0.658 . . . . 10.0 109.344 178.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -61.09 -47.24 87.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.596 -0.729 . . . . 10.0 111.258 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 95.6 mmm -71.43 -43.66 66.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.811 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -61.61 -48.16 82.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.903 0.382 . . . . 10.0 110.248 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 69.4 mt -67.23 -23.59 65.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.5 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.75 -51.51 13.98 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 177.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 45.0 mtt85 -60.4 -41.28 93.54 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.668 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.05 -20.54 58.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.611 -0.722 . . . . 10.0 111.063 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 47.5 mttp -103.19 -41.09 6.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.643 179.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 38.5 t -47.11 -43.18 7.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 112.432 0.531 . . . . 10.0 112.432 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 63.9 mt-10 -64.3 -63.78 3.45 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 112.755 0.65 . . . . 10.0 112.755 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.37 -36.15 88.27 Favored 'Trans proline' 0 C--N 1.357 0.982 0 C-N-CA 121.807 1.671 . . . . 10.0 111.998 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 23.1 mt -67.63 -31.57 71.68 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 110.005 -0.368 . . . . 10.0 110.005 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 5.9 mtt180 -72.89 -35.85 67.19 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -58.96 -46.66 87.5 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.5 -0.555 . . . . 10.0 109.5 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -65.0 -40.63 95.23 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 178.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -43.41 97.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.42 -0.809 . . . . 10.0 109.696 179.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -69.6 -44.93 69.74 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.536 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -60.79 -49.73 76.3 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 110.177 -0.305 . . . . 10.0 110.177 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -59.47 -42.43 97.58 Favored Glycine 0 N--CA 1.443 -0.843 0 N-CA-C 110.863 -0.895 . . . . 10.0 110.863 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -66.1 -44.58 83.94 Favored 'General case' 0 C--O 1.223 -0.334 0 O-C-N 123.539 0.199 . . . . 10.0 110.814 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 37.1 mtt180 -58.89 -46.74 87.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.906 0.384 . . . . 10.0 110.194 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -61.72 -47.55 84.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.525 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.97 -44.06 94.71 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.266 179.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 77.0 mt -60.25 -40.23 89.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.275 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -64.62 -47.68 77.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.015 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -64.52 -31.0 72.03 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.072 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 39.6 mt -72.2 -40.97 67.48 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.881 -0.6 . . . . 10.0 109.575 178.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -60.55 -36.18 77.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.234 0.54 . . . . 10.0 109.666 178.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -72.4 3.77 4.44 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.667 179.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 45.2 mttp -126.24 -24.69 3.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.567 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 82.6 mt -76.54 -33.08 58.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.631 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 4.5 m -89.66 -61.6 0.22 Allowed Pre-proline 0 CA--C 1.538 0.513 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.815 179.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -59.05 -63.86 0.12 Allowed 'Trans proline' 0 C--N 1.357 0.986 0 C-N-CA 122.4 2.067 . . . . 10.0 112.244 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 88.4 mt -63.17 -25.86 68.54 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.414 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -68.17 -49.03 49.43 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 110.1 -1.2 . . . . 10.0 110.1 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -63.44 -35.75 81.47 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.912 -0.403 . . . . 10.0 109.912 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -64.3 -45.12 89.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.095 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.7 ttt -67.47 -33.77 75.79 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.094 -0.706 . . . . 10.0 109.094 178.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -64.19 -44.2 92.72 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.165 -0.68 . . . . 10.0 109.165 178.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -65.58 -42.42 91.78 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.269 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 11.4 mmt180 -62.6 -37.57 86.76 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 178.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -67.22 -35.99 80.76 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 115.844 -0.616 . . . . 10.0 109.713 178.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -60.92 -50.86 71.71 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.72 -0.844 . . . . 10.0 108.72 178.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.33 -37.51 87.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.741 178.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -57.85 -55.29 36.81 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.202 178.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 87.5 t -71.28 -40.04 73.34 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.264 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.608 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -60.57 -47.82 84.5 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.978 -0.289 . . . . 10.0 110.366 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -64.95 -28.32 69.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.358 0.599 . . . . 10.0 109.398 178.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . 0.412 ' O ' ' N ' ' A' ' 320' ' ' LEU . 8.9 mt -71.2 -39.88 71.52 Favored 'General case' 0 C--O 1.216 -0.698 0 N-CA-C 108.744 -0.836 . . . . 10.0 108.744 177.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -61.45 -43.92 98.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.356 -0.383 . . . . 10.0 110.398 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -15.66 63.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.847 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -106.17 -39.08 6.07 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.504 -0.317 . . . . 10.0 111.756 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . 0.412 ' N ' ' O ' ' A' ' 316' ' ' LEU . 50.2 mt -60.15 -36.25 77.11 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 122.251 0.22 . . . . 10.0 111.132 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -60.75 -62.06 6.72 Favored Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.657 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -60.78 -33.83 92.41 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.709 1.606 . . . . 10.0 110.899 178.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -60.33 -49.77 76.26 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 32.6 m -66.59 -37.77 85.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.172 179.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.41 -41.26 93.78 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -66.0 -37.38 85.79 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.778 -0.823 . . . . 10.0 108.778 177.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 51.4 mt -61.77 -37.08 82.98 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.03 178.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -64.32 -40.79 96.61 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -62.16 -42.67 99.48 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -65.48 -50.6 64.74 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 115.512 -0.767 . . . . 10.0 109.671 178.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -55.87 -40.5 73.02 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.923 -0.581 . . . . 10.0 110.587 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.24 -45.46 94.42 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -64.42 -45.83 85.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.267 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 7.6 mmt85 -61.35 -46.19 91.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.54 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 64.5 mt -62.18 -41.99 98.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.962 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -61.08 -42.38 98.4 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 178.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.26 -40.39 86.2 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 78.2 mt -67.75 -20.72 65.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.125 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 71.4 mttt -87.35 -47.68 8.6 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 178.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -67.97 -62.33 1.45 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.958 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -68.76 -39.09 80.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.285 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -60.5 -43.63 98.61 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.934 -0.65 . . . . 10.0 111.74 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -64.79 -43.36 96.31 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 110.415 -1.074 . . . . 10.0 110.415 178.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -62.93 -40.43 97.6 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.413 -0.588 . . . . 10.0 109.413 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -60.21 -44.48 95.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.073 -0.967 . . . . 10.0 109.863 178.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 73.7 mt -64.68 -40.48 95.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.121 179.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -63.31 -45.81 89.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.73 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.02 -42.74 97.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.934 -0.576 . . . . 10.0 109.837 178.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -62.43 -41.67 98.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.114 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -65.37 -41.66 93.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.382 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.89 -48.46 80.37 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.642 -0.503 . . . . 10.0 109.642 178.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 47.6 mttm -62.43 -41.51 98.76 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.494 -0.775 . . . . 10.0 110.295 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.78 -45.76 91.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.196 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 28.8 m -61.38 -45.51 94.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.892 -0.594 . . . . 10.0 110.67 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -71.53 -31.19 66.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.003 0.43 . . . . 10.0 111.366 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -72.39 -25.39 61.48 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 40.9 mt -71.88 -39.84 69.35 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.252 -0.648 . . . . 10.0 109.252 178.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -44.12 88.03 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 178.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.1 p -70.71 -20.57 62.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.723 179.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 9.3 mt -80.38 -39.24 28.79 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.642 -0.873 . . . . 10.0 108.642 177.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 16.2 m -66.54 -31.78 72.71 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.534 -0.913 . . . . 10.0 108.534 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -75.06 9.01 2.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.086 -0.961 . . . . 10.0 110.782 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -128.33 -46.69 1.33 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.268 -1.012 . . . . 10.0 108.268 178.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -67.61 -7.3 25.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.458 -0.792 . . . . 10.0 112.518 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -106.42 -66.96 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.526 0 C-N-CA 120.95 -0.3 . . . . 10.0 111.806 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -66.28 -47.59 3.16 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 121.58 1.52 . . . . 10.0 112.557 -178.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -65.08 -38.98 92.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.506 0.193 . . . . 10.0 111.122 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 1.5 mt -68.47 -39.85 81.24 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.701 -0.4 . . . . 10.0 110.065 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -68.96 -35.38 76.68 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.557 -0.535 . . . . 10.0 109.557 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -47.21 81.82 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.855 -1.165 . . . . 10.0 107.855 177.574 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 65.3 mt -62.28 -41.19 98.27 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.311 -0.859 . . . . 10.0 110.775 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 52.4 mtt180 -63.39 -43.34 97.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.114 0.483 . . . . 10.0 110.035 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -68.13 -21.06 64.95 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.439 -0.8 . . . . 20.0 111.869 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -93.24 -37.35 5.66 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.821 -0.912 . . . . 10.0 110.821 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 18.5 mt -59.52 -37.52 78.55 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.306 0.484 . . . . 10.0 112.306 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 81.8 mt -58.85 -62.33 5.97 Favored Pre-proline 0 CA--C 1.535 0.378 0 N-CA-C 111.734 0.272 . . . . 10.0 111.734 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -63.68 -35.17 59.75 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.012 1.808 . . . . 10.0 112.044 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 15.6 t -64.46 -47.25 90.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-O 120.645 0.26 . . . . 10.0 110.581 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 18.3 mt -63.92 -32.3 73.78 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.655 -0.498 . . . . 10.0 109.655 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -69.87 -46.96 64.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.429 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.1 p -62.49 -36.85 83.82 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.187 -0.672 . . . . 10.0 109.187 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -68.47 -45.85 71.33 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.339 -0.846 . . . . 10.0 109.845 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 25.3 mtmt -60.17 -45.44 93.09 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.991 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 70.8 t -59.7 -44.63 94.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 109.752 -0.462 . . . . 10.0 109.752 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 27.9 m -65.93 -40.55 91.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.493 178.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 7.4 m-30 -65.23 -48.0 74.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.764 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 75.1 mt -58.77 -48.67 80.43 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.256 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 18.3 p -66.44 -25.52 66.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.519 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -82.0 -42.07 19.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.41 179.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.48 -41.37 85.14 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.41 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -64.45 -36.36 83.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.245 178.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.79 -43.28 84.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.039 0.447 . . . . 10.0 110.954 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -56.84 -52.43 65.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.761 -0.654 . . . . 10.0 111.009 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -69.32 -22.47 63.77 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.838 0.352 . . . . 10.0 111.234 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt . . . . . 0 C--N 1.325 -0.47 0 CA-C-N 116.324 -0.398 . . . . 10.0 111.069 -179.943 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 6.8 mp . . . . . 0 N--CA 1.453 -0.286 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.43 -37.34 86.63 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.392 -0.822 . . . . 10.0 110.386 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.4 -38.6 74.69 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -68.22 -36.34 79.35 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.118 -0.697 . . . . 10.0 109.118 178.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 68.9 t90 -66.49 -36.7 83.38 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.419 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -60.68 -46.39 90.53 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.939 -0.573 . . . . 10.0 109.96 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -32.81 74.69 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.129 0.49 . . . . 10.0 109.979 179.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 36.0 t -67.9 -37.61 78.7 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.089 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 177.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 21.8 m -68.52 -42.13 78.93 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.684 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.98 -43.36 88.03 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.897 -0.321 . . . . 10.0 110.538 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 7.4 p -65.7 -38.14 88.4 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.409 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.58 -40.1 88.77 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.156 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 30.8 m -62.52 -44.67 95.79 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 178.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -69.43 -25.29 64.04 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.137 178.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.0 -36.38 67.01 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.998 -1.112 . . . . 10.0 107.998 177.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -72.68 -23.6 60.9 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.235 -0.893 . . . . 10.0 110.191 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -64.33 -38.83 92.41 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 107.923 -1.14 . . . . 10.0 107.923 176.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -69.36 -30.19 68.14 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 115.103 -0.953 . . . . 10.0 109.057 178.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 88.5 mt -72.3 -1.74 16.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.633 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -92.82 -93.29 1.47 Allowed Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.748 -0.739 . . . . 10.0 111.483 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -52.94 -46.03 36.73 Favored 'Trans proline' 0 N--CA 1.473 0.3 0 C-N-CA 123.321 2.681 . . . . 10.0 113.172 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 67.6 t -55.08 -42.47 65.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.429 0.157 . . . . 10.0 111.178 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 2.8 m -72.71 -34.42 67.11 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.962 0.411 . . . . 10.0 110.069 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -61.7 -52.84 62.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.946 -0.57 . . . . 10.0 109.782 178.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.51 -19.38 64.52 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -70.8 -42.79 69.86 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.292 -1.003 . . . . 10.0 108.292 178.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 18.9 m0 -69.4 -33.71 73.41 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.691 -0.855 . . . . 10.0 108.691 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -67.89 -41.83 82.13 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.772 -0.825 . . . . 10.0 108.772 177.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -63.95 -38.79 92.37 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.572 -0.899 . . . . 10.0 108.572 177.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 30.1 mt -66.6 -27.78 67.98 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.707 -0.678 . . . . 10.0 109.986 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -68.18 -38.81 82.44 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 107.705 -1.22 . . . . 10.0 107.705 177.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -68.57 -41.83 79.18 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.52 -0.919 . . . . 10.0 108.52 177.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 56.3 mm-40 -58.96 -53.76 54.78 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 115.353 -0.84 . . . . 10.0 109.886 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 16.4 p -63.52 -37.05 85.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 10.0 112.073 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -69.59 -45.4 68.72 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -63.95 -48.47 75.7 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.271 -1.132 . . . . 10.0 110.271 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 20.4 mt -62.58 -28.47 69.9 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 109.974 -0.38 . . . . 10.0 109.974 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -65.3 -42.88 92.63 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -65.22 -44.34 88.55 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -62.65 -55.17 29.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.434 -0.803 . . . . 10.0 110.375 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 87.0 mmm -59.61 -45.7 91.15 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 112.972 0.73 . . . . 10.0 112.972 -179.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 15.8 p -57.28 -51.18 70.39 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.913 -0.315 . . . . 10.0 111.08 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -65.84 -46.18 79.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.726 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.18 -43.57 95.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.214 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 63.3 mt -70.69 -45.06 65.7 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.673 0.273 . . . . 10.0 111.175 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -59.98 -45.21 93.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.126 0.488 . . . . 10.0 110.345 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -74.87 -26.8 59.93 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.454 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.91 -35.0 73.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.769 0.319 . . . . 10.0 110.383 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -70.47 -34.0 71.91 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.48 -0.933 . . . . 10.0 108.48 177.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -82.2 -1.45 49.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.034 -0.984 . . . . 10.0 109.95 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -105.5 -44.41 4.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.603 -0.726 . . . . 10.0 109.055 178.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 53.6 t -61.07 -34.95 62.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.894 -0.593 . . . . 10.0 110.376 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -56.99 -62.46 5.11 Favored Pre-proline 0 CA--C 1.537 0.469 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.148 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -65.5 -29.25 53.23 Favored 'Trans proline' 0 C--N 1.36 1.164 0 C-N-CA 121.6 1.534 . . . . 10.0 111.08 178.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -61.32 -56.0 25.34 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 178.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 41.9 mt -61.05 -40.86 95.22 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.424 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -59.59 -50.31 74.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.804 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -72.12 -37.29 69.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.776 -178.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -65.17 -47.62 76.34 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -67.11 -32.33 73.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.26 -0.427 . . . . 10.0 109.948 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.15 -52.16 63.57 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.979 -0.748 . . . . 10.0 108.979 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 22.7 mttm -66.34 -34.32 77.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.188 -0.915 . . . . 10.0 110.108 179.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 6.9 m95 -68.64 -32.54 72.46 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.239 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 -66.85 -44.26 81.48 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 107.875 -1.157 . . . . 10.0 107.875 177.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -62.78 -41.79 99.4 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.833 -0.802 . . . . 10.0 108.833 177.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.55 -44.03 95.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.971 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 9.0 mmt -61.26 -44.44 97.24 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.57 -0.53 . . . . 10.0 109.57 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -61.89 -52.55 63.64 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.955 -0.757 . . . . 10.0 108.955 178.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 96.2 mt -54.6 -49.21 70.99 Favored 'General case' 0 C--O 1.225 -0.187 0 CA-C-N 115.62 -0.718 . . . . 20.0 111.474 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -60.49 -45.7 92.83 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 116.42 -0.355 . . . . 10.0 111.093 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -68.17 -46.16 71.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.608 0.242 . . . . 10.0 111.286 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -69.07 -15.94 63.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.798 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 65.2 mttt -97.31 -51.96 3.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.154 178.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 24.7 t -59.44 -39.08 78.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.107 -0.497 . . . . 10.0 112.049 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -54.86 -63.77 2.61 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 112.238 0.458 . . . . 10.0 112.238 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -68.86 -27.49 30.9 Favored 'Trans proline' 0 C--N 1.354 0.866 0 C-N-CA 121.823 1.682 . . . . 10.0 111.141 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 10.4 tp -65.3 -51.5 60.28 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 178.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 61.0 mtt180 -67.21 -31.61 72.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.607 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -63.85 -45.49 89.27 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.381 -0.6 . . . . 10.0 109.381 178.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.84 -30.46 56.35 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.298 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 20.4 mt -69.47 -40.77 76.9 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 109.679 -0.489 . . . . 10.0 109.679 178.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -67.02 -46.07 75.61 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.826 -0.435 . . . . 10.0 109.826 178.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -64.6 -41.46 96.2 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.798 -0.816 . . . . 10.0 108.798 178.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -64.42 -40.07 97.45 Favored Glycine 0 N--CA 1.443 -0.869 0 N-CA-C 110.88 -0.888 . . . . 10.0 110.88 178.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.39 -38.62 81.49 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 109.465 -0.569 . . . . 10.0 109.465 178.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -63.41 -43.71 96.71 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 108.797 -0.816 . . . . 10.0 108.797 178.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -65.04 -41.66 95.0 Favored 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 109.203 -0.666 . . . . 10.0 109.203 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 28.4 tptt -65.41 -42.4 92.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.085 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 67.7 mt -65.87 -43.66 87.73 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -61.55 -45.88 92.28 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.497 -0.927 . . . . 10.0 108.497 178.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -57.19 -51.96 67.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.875 -1.057 . . . . 10.0 109.03 178.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 78.6 mt -63.93 -42.22 97.42 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.865 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -61.36 -44.28 97.45 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.612 0.244 . . . . 10.0 111.233 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -72.08 -2.05 17.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.009 0.433 . . . . 10.0 111.253 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -111.31 -47.42 3.19 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.91 178.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 93.7 mt -64.93 -28.29 69.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.729 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 46.8 m -68.25 -62.17 3.35 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 120.791 -0.363 . . . . 10.0 110.832 178.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -62.19 -38.42 55.62 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.63 1.554 . . . . 10.0 111.288 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 13.0 mt -70.58 -32.39 69.76 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.581 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -63.65 -48.18 79.8 Favored Glycine 0 N--CA 1.449 -0.441 0 N-CA-C 110.807 -0.917 . . . . 10.0 110.807 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -63.05 -39.94 96.24 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -64.61 -45.53 86.51 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.039 179.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 85.2 mmm -60.62 -35.74 76.91 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.624 -0.51 . . . . 10.0 109.624 178.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 55.4 mtt180 -67.66 -41.58 83.56 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -63.13 -42.42 99.51 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.999 -0.741 . . . . 10.0 108.999 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -62.43 -47.32 84.6 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.45 -46.14 89.6 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 115.318 -0.856 . . . . 10.0 110.479 179.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -61.45 -46.03 91.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.784 0.326 . . . . 10.0 110.19 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -63.96 -36.15 83.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.634 179.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -76.0 -45.9 32.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.839 179.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 76.3 t -67.45 -43.38 87.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.619 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -64.56 -35.84 82.29 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.025 -0.732 . . . . 10.0 109.025 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.62 -44.39 86.66 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 107.316 -1.365 . . . . 10.0 107.316 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 50.9 mt -59.8 -35.42 74.64 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.24 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 67.6 mtt180 -62.02 -49.35 76.36 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.638 -0.504 . . . . 10.0 109.638 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 4.7 p -81.81 6.15 16.48 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.899 -0.591 . . . . 10.0 111.865 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 49.2 m170 -116.96 -45.86 2.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.857 0.36 . . . . 10.0 110.954 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 97.8 mt -76.04 -38.23 57.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.481 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -58.47 -58.66 17.41 Favored Pre-proline 0 CA--C 1.533 0.315 0 N-CA-C 111.658 0.244 . . . . 10.0 111.658 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.55 -37.5 58.08 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 121.518 1.479 . . . . 10.0 111.094 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -60.58 -47.54 85.76 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.802 0.334 . . . . 10.0 110.28 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 34.9 m -69.4 -32.35 71.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.066 -0.515 . . . . 10.0 109.94 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -67.31 -41.65 85.0 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.288 -0.634 . . . . 10.0 109.288 178.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -63.74 -38.82 92.52 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 107.971 -1.122 . . . . 10.0 107.971 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 79.7 mt -65.15 -31.64 72.93 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 115.142 -0.935 . . . . 10.0 110.061 178.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -63.39 -34.24 77.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.169 0.509 . . . . 10.0 109.706 178.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -80.04 -48.0 13.99 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.023 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 50.8 mtt180 -64.84 -50.86 64.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.738 -0.665 . . . . 10.0 111.835 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 70.5 mt -60.62 -33.03 72.16 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.329 -0.249 . . . . 10.0 110.329 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -66.55 -39.58 88.61 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.944 -0.761 . . . . 10.0 108.944 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.27 -41.39 81.11 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 109.216 -0.661 . . . . 10.0 109.216 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -60.89 -43.99 97.73 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.33 -0.85 . . . . 10.0 108.8 178.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 60.0 mt -67.97 -34.62 76.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.679 -0.692 . . . . 10.0 110.078 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.41 -42.63 99.58 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.179 -0.675 . . . . 10.0 109.179 178.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -66.92 -43.6 82.86 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.176 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 88.5 mt -66.02 -24.8 66.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.758 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -80.18 -42.85 22.61 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.78 -0.452 . . . . 10.0 109.78 178.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -67.68 -47.76 68.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.366 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -74.22 -35.87 63.9 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.426 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -63.94 -46.59 91.12 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.423 -1.071 . . . . 10.0 110.423 178.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.62 -41.96 99.75 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 110.5 -1.04 . . . . 10.0 110.5 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -62.73 -53.07 59.99 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 54.3 mtt85 -52.99 -46.81 68.49 Favored 'General case' 0 C--O 1.221 -0.427 0 O-C-N 123.781 0.676 . . . . 10.0 110.784 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 54.6 mt -59.34 -42.77 92.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.462 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -71.86 -42.85 66.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.756 0.312 . . . . 10.0 110.842 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -66.81 -52.72 40.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.633 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 21.2 m-30 -65.45 -20.25 66.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.643 0.259 . . . . 10.0 111.174 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -68.33 -39.4 81.96 Favored 'General case' 0 CA--C 1.519 -0.25 0 N-CA-C 107.619 -1.252 . . . . 10.0 107.619 177.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -78.13 -32.74 50.53 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.15 -0.932 . . . . 10.0 108.768 178.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.11 -33.89 76.81 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.441 -0.8 . . . . 10.0 109.492 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.83 -45.51 89.26 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.443 -0.798 . . . . 10.0 109.103 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -33.76 76.48 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.262 179.135 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -60.8 -37.28 81.41 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 108.49 -0.929 . . . . 10.0 108.49 178.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -80.14 -36.19 35.56 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.216 -0.902 . . . . 10.0 110.998 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 65.4 mt -63.75 -41.89 97.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.843 0.354 . . . . 10.0 111.072 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 2.7 p -67.43 -39.68 85.47 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.986 0.422 . . . . 10.0 110.342 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 7.5 p -74.21 -24.75 59.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.919 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 20.5 mt -74.89 -33.05 62.0 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.992 -0.744 . . . . 10.0 108.992 177.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 49.2 m -61.95 -26.82 68.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.298 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -65.34 -17.37 64.47 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-O 121.383 0.611 . . . . 10.0 110.26 178.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 3.8 mptt -111.15 -35.08 5.99 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.899 179.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -63.96 -22.6 66.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.64 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 75.9 mttt -114.15 -70.6 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.49 0 CA-C-O 119.313 -0.375 . . . . 10.0 111.951 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -58.43 -51.76 6.8 Favored 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 122.151 1.901 . . . . 10.0 113.2 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -63.82 -41.5 97.85 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.065 -0.254 . . . . 10.0 111.408 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 1.1 mt -63.88 -38.52 91.39 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.829 -0.348 . . . . 10.0 110.107 178.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -66.84 -39.03 87.5 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.66 -41.16 96.29 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.726 -0.842 . . . . 10.0 108.726 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 51.5 mt -63.15 -42.97 99.54 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.762 178.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -64.9 -43.03 94.2 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.021 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -65.36 -20.53 66.43 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.733 -0.667 . . . . 20.0 111.591 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -92.86 -38.37 5.5 Favored Glycine 0 CA--C 1.523 0.548 0 N-CA-C 109.397 -1.481 . . . . 10.0 109.397 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 26.4 mt -54.78 -42.71 72.08 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.36 0.504 . . . . 10.0 112.36 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 96.0 mt -58.99 -62.05 6.6 Favored Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 120.811 -0.356 . . . . 10.0 111.709 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.36 -38.64 89.59 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.231 1.954 . . . . 10.0 111.741 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 27.3 t -63.31 -46.75 94.73 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-O 120.722 0.296 . . . . 10.0 110.413 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 24.1 mt -64.61 -39.57 93.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.252 -0.277 . . . . 10.0 110.252 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -63.15 -48.95 76.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.33 -0.395 . . . . 10.0 110.631 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 23.1 p -65.79 -39.79 91.31 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.768 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.14 -40.77 96.87 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 116.22 -0.445 . . . . 10.0 109.831 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -61.26 -37.77 84.31 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.515 178.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 86.0 t -62.98 -46.21 96.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.21 -0.45 . . . . 10.0 109.874 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.17 -34.84 77.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.104 -0.498 . . . . 10.0 111.079 179.288 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -73.62 -44.77 56.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.158 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 15.8 mt -58.41 -47.38 84.1 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.393 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 14.1 p -64.11 -39.89 95.03 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.312 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -62.81 -50.71 69.91 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.998 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 67.9 mt -62.79 -28.64 70.13 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.166 0.432 . . . . 10.0 112.166 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -86.57 -33.15 20.32 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.556 0.576 . . . . 10.0 112.556 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -85.13 -38.7 18.76 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.65 0.611 . . . . 10.0 112.65 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -67.1 -29.24 68.94 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 112.25 0.463 . . . . 10.0 112.25 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.28 -30.21 70.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.848 0.356 . . . . 10.0 110.905 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -63.47 -26.62 68.81 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.928 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.97 -4.59 46.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.594 -179.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 82.8 mt -98.5 -15.79 19.44 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.359 -0.382 . . . . 10.0 111.398 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 . . . . . 0 C--O 1.246 0.877 0 CA-C-O 118.412 -0.804 . . . . 10.0 110.229 179.927 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.235 0.301 0 CA-C-O 120.793 0.33 . . . . 10.0 110.468 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -99.65 116.32 31.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.45 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -109.51 119.61 39.96 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.582 -179.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 6.8 mptt -93.86 122.89 36.81 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 42.4 mt -117.93 124.37 48.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.836 0.351 . . . . 10.0 111.232 -178.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 29.2 t -107.86 114.14 45.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.226 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 26.0 t -91.15 117.09 33.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.36 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 19.1 m -113.68 161.41 12.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.719 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 152.57 172.03 20.65 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 111.321 -0.711 . . . . 10.0 111.321 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.74 167.05 11.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.189 0.519 . . . . 10.0 112.081 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -67.66 -16.57 67.98 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 115.863 -0.608 . . . . 10.0 113.94 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -115.0 18.72 16.08 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.398 -0.906 . . . . 10.0 113.73 -179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 35.8 m -80.27 -32.27 13.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 117.691 0.746 . . . . 10.0 112.184 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.69 39.34 2.76 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.782 -0.723 . . . . 10.0 113.129 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -61.14 -47.99 83.67 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.9 p -62.49 -43.28 99.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.517 0.199 . . . . 10.0 111.106 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.01 -47.47 85.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.126 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 35.8 mt -61.82 -44.99 95.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.391 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 6.7 m -65.82 -51.4 59.26 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.041 -0.527 . . . . 10.0 112.283 -178.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 50.3 mt -62.48 -30.27 48.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-O 120.932 0.396 . . . . 10.0 110.688 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 28.4 tp60 -66.28 -25.1 66.71 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.753 179.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 36.2 tp -95.15 -32.97 12.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.066 0.46 . . . . 10.0 110.219 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 48.8 mm -73.27 -63.48 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.997 -0.547 . . . . 10.0 112.058 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -110.04 -3.6 16.36 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 -178.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 20.1 m-80 66.57 38.51 4.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.4 0.619 . . . . 10.0 109.703 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 21.2 t60 -123.52 114.21 19.77 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.55 -179.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -85.1 134.82 34.18 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.592 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 m -98.96 115.19 38.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 N-CA-C 109.668 -0.493 . . . . 10.0 109.668 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -85.84 -7.07 58.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.081 -0.508 . . . . 10.0 111.65 -178.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -101.39 161.61 13.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.077 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -85.81 91.7 8.41 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.084 0.469 . . . . 10.0 110.854 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.11 135.16 37.5 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.097 179.097 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.3 172.29 14.38 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.605 2.203 . . . . 10.0 112.364 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -165.6 136.13 3.68 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.398 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 4.2 mp -130.56 -62.54 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 107.398 -1.334 . . . . 10.0 107.398 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.94 85.36 1.68 Allowed 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.029 -0.987 . . . . 10.0 109.031 178.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -120.86 110.41 16.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.611 -0.722 . . . . 10.0 111.006 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.51 149.1 24.05 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.464 -0.789 . . . . 10.0 112.292 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -124.54 176.39 6.55 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.245 -0.888 . . . . 10.0 109.129 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -163.09 130.56 3.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.571 0.224 . . . . 10.0 111.268 -179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -157.49 158.02 34.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.401 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -120.83 128.0 52.44 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 7.9 m -139.53 173.52 10.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.999 0.428 . . . . 10.0 110.96 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 21.9 t -103.43 106.03 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.545 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 58.9 mt -102.99 114.42 42.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.684 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 61.32 27.19 16.89 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.947 -0.57 . . . . 10.0 111.571 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.63 -9.25 73.92 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.566 -0.826 . . . . 10.0 113.035 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -105.43 124.33 49.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.858 0.361 . . . . 10.0 110.903 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 12.7 t -80.85 136.91 36.17 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.723 -0.473 . . . . 10.0 109.723 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -154.68 161.0 41.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.727 0.299 . . . . 10.0 111.18 -179.256 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 29.7 tp -96.45 130.15 43.66 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 86.7 mt -109.3 115.86 30.78 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.925 0.393 . . . . 10.0 112.012 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -101.15 97.32 7.87 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.044 -1.095 . . . . 10.0 108.044 178.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 27.5 mt -93.5 129.24 44.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.897 -0.592 . . . . 10.0 112.496 -177.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 48.3 tp -119.26 115.59 24.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.861 -0.608 . . . . 10.0 109.91 178.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -89.59 119.31 29.9 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.793 -0.639 . . . . 10.0 110.293 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 40.2 p -75.74 156.83 34.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.881 -0.6 . . . . 10.0 112.074 -178.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.38 155.17 9.56 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.488 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.52 -53.14 26.22 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.636 -0.792 . . . . 10.0 111.587 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -132.77 128.79 37.59 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.854 -0.424 . . . . 20.0 109.854 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -140.09 171.41 14.21 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.152 -0.476 . . . . 10.0 109.77 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -108.18 -86.54 0.51 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.198 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -164.38 93.29 0.67 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.029 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 31.5 t -118.42 153.56 33.89 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.894 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.93 -28.76 69.75 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.179 0.514 . . . . 10.0 110.188 179.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 11.2 mmm -64.08 -31.59 72.83 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.06 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 48.8 ttt85 -67.17 -52.47 40.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.397 -0.82 . . . . 10.0 110.572 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -31.77 67.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.602 -0.727 . . . . 10.0 110.099 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -61.71 -57.59 11.36 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.31 -0.859 . . . . 10.0 112.313 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -71.07 -18.71 62.54 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.373 0.879 . . . . 10.0 113.373 -178.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 84.9 mtp -89.39 -5.51 57.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.09 0.472 . . . . 10.0 111.016 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 11.0 ttm105 -89.18 -33.1 17.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.671 -179.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -47.48 62.19 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.837 0.68 . . . . 10.0 112.837 -178.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.49 148.38 45.29 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.678 -0.772 . . . . 10.0 113.897 -178.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -107.52 -45.65 4.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.192 0.52 . . . . 10.0 109.795 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -92.05 133.77 11.91 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.239 -0.744 . . . . 10.0 111.239 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -125.69 132.1 52.47 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.329 0.492 . . . . 10.0 112.329 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 78.0 mt -97.3 114.35 26.1 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.762 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 21.1 m -87.31 89.94 8.18 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 21.9 t -91.14 123.48 43.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.78 -0.645 . . . . 10.0 111.417 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -132.95 168.73 17.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.822 -0.626 . . . . 10.0 109.668 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -102.8 120.89 41.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 110.022 -0.362 . . . . 10.0 110.022 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 42.2 pt -68.99 -7.75 8.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 112.124 0.416 . . . . 10.0 112.124 -179.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -102.92 7.12 39.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.279 0.562 . . . . 10.0 110.603 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -141.77 100.54 3.77 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.065 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.9 -27.04 64.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.886 -0.597 . . . . 10.0 112.16 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 9.2 tmtm? -58.28 -47.58 83.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.515 -0.311 . . . . 10.0 110.939 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 71.1 p -67.75 -31.0 70.61 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.26 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -67.19 -40.74 86.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.091 0.472 . . . . 10.0 110.142 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -71.88 -29.36 64.27 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.727 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.57 -11.64 61.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.914 -0.584 . . . . 10.0 112.006 -179.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 33.3 mm -59.46 -40.93 83.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.887 0.375 . . . . 10.0 110.086 179.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -64.18 -39.9 94.97 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 108.692 -0.855 . . . . 10.0 108.692 178.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 8.2 t-160 -63.26 -39.33 94.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.227 -0.897 . . . . 10.0 110.132 179.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -69.88 -52.22 26.62 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.529 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 8.6 ttt180 -54.1 -43.11 70.13 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.629 0.252 . . . . 10.0 111.435 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -65.39 -38.03 88.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.343 -0.389 . . . . 10.0 111.267 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.21 -36.45 77.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.965 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 73.8 mt -70.99 -37.86 69.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.344 178.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -60.39 -32.17 71.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.663 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 1.2 ttp-105 -68.01 -29.97 69.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.667 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 22.3 m -95.57 -9.35 9.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.541 -0.3 . . . . 10.0 111.536 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 14.0 mmtt -103.96 -18.22 14.68 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.572 -0.286 . . . . 10.0 110.861 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 15.2 t70 75.87 -39.0 0.36 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.644 -0.707 . . . . 10.0 112.527 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 5.0 m -107.73 156.29 19.26 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.726 0.298 . . . . 10.0 111.026 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 35.1 mp0 -81.18 -19.66 42.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.944 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . 0.403 ' OD2' ' NE2' ' B' ' 166' ' ' HIS . 31.6 t70 -79.16 84.12 5.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.522 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 19.8 t -127.39 132.6 24.41 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.858 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -65.53 99.23 0.36 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.581 2.188 . . . . 10.0 111.322 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 66.9 mtt -121.56 153.79 37.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.592 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 99.1 t -134.62 130.67 53.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 179.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 14.6 tp -85.35 114.67 22.59 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.644 -0.502 . . . . 10.0 109.644 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 66.2 t -109.34 112.05 38.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.784 -178.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -93.93 97.82 2.26 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 110.339 -1.104 . . . . 10.0 110.339 178.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -87.07 162.67 17.45 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.139 0.422 . . . . 10.0 112.139 -178.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 92.8 mttt 74.15 34.95 0.8 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.207 -0.906 . . . . 10.0 112.455 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 5.4 p -71.74 -7.47 48.29 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.983 0.42 . . . . 10.0 111.457 179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -90.33 -5.12 56.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.785 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 68.0 mt -96.52 129.22 33.76 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.267 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.79 1.1 8.47 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 123.191 2.594 . . . . 10.0 112.136 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.35 16.16 5.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.419 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -56.8 122.29 11.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.65 -0.705 . . . . 10.0 111.902 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.71 -22.54 11.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.318 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 38.9 t -98.55 118.18 44.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.56 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -72.12 151.24 43.16 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.263 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 2.0 m -58.59 -42.55 88.31 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.243 0.46 . . . . 10.0 112.243 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -67.13 -34.67 78.09 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.678 0.251 . . . . 10.0 111.678 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -61.36 -43.34 99.03 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.232 0.539 . . . . 10.0 109.931 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.53 -42.78 64.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.643 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -59.86 -43.97 94.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.053 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -61.25 -43.48 98.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.718 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 31.2 tp -65.04 -40.41 94.76 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.232 -0.44 . . . . 10.0 109.897 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.32 -46.43 88.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.707 -0.678 . . . . 10.0 110.402 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -64.54 -32.9 74.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.242 -0.436 . . . . 10.0 110.482 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 44.0 m -70.61 -18.31 62.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.593 179.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -106.08 1.11 26.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.852 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 66.69 28.93 74.01 Favored Glycine 0 CA--C 1.517 0.199 0 CA-C-N 115.914 -0.584 . . . . 10.0 112.801 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 49.4 pt -123.21 153.84 65.02 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.593 0.235 . . . . 10.0 110.874 -179.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -83.29 149.22 13.25 Favored 'Trans proline' 0 C--O 1.235 0.332 0 C-N-CA 122.435 2.09 . . . . 10.0 112.019 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -109.46 128.22 54.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.253 -0.431 . . . . 10.0 110.12 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 24.7 mm -126.48 123.99 64.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.085 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -83.01 127.01 33.17 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 107.792 -1.188 . . . . 10.0 107.792 178.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 11.1 m -133.58 160.6 36.99 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.136 0.493 . . . . 10.0 112.21 -177.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 12.7 t -157.58 123.53 4.72 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.025 -0.731 . . . . 10.0 109.025 178.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -76.89 -21.39 54.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.074 0.464 . . . . 10.0 110.065 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -73.06 -48.4 36.32 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.173 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 34.2 p -92.04 -6.21 51.48 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.032 0.444 . . . . 10.0 111.205 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 3.4 ttt-85 58.86 38.13 24.64 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.354 -0.839 . . . . 10.0 111.484 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -107.22 136.07 47.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.057 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 76.44 -10.09 18.38 Favored Glycine 0 CA--C 1.518 0.254 0 O-C-N 123.531 0.519 . . . . 10.0 114.332 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 22.5 t -55.52 -54.82 21.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 112.117 0.414 . . . . 10.0 112.117 -178.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.91 -47.7 82.14 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.994 -178.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -62.46 -36.55 82.8 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.255 0.465 . . . . 10.0 112.255 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -59.42 -47.19 86.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.935 0.398 . . . . 10.0 110.48 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -68.81 -42.55 77.13 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.644 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 17.2 m-30 -61.67 -43.69 98.37 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.658 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 97.0 m -59.11 -40.45 85.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.26 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 30.1 tp -57.5 -44.69 85.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.289 0.566 . . . . 10.0 109.56 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 44.5 t -65.73 -38.23 81.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.179 179.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -63.04 -35.68 81.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.843 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -69.83 -41.4 75.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.05 0.452 . . . . 10.0 110.004 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 85.1 mt -62.85 -43.64 99.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.31 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.34 -48.44 74.21 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.707 179.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 29.1 mtmm -64.77 -37.58 88.1 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.238 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . 0.403 ' NE2' ' OD2' ' B' ' 108' ' ' ASP . 3.1 t-160 -61.25 -43.05 99.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.845 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -65.97 -46.6 77.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.39 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.63 -47.82 83.68 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.384 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -62.9 -34.92 78.45 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.014 0.376 . . . . 10.0 112.014 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 15.1 mmt -71.74 -34.92 69.92 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.901 0.381 . . . . 10.0 110.583 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 21.6 m . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.2 -0.455 . . . . 10.0 111.409 -179.929 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.036 -0.426 . . . . 10.0 112.036 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.28 131.75 53.78 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.806 0.336 . . . . 10.0 110.694 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 49.0 t -118.64 140.83 40.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.996 -178.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.96 123.11 34.2 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.353 178.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 47.0 t -107.6 136.96 41.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 116.11 -0.496 . . . . 10.0 109.952 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -90.58 133.3 35.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.933 0.397 . . . . 10.0 111.487 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 83.7 mt -101.67 147.63 34.13 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.766 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.72 45.16 0.84 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 123.247 2.631 . . . . 10.0 113.458 -178.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -148.98 27.58 0.86 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.117 0.484 . . . . 10.0 109.998 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 49.3 mttm 60.37 44.16 12.57 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.176 -0.92 . . . . 10.0 111.826 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -147.91 177.1 9.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.952 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.97 168.46 19.92 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.858 0.361 . . . . 10.0 111.287 -178.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 12.0 t -147.63 151.55 36.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.737 -0.665 . . . . 10.0 109.283 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 4.2 t -104.9 117.46 50.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.809 0.338 . . . . 10.0 111.016 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 21.1 t -112.68 140.81 30.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.716 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.22 137.03 33.71 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.71 179.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 22.0 t -87.43 120.88 37.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.824 0.345 . . . . 10.0 110.15 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 16.5 mtp180 -129.34 135.11 48.32 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.698 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -78.84 49.37 0.9 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.92 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . -161.04 25.98 0.27 Allowed Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 120.457 -0.878 . . . . 10.0 112.34 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 11.6 ptm -151.94 159.06 43.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.626 0.25 . . . . 10.0 111.128 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 93.9 p -100.98 -179.71 4.13 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.737 -179.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 98.6 t -67.1 -33.39 62.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 108.898 -0.779 . . . . 10.0 108.898 178.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -59.38 -43.14 92.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.463 -0.789 . . . . 10.0 110.546 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -68.73 -56.07 9.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.115 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 1.7 m -57.59 -37.22 72.84 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.383 0.883 . . . . 10.0 113.383 -178.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -91.89 -8.98 44.87 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.915 0.709 . . . . 10.0 112.915 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -62.07 -56.81 15.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.956 0.407 . . . . 10.0 110.499 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -59.93 -33.16 71.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.82 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -67.75 -36.57 80.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.491 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 88.0 mt -86.13 -43.31 13.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.42 -0.355 . . . . 10.0 111.913 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 16.1 mmtp -61.64 -30.71 70.89 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.16 0.429 . . . . 10.0 112.16 -179.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 5.1 p -71.11 -17.82 20.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.926 0.394 . . . . 10.0 111.226 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -108.93 -2.85 18.01 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.893 0.331 . . . . 10.0 111.893 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 83.91 33.52 20.98 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 120.934 -0.651 . . . . 10.0 113.057 179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 64.3 mt -121.27 154.78 35.89 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -123.15 152.56 41.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.855 0.36 . . . . 10.0 111.035 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -66.73 -6.24 15.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.592 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -74.13 -27.1 60.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.691 -0.686 . . . . 10.0 111.599 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 1.9 m -124.38 20.57 8.79 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.655 0.264 . . . . 10.0 111.697 -178.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 82.6 m -143.9 157.34 44.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.926 0.393 . . . . 10.0 110.721 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 4.4 p -144.43 156.54 14.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.87 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 3.8 m -100.62 127.95 53.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.168 0.508 . . . . 10.0 112.3 -179.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -107.03 117.28 33.64 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 12.7 mtm180 -75.93 127.39 32.89 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 110.126 -0.324 . . . . 10.0 110.126 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.66 87.66 6.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.008 0.433 . . . . 10.0 110.883 -179.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 54.1 mt -99.67 103.1 14.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.353 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt 52.91 28.7 6.83 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.42 0.896 . . . . 10.0 113.42 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 98.53 6.37 56.47 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.535 -0.841 . . . . 10.0 113.318 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 45.0 mmt-85 -113.99 117.03 30.18 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.387 -0.478 . . . . 10.0 111.143 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -73.43 109.59 7.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.819 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 4.0 m -104.42 117.4 34.08 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.422 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 2.1 t -67.55 132.86 32.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.742 -179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 28.7 m -136.27 146.75 47.03 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.118 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -81.4 170.03 16.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.508 -179.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -83.26 -18.49 38.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.04 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.04 -16.41 63.15 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.702 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.19 148.38 43.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.273 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -82.16 161.57 22.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.385 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 9.2 tp -89.32 -0.48 8.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.499 0.666 . . . . 10.0 110.861 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -62.42 -51.33 74.1 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 113.193 0.812 . . . . 10.0 113.193 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -78.08 31.8 0.44 Allowed 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 122.491 2.127 . . . . 10.0 112.864 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -117.62 25.96 10.04 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.239 0.542 . . . . 10.0 110.108 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -71.78 105.38 3.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.915 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 90.17 13.16 60.74 Favored Glycine 0 CA--C 1.517 0.217 0 C-N-CA 120.842 -0.694 . . . . 10.0 113.095 178.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -114.43 156.15 25.04 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 122.709 -0.289 . . . . 10.0 110.648 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -114.4 154.5 28.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.577 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 6.3 mt -128.21 135.56 49.87 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.409 -0.359 . . . . 10.0 111.696 -178.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 63.9 mt -118.88 118.28 57.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 108.488 -0.93 . . . . 10.0 108.488 178.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 11.9 t -90.02 124.3 42.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.566 0.222 . . . . 10.0 110.58 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -127.0 155.29 43.44 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.014 0.435 . . . . 10.0 111.045 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 13.5 t -76.28 143.55 12.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.426 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 79.7 mt . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.438 -0.791 . . . . 10.0 111.313 -179.869 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 46.8 mt . . . . . 0 C--O 1.213 -0.824 0 N-CA-C 111.166 0.062 . . . . 10.0 111.166 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 69.9 mtt180 -70.72 -44.38 66.98 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 178.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -64.78 -29.64 70.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.318 -0.856 . . . . 10.0 109.757 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -86.93 -38.83 16.32 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.716 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 1.7 mmt -62.01 -36.64 82.13 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.827 -0.17 . . . . 10.0 111.329 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 2.0 p -62.0 -39.99 94.11 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.79 -0.819 . . . . 10.0 108.79 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -73.35 -45.57 54.3 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.201 178.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.91 -54.26 41.25 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 115.892 -0.595 . . . . 10.0 109.462 179.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 75.7 mt -63.52 -44.17 95.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.142 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -58.69 -55.18 38.45 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 120.746 0.308 . . . . 10.0 110.815 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -63.89 -50.09 70.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.821 -0.627 . . . . 10.0 111.603 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 46.1 t -59.55 -45.58 93.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 112.057 0.391 . . . . 10.0 112.057 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -72.48 -40.52 66.87 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.348 0.499 . . . . 10.0 112.348 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -68.68 -33.35 73.82 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.892 0.377 . . . . 10.0 110.696 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -88.12 -24.51 23.36 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.498 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -63.45 -24.25 35.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.016 0.436 . . . . 10.0 110.005 179.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -62.45 -64.5 2.98 Favored Pre-proline 0 N--CA 1.451 -0.419 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.43 178.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -63.59 -29.19 70.05 Favored 'Trans proline' 0 C--N 1.361 1.193 0 C-N-CA 121.802 1.668 . . . . 10.0 111.363 177.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 5.0 m-30 -59.58 -57.77 11.52 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 109.424 -0.584 . . . . 10.0 109.424 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 72.7 mt -72.35 -32.86 66.85 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 115.686 -0.688 . . . . 10.0 111.003 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -60.98 -49.06 78.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.748 0.309 . . . . 10.0 110.585 179.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -63.31 -44.97 93.48 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -61.41 -43.65 98.5 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.805 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -62.64 -46.23 89.19 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 110.258 -0.275 . . . . 10.0 110.258 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 71.0 mttt -59.6 -45.57 91.52 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.089 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -65.8 -46.02 80.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.0 179.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 4.0 m0 -58.51 -41.14 84.76 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.39 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -59.86 -48.12 82.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.817 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -64.12 -41.63 97.16 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -60.9 -40.1 91.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.861 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 96.2 mmm -75.6 -39.25 58.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.742 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -62.05 -52.58 63.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.286 0.565 . . . . 10.0 109.612 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.54 -22.44 66.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.504 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -78.63 -46.44 19.24 Favored 'General case' 0 C--O 1.221 -0.406 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 178.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 43.0 mtt85 -62.98 -33.96 76.52 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.271 0.558 . . . . 10.0 109.78 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -70.63 -7.02 41.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.338 -0.846 . . . . 10.0 110.477 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -112.62 -36.38 5.23 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.493 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 53.5 t -48.96 -49.08 15.96 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.673 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -62.7 -59.04 13.77 Favored Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 111.747 0.277 . . . . 10.0 111.747 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -56.26 -44.05 50.11 Favored 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 122.032 1.821 . . . . 10.0 111.932 178.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 34.8 mt -64.74 -40.06 94.69 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 116.578 -0.283 . . . . 10.0 110.304 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -65.9 -35.36 80.42 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 109.214 -0.661 . . . . 10.0 109.214 178.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.94 -44.18 90.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.738 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -61.98 -48.24 81.24 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.9 -43.85 97.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.32 -0.855 . . . . 10.0 110.584 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -63.62 -50.55 68.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.745 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -59.15 -45.86 89.87 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.899 0.38 . . . . 10.0 110.139 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.38 -44.64 96.54 Favored Glycine 0 N--CA 1.442 -0.921 0 N-CA-C 111.015 -0.834 . . . . 10.0 111.015 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -62.22 -38.29 88.62 Favored 'General case' 0 C--O 1.221 -0.441 0 N-CA-C 110.438 -0.208 . . . . 10.0 110.438 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -58.24 -43.61 87.88 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -71.16 -49.98 38.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.144 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 59.9 mttt -57.48 -49.34 76.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.538 -0.756 . . . . 10.0 111.507 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 69.8 mt -66.46 -34.35 77.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.519 -0.31 . . . . 10.0 110.986 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.77 -53.25 57.14 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.682 -0.488 . . . . 10.0 109.682 179.194 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.4 -37.55 81.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.633 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 60.8 mt -64.57 -48.63 74.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.8 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 15.3 mt-30 -69.74 -33.36 72.35 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.84 0.353 . . . . 10.0 111.037 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.5 -11.2 60.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.148 178.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 9.8 mttp -103.3 -38.64 7.14 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.94 -0.573 . . . . 10.0 109.84 177.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 59.0 mt -63.73 -19.9 65.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.727 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 14.8 m -80.63 -64.7 0.29 Allowed Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 116.578 -0.283 . . . . 10.0 111.736 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -68.72 -51.3 0.51 Allowed 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.954 1.769 . . . . 10.0 111.964 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 93.0 mt -66.81 -25.09 66.28 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.938 0.399 . . . . 10.0 110.193 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -72.88 -41.19 50.06 Favored Glycine 0 N--CA 1.444 -0.822 0 N-CA-C 109.075 -1.61 . . . . 10.0 109.075 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -64.41 -41.79 96.44 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 178.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -64.11 -31.87 73.23 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.156 -0.475 . . . . 10.0 109.851 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 11.0 tpt -67.68 -42.3 82.34 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.741 -0.837 . . . . 10.0 108.741 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 61.6 mtt180 -69.82 -40.11 76.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.449 -0.796 . . . . 10.0 109.801 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -62.37 -43.26 99.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.497 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . 0.573 ' CG ' ' CD1' ' C' ' 469' ' ' LEU . 23.1 mmt180 -70.06 -32.03 69.92 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.547 178.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -67.18 -38.65 85.77 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.738 -0.838 . . . . 10.0 108.738 178.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 82.3 mtt180 -56.74 -54.68 43.47 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 108.993 -0.743 . . . . 10.0 108.993 178.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -64.13 -39.82 94.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.498 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -57.37 -54.98 40.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.89 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 31.5 t -73.68 -36.2 46.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.636 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -63.55 -44.52 93.92 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.874 -0.33 . . . . 10.0 110.553 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -63.95 -31.97 73.35 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.492 -0.929 . . . . 10.0 108.492 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 7.3 mt -69.44 -37.36 77.33 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.276 -0.874 . . . . 10.0 109.044 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 70.2 mtt180 -62.11 -47.2 85.69 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.997 -0.372 . . . . 10.0 109.997 178.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 1.6 m -69.16 -9.24 51.91 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.148 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -104.21 -46.57 4.39 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.642 179.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 96.4 mt -64.17 -34.51 78.23 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.42 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.71 -60.67 8.65 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-O 119.668 -0.206 . . . . 10.0 111.422 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -66.76 -31.29 39.84 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 121.632 1.554 . . . . 10.0 111.494 178.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 4.6 m-30 -64.84 -42.01 95.26 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.824 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 11.9 p -71.93 -38.54 69.83 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 178.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -62.95 -44.27 96.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.192 0.52 . . . . 10.0 109.638 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -71.18 -31.23 67.39 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.42 -32.04 73.36 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.201 -0.666 . . . . 10.0 109.201 178.111 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 80.9 mtt180 -64.62 -39.44 93.71 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.589 -0.893 . . . . 10.0 108.589 177.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -66.7 -40.43 88.47 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.956 -0.757 . . . . 10.0 108.956 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -63.83 -49.15 73.95 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.459 178.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 69.9 mt -58.81 -42.15 88.46 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.878 -0.601 . . . . 10.0 109.607 178.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -62.8 -50.42 71.07 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.591 178.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -56.28 -42.7 77.91 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.889 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -71.34 -54.46 10.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.057 -0.52 . . . . 10.0 111.348 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 94.1 mt -63.22 -44.45 95.22 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.78 0.659 . . . . 10.0 112.78 -178.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -63.25 -42.24 99.15 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.543 0.211 . . . . 10.0 110.659 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.39 -38.77 91.0 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.778 -0.823 . . . . 10.0 108.778 178.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 39.5 mt -67.93 -18.85 64.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.955 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 82.5 mttt -75.84 -47.49 25.35 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.934 -0.765 . . . . 10.0 108.934 178.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -69.97 -50.35 42.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.545 -0.752 . . . . 10.0 109.3 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -61.85 -47.77 83.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.008 -0.996 . . . . 10.0 109.796 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -64.23 -41.25 98.37 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.961 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -58.46 -41.16 95.18 Favored Glycine 0 N--CA 1.45 -0.38 0 N-CA-C 111.05 -0.82 . . . . 10.0 111.05 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -70.36 -39.98 74.3 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 68.7 mtt180 -60.94 -44.24 97.52 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.368 179.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 66.6 mt -65.67 -44.0 87.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.502 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.65 -48.9 79.72 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -66.17 -33.24 75.33 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.399 -0.819 . . . . 10.0 110.75 179.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -62.94 -45.3 93.1 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.453 -0.573 . . . . 10.0 109.453 179.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 -69.33 -38.5 78.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.485 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.63 94.96 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.108 0.48 . . . . 10.0 110.083 178.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 14.4 mtmm -81.12 -18.36 46.74 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.117 178.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -72.76 -42.29 64.16 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.259 -0.645 . . . . 10.0 109.259 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -62.39 -36.2 81.57 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.395 -0.595 . . . . 10.0 109.395 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -66.32 -34.57 78.29 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.941 -0.572 . . . . 10.0 109.465 178.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -69.1 -42.94 75.45 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.081 -1.081 . . . . 10.0 108.081 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 86.1 mt -65.15 -40.94 95.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.278 -0.873 . . . . 10.0 112.42 -179.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 1.7 p -61.74 -45.75 92.6 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.879 0.371 . . . . 10.0 110.844 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.4 p -70.97 -33.98 70.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.967 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 16.1 mt -66.35 -43.63 85.53 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.625 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 1.8 p -68.55 -28.87 67.35 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.101 0.477 . . . . 10.0 109.877 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -78.11 2.23 18.61 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-O 121.616 0.722 . . . . 10.0 110.034 178.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -117.81 -36.83 3.55 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.401 -0.963 . . . . 10.0 108.401 177.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -72.1 -13.06 61.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.613 -0.722 . . . . 10.0 111.688 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -111.91 -70.1 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.552 0 C-N-CA 120.834 -0.346 . . . . 10.0 111.117 178.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -60.04 -55.2 1.73 Allowed 'Trans proline' 0 C--N 1.355 0.868 0 C-N-CA 121.928 1.752 . . . . 10.0 112.302 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -64.95 -41.07 95.81 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.304 0.483 . . . . 10.0 112.304 -179.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 10.9 mt -66.01 -40.65 91.28 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.588 -0.445 . . . . 10.0 111.253 179.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -69.92 -32.34 70.59 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.886 -0.783 . . . . 10.0 108.886 178.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.78 -42.25 95.23 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.049 -1.093 . . . . 10.0 108.049 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 51.6 mt -66.33 -34.4 77.9 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.154 -0.93 . . . . 10.0 109.936 178.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -63.41 -44.87 93.4 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.05 -0.722 . . . . 10.0 109.05 178.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -73.03 -5.44 38.9 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.467 -0.788 . . . . 20.0 112.076 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -102.76 -41.15 2.36 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 109.748 -1.341 . . . . 10.0 109.748 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 89.1 mt -71.34 -37.99 71.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.463 -0.369 . . . . 10.0 111.439 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 58.5 mt -56.43 -59.64 11.49 Favored Pre-proline 0 CA--C 1.534 0.365 0 N-CA-C 112.212 0.449 . . . . 10.0 112.212 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -62.77 -35.37 68.88 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 121.84 1.693 . . . . 10.0 111.718 179.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.16 -33.71 64.8 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 C-N-CA 120.652 -0.419 . . . . 10.0 110.643 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.73 -36.2 81.91 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -67.72 -44.17 78.25 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.92 -0.582 . . . . 10.0 109.74 178.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 13.7 m -62.25 -40.85 97.55 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.058 -0.719 . . . . 10.0 109.058 178.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -65.4 -43.01 91.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.247 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -57.78 -50.1 74.38 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.598 -0.274 . . . . 10.0 110.91 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 81.7 t -59.07 -46.32 91.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.347 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 14.7 m -66.91 -40.67 87.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.914 -0.584 . . . . 10.0 111.682 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -68.44 -45.96 71.11 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.012 0.375 . . . . 10.0 112.012 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 37.4 mt -59.88 -43.29 94.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.034 0.445 . . . . 10.0 110.627 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 34.0 p -75.95 -16.2 60.04 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.502 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -87.0 -48.63 7.95 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.985 -0.376 . . . . 10.0 109.985 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 77.9 mt -59.9 -42.45 93.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.051 0.453 . . . . 10.0 109.834 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -64.75 -36.35 84.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.639 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -49.56 65.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.533 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -55.79 -50.03 71.57 Favored 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.743 0.652 . . . . 10.0 111.643 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 5.0 m -60.92 -32.73 72.22 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.589 -0.732 . . . . 10.0 111.089 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt . . . . . 0 CA--C 1.529 0.143 0 CA-C-O 120.658 0.266 . . . . 10.0 111.209 179.98 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 58.7 mt . . . . . 0 N--CA 1.455 -0.225 0 CA-C-O 120.631 0.253 . . . . 10.0 111.664 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -62.33 -23.84 67.0 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.061 0.457 . . . . 10.0 111.073 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -79.01 -50.07 11.69 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.118 -0.697 . . . . 10.0 109.118 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -58.79 -44.72 90.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.243 -0.89 . . . . 10.0 110.394 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 25.9 m0 -64.76 -32.58 74.32 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.953 -0.567 . . . . 10.0 111.419 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -61.67 -50.27 73.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.452 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -37.51 87.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.21 0.528 . . . . 10.0 110.602 179.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 74.9 t -67.99 -41.86 84.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.964 178.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 81.9 m -62.71 -48.08 80.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.795 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 2.5 p -60.86 -46.2 91.55 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.683 0.278 . . . . 10.0 111.206 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 12.1 p -66.19 -39.01 89.36 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.906 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -66.24 -40.03 89.95 Favored 'General case' 0 CA--C 1.522 -0.106 0 CA-C-N 116.552 -0.295 . . . . 10.0 110.402 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 30.8 m -63.15 -48.22 79.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.438 . . . . 10.0 110.012 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -66.62 -29.11 69.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.681 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 53.0 tp -67.31 -46.38 73.71 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 61.2 mtt180 -62.59 -40.49 97.07 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.669 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -61.77 -48.6 79.93 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.778 -0.646 . . . . 10.0 109.813 178.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -60.18 -42.67 95.49 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.768 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 49.0 mt -57.48 -26.77 61.76 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.612 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -56.57 -78.09 0.14 Allowed Glycine 0 CA--C 1.52 0.377 0 C-N-CA 120.957 -0.64 . . . . 10.0 111.613 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -57.64 -33.4 96.6 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.901 2.401 . . . . 10.0 111.95 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 21.9 t -61.72 -49.15 85.49 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 CA-C-N 116.717 -0.22 . . . . 10.0 111.004 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 19.7 m -69.78 -34.7 74.11 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 110.075 -0.342 . . . . 10.0 110.075 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -61.92 -49.99 73.94 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.221 -0.659 . . . . 10.0 109.221 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -63.63 -40.79 97.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.703 -0.68 . . . . 10.0 109.212 178.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -58.27 -43.07 87.8 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.937 179.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 28.5 m0 -67.87 -36.48 80.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.865 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -70.53 -30.13 66.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.504 0.668 . . . . 10.0 109.429 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -73.46 -38.95 65.3 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.232 -1.025 . . . . 10.0 108.232 177.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 42.0 mt -68.31 -24.02 64.8 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 177.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -67.01 -47.94 69.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.118 -1.438 . . . . 10.0 107.118 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -65.65 -36.73 84.52 Favored 'General case' 0 C--N 1.333 -0.11 0 N-CA-C 108.576 -0.898 . . . . 10.0 108.576 178.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -59.47 -57.67 11.94 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.105 -0.952 . . . . 10.0 109.454 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 33.8 m -63.48 -42.93 98.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.59 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -63.15 -41.2 99.23 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.782 0.325 . . . . 10.0 110.457 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -66.54 -48.56 61.94 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 110.013 -1.235 . . . . 10.0 110.013 178.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 14.9 mt -59.82 -33.63 72.0 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 120.499 0.19 . . . . 10.0 110.527 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 27.7 mtt180 -62.62 -38.91 92.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.464 -0.335 . . . . 10.0 110.769 179.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -67.64 -40.19 84.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.341 0.591 . . . . 10.0 109.697 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -72.04 -50.08 31.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.301 -0.863 . . . . 10.0 110.91 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 92.1 mmm -63.49 -37.53 87.66 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.795 1.035 . . . . 10.0 113.795 -178.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 4.4 p -59.47 -45.65 91.04 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -70.46 -42.13 71.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.461 -0.79 . . . . 10.0 109.82 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -58.23 -48.17 81.22 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.739 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 78.2 mt -61.86 -50.11 73.54 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.678 0.251 . . . . 10.0 111.678 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -62.82 -42.94 99.93 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.822 0.344 . . . . 10.0 110.412 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -66.05 -43.13 88.4 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.31 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 2.8 p -66.76 -33.95 66.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 121.087 -0.245 . . . . 10.0 111.204 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -73.93 -43.58 57.85 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.996 0.426 . . . . 10.0 110.069 178.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -72.01 -11.8 60.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.915 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.09 -30.41 10.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.975 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 5.4 p -69.76 -29.9 42.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.746 0.308 . . . . 10.0 110.567 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -62.84 -59.6 12.1 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.198 178.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -63.58 -29.56 70.29 Favored 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 122.079 1.853 . . . . 10.0 110.952 178.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.3 -48.08 62.64 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.264 179.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 18.0 mt -64.77 -38.39 90.81 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 178.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -63.57 -50.24 70.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.903 -0.589 . . . . 10.0 109.816 178.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -62.07 -45.66 92.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.824 -0.626 . . . . 10.0 109.691 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -62.24 -41.24 98.25 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.841 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -64.09 -40.06 95.41 Favored 'General case' 0 C--O 1.225 -0.225 0 N-CA-C 109.562 -0.533 . . . . 10.0 109.562 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 43.0 mttp -61.08 -41.91 97.53 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 108.703 -0.851 . . . . 10.0 108.703 178.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 35.1 mttm -66.6 -42.05 87.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.358 -0.837 . . . . 10.0 109.906 178.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 13.8 m0 -64.2 -35.18 79.95 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.043 178.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -67.49 -46.06 74.05 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . 0.771 ' O ' ' CG ' ' C' ' 469' ' ' LEU . 42.2 mt-10 -60.24 -44.25 95.4 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 121.191 0.52 . . . . 10.0 109.901 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -71.61 -48.09 50.31 Favored 'General case' 0 C--O 1.217 -0.652 0 CA-C-N 115.486 -0.779 . . . . 10.0 112.402 -179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 11.3 mmt -60.17 -43.94 95.43 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.802 -0.359 . . . . 10.0 110.582 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -65.33 -46.53 79.89 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.793 -0.817 . . . . 10.0 108.793 178.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . 0.771 ' CG ' ' O ' ' C' ' 465' ' ' GLU . 96.2 mt -59.64 -46.3 89.42 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 115.39 -0.823 . . . . 20.0 111.499 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 19.3 m-30 -63.87 -44.14 93.99 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.99 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 19.5 ttm105 -65.23 -47.06 78.15 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.621 0.248 . . . . 10.0 111.219 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -65.01 -9.2 19.96 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.274 -0.421 . . . . 10.0 112.055 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -111.84 -43.67 3.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.648 -0.251 . . . . 10.0 111.188 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 42.4 t -64.95 -38.57 83.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.79 -0.186 . . . . 10.0 110.848 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -58.13 -59.7 12.47 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 120.879 -0.328 . . . . 10.0 111.311 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -65.32 -35.67 39.24 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 121.649 1.566 . . . . 10.0 111.384 178.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 10.2 mt -62.08 -41.95 98.7 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 109.82 -0.437 . . . . 10.0 109.82 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -63.16 -35.05 79.01 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -68.71 -51.33 42.74 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.767 -0.652 . . . . 10.0 109.298 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -62.93 -36.87 84.85 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.335 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 35.9 mt -66.09 -35.25 80.02 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -69.84 -36.71 75.8 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -63.57 -48.83 75.81 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 107.699 -1.223 . . . . 10.0 107.699 177.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -65.85 -33.37 85.6 Favored Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 114.999 -1.0 . . . . 10.0 111.319 178.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.63 -44.79 73.48 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 110.356 -0.239 . . . . 10.0 110.356 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -63.83 -39.57 94.53 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.125 -0.694 . . . . 10.0 109.125 178.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -65.33 -49.35 69.75 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.659 -0.867 . . . . 10.0 108.659 177.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -59.04 -38.99 80.62 Favored 'General case' 0 CA--C 1.522 -0.11 0 CA-C-N 115.943 -0.572 . . . . 10.0 110.613 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 39.3 mt -63.32 -44.23 95.54 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -69.61 -37.24 76.78 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.666 -0.494 . . . . 10.0 109.666 178.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -60.16 -43.84 95.48 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 177.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 58.2 mt -71.6 -37.56 70.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.569 179.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -61.6 -40.41 94.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.646 0.26 . . . . 10.0 110.305 179.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -75.66 9.59 2.19 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.081 -0.509 . . . . 10.0 111.009 178.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 56.8 mttp -123.2 -55.14 1.78 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.621 -0.718 . . . . 10.0 109.192 178.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 91.5 mt -61.23 -33.71 73.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.855 -0.612 . . . . 10.0 112.39 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 13.6 m -69.8 -61.04 3.25 Favored Pre-proline 0 CA--C 1.536 0.417 0 C-N-CA 120.734 -0.387 . . . . 10.0 111.668 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.17 -48.09 3.9 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 121.708 1.606 . . . . 10.0 111.801 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 12.4 mt -66.26 -34.01 77.03 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-N 116.908 -0.133 . . . . 10.0 110.983 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.87 -50.94 55.74 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.524 -0.846 . . . . 10.0 111.002 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -67.0 -34.28 77.4 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.931 0.396 . . . . 10.0 110.337 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -69.2 -46.66 66.88 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 58.4 mmm -61.22 -32.26 72.03 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -64.97 -44.5 89.17 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -68.15 -38.53 82.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.887 -0.597 . . . . 10.0 109.872 178.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -61.26 -45.28 95.18 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 107.963 -1.125 . . . . 10.0 107.963 177.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -62.25 -42.93 99.76 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.342 -0.844 . . . . 10.0 109.596 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -58.86 -49.44 77.74 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.596 -0.52 . . . . 10.0 109.596 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -61.41 -38.52 87.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.69 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -70.18 -51.41 31.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.778 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 66.7 t -65.29 -42.17 93.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.667 -179.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.62 -34.56 78.57 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.589 -0.523 . . . . 10.0 109.589 179.24 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -69.97 -39.82 75.75 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.548 -1.279 . . . . 10.0 107.548 177.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 81.9 mt -64.61 -28.67 69.78 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.901 -0.591 . . . . 10.0 109.899 178.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 28.8 mtt180 -62.37 -30.93 71.54 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.568 -0.53 . . . . 10.0 109.568 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.13 2.23 24.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.691 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 50.7 m170 -115.07 -16.4 11.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.505 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 93.2 mt -111.95 -55.0 2.56 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.652 -0.249 . . . . 10.0 111.448 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -50.71 -60.19 5.94 Favored Pre-proline 0 N--CA 1.468 0.465 0 N-CA-C 113.134 0.79 . . . . 10.0 113.134 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -66.5 -29.22 44.96 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.44 1.426 . . . . 10.0 110.98 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -66.19 -45.03 82.23 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.188 -0.46 . . . . 10.0 109.992 179.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 11.1 p -66.83 -29.22 69.1 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.882 -0.414 . . . . 10.0 109.882 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -70.76 -41.02 72.31 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 72.7 mt-10 -63.22 -39.54 94.91 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 107.704 -1.221 . . . . 10.0 107.704 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 32.9 mt -64.0 -36.25 83.35 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.151 -0.931 . . . . 10.0 109.426 177.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -60.59 -38.78 85.78 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -65.28 -45.37 84.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.24 0.543 . . . . 10.0 109.694 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -68.25 -41.31 81.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.443 -0.799 . . . . 10.0 110.121 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 53.3 mt -65.21 -35.08 79.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.204 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -61.36 -46.4 90.37 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.38 -39.39 89.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.821 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 4.4 ttm180 -60.79 -39.69 89.79 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 178.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 71.5 mt -72.05 -33.96 68.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.575 -0.738 . . . . 10.0 109.914 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -59.36 -43.91 92.76 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 178.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.61 -40.88 98.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.366 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 94.9 mt -69.66 -11.37 60.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.778 -0.646 . . . . 10.0 111.171 179.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -94.18 -51.87 4.63 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.924 -0.769 . . . . 10.0 108.924 178.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -59.28 -54.75 43.28 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.585 -0.734 . . . . 10.0 110.044 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -75.83 -23.97 55.81 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.725 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.22 -54.33 24.53 Favored Glycine 0 N--CA 1.449 -0.484 0 N-CA-C 111.176 -0.769 . . . . 10.0 111.176 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.7 -34.34 89.37 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 110.988 -0.845 . . . . 10.0 110.988 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -66.28 -53.21 39.4 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 55.2 mtt85 -59.57 -34.89 73.27 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.378 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 58.7 mt -63.27 -41.09 98.99 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.142 0.496 . . . . 10.0 109.775 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -72.83 -40.84 65.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.611 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -60.65 -50.49 73.29 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.816 -0.629 . . . . 10.0 109.544 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -58.92 -38.61 79.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.062 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.55 -43.17 94.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.155 179.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -66.15 -49.77 66.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.753 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.4 -36.64 80.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.851 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.06 -40.84 95.28 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 71.0 m -62.54 -49.17 76.39 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.944 -0.761 . . . . 10.0 108.944 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.49 -38.71 85.19 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.175 178.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -66.45 -38.37 87.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.278 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 75.2 mt -67.44 -35.69 79.73 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 178.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 16.9 m -70.01 -37.69 75.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.259 0.552 . . . . 10.0 109.796 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 3.1 p -78.55 -5.0 51.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.519 0.676 . . . . 10.0 110.156 179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 19.7 mt -98.88 -30.42 12.39 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.25 -0.886 . . . . 10.0 109.64 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.97 -30.33 69.59 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.027 0.441 . . . . 10.0 110.117 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -71.36 -5.76 34.96 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 121.505 0.669 . . . . 10.0 110.06 178.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -113.12 -35.17 5.46 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.516 -0.766 . . . . 10.0 109.175 177.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -65.65 -24.91 67.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.248 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -102.89 -73.14 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.463 0 CA-C-O 119.208 -0.425 . . . . 10.0 111.969 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -58.95 -51.38 6.96 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 122.444 2.096 . . . . 10.0 113.735 -178.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.13 -52.28 59.85 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.617 0.228 . . . . 10.0 111.617 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 16.5 mt -59.88 -40.73 89.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.864 -0.153 . . . . 10.0 111.4 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -63.06 -45.43 92.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.719 0.295 . . . . 10.0 110.709 178.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -66.67 -32.57 73.96 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.732 -0.387 . . . . 10.0 110.382 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 38.1 mt -63.2 -39.09 93.63 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 177.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -71.95 -36.92 70.02 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.154 -0.684 . . . . 10.0 109.154 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -64.01 -23.38 67.31 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.218 -0.901 . . . . 20.0 111.292 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -94.91 -33.0 6.84 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 109.317 -1.513 . . . . 10.0 109.317 178.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 13.9 mt -62.46 -41.0 98.45 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.938 0.347 . . . . 10.0 111.938 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 90.0 mt -58.26 -60.12 11.2 Favored Pre-proline 0 C--N 1.327 -0.389 0 C-N-CA 121.145 -0.222 . . . . 10.0 111.543 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -65.08 -31.42 54.99 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 122.052 1.835 . . . . 10.0 112.155 178.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -68.13 -36.51 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 C-N-CA 120.7 -0.4 . . . . 10.0 110.251 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 34.5 mt -71.26 -35.77 71.52 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 68.7 mt-10 -64.8 -50.35 67.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.125 178.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 2.7 p -64.6 -42.1 95.78 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.424 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -60.48 -42.05 95.49 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 66.3 mttt -65.38 -38.86 91.3 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-N 115.932 -0.577 . . . . 10.0 110.679 178.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 49.0 t -59.38 -49.56 83.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 N-CA-C 109.437 -0.579 . . . . 10.0 109.437 178.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 4.6 m -62.78 -40.12 96.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.876 178.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.59 -45.63 89.54 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.958 -0.565 . . . . 10.0 111.066 179.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 52.7 mt -59.97 -42.3 93.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.306 -0.407 . . . . 10.0 110.272 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 20.8 m -67.56 -46.91 71.35 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.01 -0.737 . . . . 10.0 109.01 178.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -55.9 -50.92 69.34 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.596 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 97.0 mt -55.41 -54.0 49.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.845 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -65.07 -50.08 67.55 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.941 0.348 . . . . 10.0 111.941 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -60.38 -37.44 80.78 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -71.18 -39.85 71.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.536 0.207 . . . . 10.0 111.069 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 83.8 m -59.52 -33.81 71.84 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.963 0.411 . . . . 10.0 110.401 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -63.93 -22.36 66.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.833 -0.621 . . . . 10.0 111.583 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.67 -24.62 14.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.896 0.379 . . . . 10.0 110.699 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 81.3 mt -75.95 -31.19 58.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.326 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 . . . . . 0 C--O 1.245 0.823 0 CA-C-O 118.566 -0.731 . . . . 10.0 110.495 179.823 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 2.7 m . . . . . 0 C--O 1.234 0.24 0 CA-C-O 121.126 0.488 . . . . 10.0 111.085 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -81.39 144.51 31.38 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.292 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -128.93 109.48 11.28 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.661 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 40.8 mmtt -93.41 106.07 18.07 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.356 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 8.7 mt -102.6 108.4 19.66 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.733 -179.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 49.9 t -99.89 115.04 40.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.189 0.518 . . . . 10.0 110.61 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 39.3 t -87.73 112.35 23.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 17.6 m -108.95 160.16 7.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.826 0.346 . . . . 10.0 111.038 -179.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 158.35 171.86 24.76 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.596 -0.812 . . . . 10.0 111.938 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.41 -176.82 3.31 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.156 0.503 . . . . 10.0 112.13 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -92.51 111.41 4.06 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.005 -0.617 . . . . 10.0 112.489 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 124.08 -20.28 7.16 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.905 -0.664 . . . . 10.0 111.959 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 24.8 m -53.38 -51.67 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 112.658 0.614 . . . . 10.0 112.658 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.55 29.54 1.41 Allowed Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.461 -0.876 . . . . 10.0 113.944 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -58.73 -51.21 70.92 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.258 0.551 . . . . 10.0 110.715 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.09 -44.66 91.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.325 -0.852 . . . . 10.0 111.484 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.32 -46.22 89.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.35 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 46.4 mt -62.6 -39.15 92.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.837 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 18.6 m -67.8 -45.86 73.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.791 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 67.5 mt -65.48 -31.67 54.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.173 0.511 . . . . 10.0 110.087 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -69.58 -20.53 63.65 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.332 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 6.8 tp -92.16 -46.74 7.6 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.415 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 40.8 mm -75.73 -63.8 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 112.781 0.66 . . . . 10.0 112.781 -178.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -87.79 -15.86 35.73 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.025 0.38 . . . . 10.0 112.025 -178.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 64.6 t30 66.21 47.67 1.8 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.629 0.728 . . . . 10.0 110.046 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 51.6 t60 -143.14 134.62 26.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.458 -0.792 . . . . 10.0 110.388 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -93.35 133.65 36.38 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.381 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 6.1 m -98.19 137.45 25.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.095 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -94.26 -18.15 21.95 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.359 0.599 . . . . 10.0 110.467 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -93.2 175.88 6.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.692 -0.686 . . . . 10.0 111.684 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -94.95 133.99 38.1 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.872 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -101.31 95.81 5.35 Favored Pre-proline 0 C--O 1.235 0.298 0 N-CA-C 110.113 -0.328 . . . . 10.0 110.113 178.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -66.31 103.97 0.7 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.545 2.163 . . . . 10.0 108.509 179.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 87.8 m -120.32 141.12 50.32 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 114.117 1.154 . . . . 10.0 114.117 -176.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 5.0 mp -113.82 -28.58 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 N-CA-C 106.583 -1.636 . . . . 10.0 106.583 176.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -176.65 103.5 0.06 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 114.651 -1.159 . . . . 10.0 110.378 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 52.6 m-20 -114.35 139.03 49.8 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 4.0 m -116.01 131.0 57.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.91 0.385 . . . . 10.0 111.8 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -129.81 150.06 51.27 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.111 -0.7 . . . . 10.0 109.111 179.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 35.4 ttp180 -165.1 136.98 4.23 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.08 -0.248 . . . . 10.0 111.436 -178.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 7.4 tttm -150.58 162.9 39.75 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.376 -0.601 . . . . 10.0 109.376 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -103.09 118.15 36.16 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.886 -0.412 . . . . 10.0 109.886 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 9.1 m -139.36 166.99 20.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-O 121.056 0.455 . . . . 10.0 111.303 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 10.9 t -96.93 129.23 47.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 109.122 -0.696 . . . . 10.0 109.122 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 9.6 mt -113.29 94.38 3.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.752 0.311 . . . . 10.0 111.095 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 61.56 41.17 12.74 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.521 -0.763 . . . . 10.0 111.744 178.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.56 -33.19 6.04 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.532 -0.758 . . . . 10.0 112.284 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -91.87 111.67 23.29 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.778 0.323 . . . . 10.0 110.928 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 3.8 m -76.74 132.3 39.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.782 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 73.5 m -148.75 175.64 11.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.749 0.309 . . . . 10.0 111.368 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 22.3 tp -106.56 126.27 52.05 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.596 -0.52 . . . . 10.0 109.596 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 66.7 mt -105.76 126.82 52.61 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.5 0.556 . . . . 10.0 112.5 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -106.56 117.04 33.0 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.129 -1.063 . . . . 10.0 108.129 178.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 4.0 mp -113.5 143.53 23.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 120.598 0.237 . . . . 10.0 111.125 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 12.4 tp -128.1 122.71 32.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.895 0.378 . . . . 10.0 111.823 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -88.51 105.95 17.96 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 107.429 -1.323 . . . . 10.0 107.429 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 27.1 p -80.9 164.65 22.47 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.539 0.94 . . . . 10.0 113.539 -177.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -73.22 140.0 46.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.218 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.68 -9.78 60.95 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.607 -0.806 . . . . 10.0 112.413 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -141.13 79.21 1.68 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.198 0.523 . . . . 20.0 110.241 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -134.62 152.83 52.06 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.057 -179.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -103.42 -154.45 0.5 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.319 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -82.79 103.0 11.95 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.3 -0.56 . . . . 10.0 111.099 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -123.14 143.07 50.24 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.708 -0.678 . . . . 10.0 109.84 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.37 -30.98 71.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.949 0.404 . . . . 10.0 110.396 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 1.1 mmt -61.42 -45.95 92.15 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.561 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -64.21 -43.58 94.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.545 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.4 -19.2 63.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.761 -0.654 . . . . 10.0 111.357 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -97.03 -45.75 6.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.298 179.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . 0.282 0.6 OUTLIER -69.05 -25.44 64.47 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 113.124 0.787 . . . . 10.0 113.124 -179.077 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 34.0 mtp -93.72 2.25 56.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.237 0.541 . . . . 10.0 110.134 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -95.54 -25.86 16.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.731 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.44 -4.17 58.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.7 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -83.81 156.53 33.08 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.752 -0.737 . . . . 10.0 112.687 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -113.88 -46.49 3.02 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.188 0.518 . . . . 10.0 109.693 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -111.63 137.26 14.16 Favored Glycine 0 N--CA 1.444 -0.797 0 N-CA-C 110.161 -1.176 . . . . 10.0 110.161 179.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -122.02 124.11 43.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.26 0.552 . . . . 10.0 112.406 -178.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 70.2 mt -97.18 110.27 22.85 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.472 -0.785 . . . . 10.0 109.685 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 26.3 m -85.94 92.81 8.78 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 47.1 t -91.36 121.96 42.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.847 -0.615 . . . . 10.0 112.203 -178.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 29.7 p90 -128.33 158.95 36.8 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.419 -0.81 . . . . 10.0 109.066 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -100.13 126.05 46.33 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 110.088 -0.338 . . . . 10.0 110.088 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 32.0 pt -69.49 -9.98 12.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.394 0.616 . . . . 10.0 110.288 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -87.68 -11.83 47.18 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.095 -0.957 . . . . 10.0 110.353 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -133.08 106.86 7.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.028 -178.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.26 -31.67 70.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.698 -0.683 . . . . 10.0 112.357 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -61.42 -35.58 77.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.696 0.284 . . . . 10.0 110.493 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 15.6 m -66.5 -32.69 74.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.475 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -68.64 -39.08 80.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.55 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -76.67 -25.76 54.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.259 0.552 . . . . 10.0 110.621 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -68.63 -17.64 64.15 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.841 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.92 -39.53 72.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.742 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 67.0 t60 -67.5 -37.5 82.93 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.61 -0.515 . . . . 10.0 109.61 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -63.45 -36.09 82.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.577 -0.738 . . . . 10.0 110.022 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -80.01 -40.41 27.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.435 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 ttm180 -56.65 -45.25 81.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.558 -0.292 . . . . 10.0 111.177 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 63.1 mm-40 -64.35 -38.76 92.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.906 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -62.71 -42.49 99.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.0 -0.545 . . . . 10.0 109.718 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 57.9 mt -66.26 -47.47 84.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.757 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 49.6 mtpt -57.15 -41.38 79.02 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.86 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 55.4 ttp85 -68.45 -46.55 69.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.909 -0.587 . . . . 10.0 112.313 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 35.1 m -68.27 -30.78 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.177 0 N-CA-C 112.551 0.575 . . . . 10.0 112.551 -179.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -87.15 -9.34 55.51 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 121.152 -0.219 . . . . 10.0 111.14 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 5.9 t70 63.06 29.91 16.27 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 123.803 0.69 . . . . 10.0 111.25 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 53.1 m -163.48 145.08 9.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.486 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.29 -11.34 41.1 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.541 0.686 . . . . 10.0 109.271 178.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -91.24 72.63 6.22 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.794 -1.094 . . . . 10.0 109.532 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 58.6 t -123.09 133.43 24.51 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.361 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -63.0 107.89 0.69 Allowed 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.819 2.346 . . . . 10.0 111.555 179.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 54.4 mtt -127.0 153.15 46.29 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.118 -0.492 . . . . 10.0 109.91 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 92.6 t -134.11 132.57 55.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 109.307 -0.627 . . . . 10.0 109.307 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 20.1 tp -85.89 117.94 25.06 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 23.2 t -114.52 117.88 56.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.972 0.415 . . . . 10.0 111.496 -178.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -101.14 110.51 3.9 Favored Glycine 0 N--CA 1.45 -0.407 0 N-CA-C 110.517 -1.033 . . . . 10.0 110.517 178.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -97.75 166.38 11.51 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.031 0.382 . . . . 10.0 112.031 -178.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 36.8 mttm 72.55 35.05 1.17 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 123.702 0.801 . . . . 10.0 112.187 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 31.7 p -71.47 -13.36 61.79 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.064 0.394 . . . . 10.0 112.064 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -88.99 2.53 53.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.967 0.413 . . . . 10.0 111.172 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 38.0 mt -98.07 137.51 20.86 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.044 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -74.73 -14.14 21.9 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.768 2.312 . . . . 10.0 111.899 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.25 37.25 0.32 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.295 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -71.21 110.43 5.86 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.378 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.58 -18.22 14.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.063 179.136 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 40.4 t -105.68 113.9 43.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 115.658 -0.701 . . . . 10.0 109.543 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -76.39 152.43 36.28 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.662 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.5 -44.05 93.19 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.768 -0.651 . . . . 10.0 112.401 -179.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 8.4 tmtm? -61.25 -40.1 92.8 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.946 0.403 . . . . 10.0 110.908 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -63.45 -44.48 94.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.683 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.63 -44.93 80.68 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.236 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -62.35 -36.16 81.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.748 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.47 -47.87 80.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.778 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 18.9 tp -63.96 -41.84 97.45 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.501 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.69 -47.1 86.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.436 179.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -62.95 -34.96 78.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.977 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 14.7 m -66.55 -25.75 66.81 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.213 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 16.2 m-30 -99.69 -4.73 30.16 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.473 -0.331 . . . . 10.0 111.481 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 71.53 33.24 64.01 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 111.624 -0.59 . . . . 10.0 111.624 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 48.8 pt -123.54 147.71 53.69 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-O 120.574 0.226 . . . . 10.0 110.813 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -73.07 151.92 50.45 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.625 2.216 . . . . 10.0 111.714 179.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -114.2 127.16 55.77 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.766 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 34.4 mm -125.14 122.05 62.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.082 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -90.89 124.37 35.13 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.595 -0.891 . . . . 10.0 108.595 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 44.6 p -130.34 172.66 11.6 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 122.105 0.955 . . . . 10.0 113.373 -177.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 6.0 t -160.99 117.08 2.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.045 -1.434 . . . . 10.0 107.341 178.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.57 -17.87 62.91 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.769 0.319 . . . . 10.0 111.244 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 70.5 tttt -84.0 -44.61 13.98 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.209 0.448 . . . . 10.0 112.209 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 36.6 p -93.8 -13.69 27.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.735 0.302 . . . . 10.0 111.317 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 18.6 ttt-85 67.49 44.98 1.64 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.078 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -85.33 103.24 14.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.486 -0.779 . . . . 10.0 111.592 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 58.9 37.23 90.62 Favored Glycine 0 CA--C 1.519 0.285 0 CA-C-N 115.889 -0.596 . . . . 10.0 114.306 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 70.4 t -66.25 -54.52 25.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.911 0.386 . . . . 10.0 110.711 -179.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.45 -32.38 71.28 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -58.17 -42.62 86.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.85 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.89 -48.19 82.29 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.966 0.412 . . . . 10.0 110.64 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -65.17 -43.15 92.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.808 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 16.0 m-30 -60.71 -41.89 96.15 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.419 179.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 32.8 m -58.93 -38.16 78.34 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.501 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 24.2 tp -62.4 -46.11 90.08 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.047 179.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 43.2 t -64.04 -39.35 85.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.987 -0.552 . . . . 10.0 109.571 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -63.53 -29.96 71.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.705 -0.679 . . . . 10.0 110.683 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -77.97 -43.72 28.84 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.208 178.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 93.2 mt -60.17 -45.32 96.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.475 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -59.48 -48.12 82.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.356 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -66.39 -36.13 82.07 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.966 0.412 . . . . 10.0 110.821 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -63.04 -44.19 96.58 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.524 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -71.77 -39.41 69.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.604 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -57.55 -40.75 79.58 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.259 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -59.93 -36.04 76.21 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.936 -0.574 . . . . 10.0 112.165 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 25.3 mmt -90.44 -22.96 21.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.87 0.367 . . . . 10.0 111.556 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 31.4 t . . . . . 0 C--N 1.326 -0.436 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.968 -179.586 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.285 0 N-CA-C 111.503 -0.639 . . . . 10.0 111.503 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.01 136.73 52.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.737 0.303 . . . . 10.0 111.404 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 20.9 t -122.57 142.07 40.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.977 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -93.92 125.78 38.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.033 0.444 . . . . 10.0 111.641 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 59.4 t -99.47 118.22 45.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.082 -0.71 . . . . 10.0 109.082 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -91.84 113.79 26.16 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.173 0.511 . . . . 10.0 111.185 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 23.6 mt -81.04 150.39 68.46 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.329 -0.851 . . . . 10.0 110.94 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.24 -7.41 15.6 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.178 2.585 . . . . 10.0 113.295 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -90.28 17.22 7.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.986 0.422 . . . . 10.0 110.618 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 53.8 tttt 66.23 45.03 2.38 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 115.429 -0.805 . . . . 10.0 111.72 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -146.33 175.48 10.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.608 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.33 167.76 23.51 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.894 0.702 . . . . 10.0 112.894 -178.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 2.6 t -147.63 145.26 28.9 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.101 -0.954 . . . . 10.0 108.833 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 21.9 t -101.1 115.25 42.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.963 0.411 . . . . 10.0 111.328 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 24.1 t -110.66 141.54 25.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.449 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 1.2 m -80.84 128.13 33.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 42.5 t -66.28 127.86 28.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.735 0.302 . . . . 10.0 110.477 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -118.91 127.4 53.45 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.983 0.42 . . . . 10.0 110.881 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -77.05 74.6 3.63 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.675 -0.693 . . . . 10.0 112.349 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 165.41 -40.18 0.28 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.506 -0.854 . . . . 10.0 112.769 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 10.5 ptm -75.22 154.85 37.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.041 0.448 . . . . 10.0 111.738 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.81 169.4 9.49 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.164 -179.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 87.6 t -57.95 -42.92 83.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.515 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -56.03 -34.72 66.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.828 -0.624 . . . . 10.0 111.321 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -77.27 -49.39 15.16 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.306 -0.406 . . . . 10.0 111.133 -179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 3.4 m -63.39 -40.79 98.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.396 -0.366 . . . . 10.0 111.626 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -71.58 -24.11 61.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.536 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -63.8 -32.55 74.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.037 0.446 . . . . 10.0 110.274 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 14.0 tttm -72.47 -6.42 43.62 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.552 -0.749 . . . . 10.0 111.282 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -117.73 -46.77 2.64 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.967 0.413 . . . . 10.0 111.49 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 74.8 mt -65.73 -43.92 87.56 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.819 0.674 . . . . 10.0 112.819 -179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -67.75 -21.24 65.28 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.131 0.419 . . . . 10.0 112.131 -179.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 50.5 t -75.54 -23.67 16.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.042 0.449 . . . . 10.0 110.583 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 5.6 mtt-85 -106.55 -6.9 17.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.628 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 85.1 40.22 8.11 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.786 -0.721 . . . . 10.0 112.633 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 76.1 mt -114.68 129.04 56.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.791 0.329 . . . . 10.0 110.65 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -90.53 134.61 34.25 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.052 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 14.7 mp0 -57.61 -34.25 69.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.965 -0.562 . . . . 10.0 112.096 -179.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -72.01 -5.6 36.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.137 0.494 . . . . 10.0 111.565 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 3.6 m -126.04 25.43 6.75 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.081 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 64.3 m -145.31 165.22 29.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.01 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 11.4 p -143.66 145.86 21.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.886 -0.412 . . . . 10.0 109.886 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 60.2 t -114.43 135.75 53.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.9 0.381 . . . . 10.0 110.944 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -118.69 141.35 48.69 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.194 179.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 34.3 mtm180 -94.08 121.9 36.04 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.136 -0.69 . . . . 10.0 109.136 178.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -84.19 113.67 21.25 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.113 -179.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 15.9 mt -111.07 72.96 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.685 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 96.1 mttt 66.43 9.09 6.22 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.998 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 147.28 -42.44 0.9 Allowed Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 121.109 -0.567 . . . . 10.0 111.848 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 7.3 mmt180 -69.74 139.94 53.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.737 0.303 . . . . 10.0 111.27 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -108.86 120.75 43.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.366 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 6.9 m -115.31 132.0 56.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.864 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 11.5 t -65.73 137.78 24.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.646 -0.252 . . . . 10.0 111.052 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -124.5 149.3 47.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.528 -0.306 . . . . 10.0 110.268 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -92.74 163.99 13.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.83 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -80.35 -34.44 36.52 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.237 -179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -72.36 -10.66 60.07 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.677 0.621 . . . . 10.0 112.677 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 2.7 m -68.01 148.61 50.79 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 110.032 -0.358 . . . . 10.0 110.032 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -80.22 152.46 29.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.506 0.193 . . . . 10.0 110.7 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 6.0 tp -89.76 -4.92 10.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.241 0.543 . . . . 10.0 110.871 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -56.99 -50.99 85.03 Favored Pre-proline 0 CA--C 1.539 0.543 0 N-CA-C 113.342 0.867 . . . . 10.0 113.342 -179.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -76.61 6.02 4.37 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 121.912 1.741 . . . . 10.0 113.171 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -90.75 47.03 1.37 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.218 0.532 . . . . 10.0 111.151 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -93.33 108.35 20.02 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.464 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 90.83 -0.23 76.17 Favored Glycine 0 CA--C 1.517 0.193 0 C-N-CA 121.069 -0.586 . . . . 10.0 113.617 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -98.73 134.88 41.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.861 0.331 . . . . 10.0 111.286 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -83.85 139.92 32.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 10.0 109.937 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 96.1 mt -114.13 118.2 33.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.109 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 1.3 pt -111.69 120.36 61.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.385 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 6.1 t -97.64 142.8 13.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.333 -178.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -125.26 160.04 30.22 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.547 178.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 80.8 t -93.79 132.46 37.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 116.258 -0.428 . . . . 10.0 109.999 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 44.6 mt . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.377 -0.82 . . . . 10.0 109.589 179.158 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 20.8 mt . . . . . 0 C--O 1.217 -0.626 0 CA-C-O 120.265 0.079 . . . . 10.0 110.845 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -70.69 -39.9 73.23 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.962 -0.384 . . . . 10.0 109.962 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -59.6 -40.8 88.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.623 179.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -81.67 -30.83 32.54 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.327 -0.851 . . . . 10.0 110.236 179.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 49.7 ttm -64.6 -44.87 89.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.489 -0.323 . . . . 10.0 110.868 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 13.1 p -62.87 -45.27 93.33 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.863 -0.792 . . . . 10.0 108.863 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 15.1 mttm -60.43 -55.19 36.52 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.487 -0.779 . . . . 10.0 109.881 178.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -56.43 -45.96 80.51 Favored 'General case' 0 C--O 1.225 -0.222 0 O-C-N 123.652 0.595 . . . . 10.0 110.753 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 24.2 mt -60.35 -45.34 93.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.766 -0.197 . . . . 10.0 111.029 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 71.1 mt-10 -66.16 -41.8 89.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.63 0.252 . . . . 10.0 110.433 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 -64.39 -43.76 93.44 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.67 -0.493 . . . . 10.0 109.67 178.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 35.5 t -65.31 -44.16 94.9 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.641 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.256 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -62.49 -48.21 80.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.041 0.448 . . . . 10.0 111.062 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.58 -41.87 98.33 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.178 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -77.18 -28.26 53.95 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 111.676 0.25 . . . . 10.0 111.676 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -71.43 -20.14 20.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 C-N-CA 121.186 -0.206 . . . . 10.0 110.73 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -59.36 -61.07 8.59 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.505 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -65.23 -28.62 55.72 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.515 1.477 . . . . 10.0 111.059 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 7.9 m-30 -64.04 -58.25 7.25 Favored 'General case' 0 C--O 1.231 0.091 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 80.8 mt -65.45 -37.51 87.11 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.731 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -62.47 -44.89 95.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.917 0.389 . . . . 10.0 110.192 179.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -64.3 -52.21 59.63 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.077 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -62.02 -29.05 70.02 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.81 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -66.44 -49.13 67.74 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 23.9 mtmt -63.05 -44.94 94.48 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.824 -0.626 . . . . 10.0 109.336 178.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -58.26 -50.16 74.57 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.604 -0.726 . . . . 10.0 109.724 178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -39.35 90.44 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.618 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -60.8 -47.62 85.49 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -63.88 -42.07 97.58 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -58.99 -49.2 78.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.393 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 99.7 mmm -67.23 -40.08 86.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.464 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -60.7 -49.68 76.55 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 110.003 -0.369 . . . . 10.0 110.003 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 66.1 mt -64.84 -35.49 81.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.844 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.73 -42.52 95.17 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.206 178.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 15.1 mtt85 -74.25 -38.66 63.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.84 0.352 . . . . 10.0 110.788 179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -65.83 -26.23 67.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.367 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -95.2 -37.51 11.01 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.862 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 2.2 p -62.22 -24.86 36.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 C-N-CA 121.31 -0.156 . . . . 10.0 111.355 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -62.93 -62.47 5.6 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 178.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -63.86 -31.54 67.54 Favored 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 121.694 1.596 . . . . 10.0 111.068 177.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 40.8 mt -65.09 -37.05 86.25 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 18.9 mtt180 -67.81 -34.88 77.61 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 178.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -67.74 -40.39 84.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.346 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -61.43 -47.93 83.47 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 108.89 -0.781 . . . . 10.0 108.89 178.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 48.6 mt -65.1 -38.71 91.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.335 -0.848 . . . . 10.0 110.537 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -66.57 -59.44 3.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.327 -0.397 . . . . 10.0 111.099 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -61.49 -37.85 85.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.048 0.451 . . . . 10.0 110.223 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -64.59 -49.0 66.98 Favored Glycine 0 N--CA 1.441 -0.996 0 N-CA-C 110.755 -0.938 . . . . 10.0 110.755 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.33 -35.11 79.81 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 110.249 -0.278 . . . . 10.0 110.249 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -57.37 -45.7 84.14 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.794 -0.447 . . . . 10.0 109.794 178.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -71.04 -49.04 49.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.09 178.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -55.4 -43.2 75.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.724 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 64.0 mt -74.0 -39.28 63.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.891 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -60.99 -47.87 84.45 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 120.936 0.398 . . . . 10.0 109.936 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.87 -39.32 94.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.623 -0.717 . . . . 10.0 109.959 179.07 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 26.7 mt -67.37 -42.77 82.89 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.751 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -64.54 -43.73 93.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.763 0.316 . . . . 10.0 110.48 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.7 -3.94 21.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.257 0.551 . . . . 10.0 110.702 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -108.08 -34.67 6.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.484 -0.78 . . . . 10.0 109.125 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 57.7 mt -64.3 -31.34 72.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.22 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 2.6 m -68.27 -62.41 3.14 Favored Pre-proline 0 CA--C 1.54 0.564 0 CA-C-N 116.602 -0.272 . . . . 10.0 111.431 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -65.04 -50.98 1.79 Allowed 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 121.853 1.702 . . . . 10.0 112.229 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 92.0 mt -65.85 -25.55 67.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.767 0.318 . . . . 10.0 110.87 -179.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -76.74 -48.55 8.69 Favored Glycine 0 N--CA 1.443 -0.848 0 N-CA-C 110.49 -1.044 . . . . 10.0 110.49 178.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -64.06 -42.3 97.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.394 0.14 . . . . 10.0 110.776 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -64.09 -35.59 81.26 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.977 0.418 . . . . 10.0 110.158 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 27.0 ttt -68.11 -39.41 82.81 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 66.4 mtt180 -67.32 -36.74 82.08 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 178.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -65.05 -44.44 89.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.841 -0.618 . . . . 10.0 109.391 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -66.28 -37.92 86.58 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 177.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -62.85 -35.02 78.59 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 115.488 -0.778 . . . . 10.0 109.649 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 77.9 mtt180 -59.85 -45.64 91.79 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.771 -0.826 . . . . 10.0 108.771 178.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -69.59 -42.45 74.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.853 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -54.39 -53.23 56.78 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.826 -0.624 . . . . 10.0 109.723 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 95.6 t -70.37 -41.7 78.48 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.36 0 CA-C-N 115.389 -0.823 . . . . 10.0 111.538 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -58.61 -53.89 53.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.625 0.25 . . . . 10.0 111.17 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -60.32 -33.83 72.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.265 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 8.9 mt -72.89 -40.71 65.34 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.928 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.7 ttm105 -62.7 -51.55 66.75 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.548 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 3.6 m -67.15 -13.4 61.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.237 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -96.15 -43.63 7.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.85 0.357 . . . . 10.0 110.127 178.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 57.6 mt -64.63 -33.56 76.21 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.21 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -54.52 -60.96 6.39 Favored Pre-proline 0 CA--C 1.534 0.328 0 O-C-N 123.149 0.281 . . . . 10.0 111.352 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -68.62 -34.84 18.4 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 121.599 1.532 . . . . 10.0 110.69 178.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -57.31 -50.05 74.17 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.227 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 8.4 p -64.69 -36.71 85.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.529 -0.305 . . . . 10.0 110.801 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.89 -39.96 79.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.139 0.495 . . . . 10.0 109.977 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -67.27 -34.4 77.35 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.032 -0.729 . . . . 10.0 109.032 177.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 63.8 mt -68.09 -33.02 73.75 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 108.708 -0.849 . . . . 10.0 108.708 177.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 84.7 mtt180 -67.4 -39.31 85.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.167 -1.049 . . . . 10.0 108.167 177.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -61.04 -42.15 97.93 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.895 -1.15 . . . . 10.0 107.895 177.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 -63.07 -53.95 45.66 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.391 -0.822 . . . . 10.0 109.08 178.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 98.3 mt -53.3 -42.74 66.94 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.851 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -60.69 -45.32 94.64 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.239 -0.437 . . . . 10.0 109.949 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -68.99 -46.58 67.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.37 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 4.3 mmt85 -60.92 -52.73 63.8 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.505 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 83.9 mt -63.15 -34.92 78.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.993 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.82 -44.32 90.23 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.221 -0.659 . . . . 10.0 109.221 178.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.12 -39.78 94.77 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.401 -0.963 . . . . 10.0 108.401 178.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 70.2 mt -66.68 -22.55 66.08 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.971 178.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -75.38 -48.13 24.37 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.017 -0.734 . . . . 10.0 109.017 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -68.93 -47.75 64.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.637 -0.71 . . . . 10.0 109.829 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -65.85 -49.76 67.0 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.627 179.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.85 -37.76 94.86 Favored Glycine 0 C--N 1.33 0.227 0 CA-C-N 115.929 -0.578 . . . . 10.0 112.445 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.38 -46.21 94.75 Favored Glycine 0 N--CA 1.449 -0.457 0 N-CA-C 110.829 -0.908 . . . . 10.0 110.829 178.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -70.3 -37.33 74.76 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 19.0 mtt180 -57.46 -58.72 7.05 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.269 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 92.7 mt -58.3 -39.82 80.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.565 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -64.9 -49.21 71.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.768 0.318 . . . . 10.0 110.323 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -64.94 -43.73 91.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.182 -0.463 . . . . 10.0 111.209 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 22.7 m-30 -63.53 -39.69 95.09 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.922 -0.399 . . . . 10.0 109.922 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -64.92 -44.17 90.42 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.705 178.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -59.25 -44.73 92.38 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.256 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 16.4 mtmm -68.33 -27.14 66.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.525 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.23 -43.48 73.95 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 178.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.47 -45.19 94.62 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -63.36 -38.46 91.25 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.888 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -66.91 -35.61 80.39 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.142 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 78.4 mt -71.21 -39.87 71.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.192 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 68.7 m -62.78 -44.55 95.89 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 178.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 4.4 p -76.16 -16.57 59.84 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.417 179.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.18 -35.41 59.15 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 107.488 -1.301 . . . . 10.0 107.488 177.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 29.1 m -67.71 -25.32 65.6 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -72.36 -2.4 19.12 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.21 -0.904 . . . . 10.0 109.923 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 31.2 mttp -123.16 -42.31 2.27 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -63.28 -22.25 66.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.535 -0.757 . . . . 10.0 111.429 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -102.12 -67.91 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.454 0 C-N-CA 120.819 -0.352 . . . . 10.0 111.544 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -65.52 -55.36 0.45 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 122.268 1.979 . . . . 10.0 113.316 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -60.89 -38.85 87.11 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.285 0.476 . . . . 10.0 112.285 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 3.0 mt -67.03 -42.25 85.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.776 0.322 . . . . 10.0 110.478 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . 0.654 ' O ' ' CG ' ' A' ' 373' ' ' GLN . 2.7 mt-10 -69.19 -29.85 67.92 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.746 -0.464 . . . . 10.0 109.746 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -69.98 -44.42 69.47 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 178.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.72 -46.85 88.8 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.385 -0.825 . . . . 10.0 109.634 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 52.5 mtt85 -65.62 -36.69 84.44 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.654 ' CG ' ' O ' ' A' ' 369' ' ' GLU . 98.7 mt-30 -63.08 -30.52 71.66 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.546 -0.752 . . . . 20.0 111.297 179.237 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -86.44 -36.09 9.99 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 109.149 -1.58 . . . . 10.0 109.149 178.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 17.6 mt -58.09 -40.31 80.82 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.011 0.374 . . . . 10.0 112.011 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 83.4 mt -55.4 -62.92 3.63 Favored Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 112.069 0.396 . . . . 10.0 112.069 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -63.19 -32.49 73.98 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 121.969 1.78 . . . . 10.0 111.564 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 6.5 t -63.45 -44.79 99.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 N-CA-C 109.916 -0.401 . . . . 10.0 109.916 178.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 33.7 mt -60.92 -35.63 77.19 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.438 -0.578 . . . . 10.0 109.438 178.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -62.86 -52.03 64.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.874 178.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.2 -38.11 85.38 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.611 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -67.97 -43.12 79.73 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.707 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -62.0 -48.42 80.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.486 -0.325 . . . . 10.0 110.538 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 75.8 t -57.51 -42.77 81.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.467 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 5.3 p -74.82 -55.03 6.24 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.174 0.435 . . . . 10.0 112.174 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -60.53 -44.53 95.97 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.311 0.856 . . . . 10.0 113.311 -178.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 56.8 mt -61.29 -41.98 97.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.689 0.281 . . . . 10.0 111.335 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 93.5 p -79.12 -26.12 42.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.329 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -65.92 -39.99 91.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 95.4 mt -61.85 -35.14 77.4 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.945 -0.571 . . . . 10.0 109.953 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -68.1 -42.4 80.37 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.55 -0.907 . . . . 10.0 108.55 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.7 -40.37 94.78 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.545 -0.752 . . . . 10.0 111.085 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -63.63 -51.82 63.54 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.493 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 4.8 m -58.63 -30.58 67.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.725 -0.671 . . . . 10.0 111.452 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 93.1 mttt . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.601 -0.272 . . . . 10.0 111.684 179.692 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 55.9 mt . . . . . 0 CA--C 1.529 0.16 0 CA-C-O 121.185 0.517 . . . . 10.0 111.515 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.12 -37.99 84.83 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.011 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.87 -38.83 61.82 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.387 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -57.56 -41.63 81.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.318 -0.856 . . . . 10.0 109.013 178.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -64.67 -33.99 77.23 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 115.415 -0.811 . . . . 10.0 111.847 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.68 -50.06 75.3 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.893 0.378 . . . . 10.0 110.21 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 1.2 m -63.79 -34.79 78.7 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.579 -0.526 . . . . 10.0 109.579 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 50.6 t -64.82 -41.38 92.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.003 178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 2.8 m -61.05 -46.55 90.23 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 42.3 m -60.55 -38.33 84.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.86 178.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 91.5 m -63.15 -44.99 93.99 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.093 -0.503 . . . . 10.0 109.889 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -64.72 -41.41 96.0 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.389 178.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 15.0 m -62.84 -44.34 96.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.019 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -66.88 -26.72 67.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.231 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 30.5 mt -70.86 -38.05 73.12 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 178.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 86.9 mtt180 -66.96 -40.11 87.41 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 108.751 -0.833 . . . . 10.0 108.751 178.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -65.16 -23.52 67.14 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 115.421 -0.809 . . . . 10.0 110.379 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -82.57 -48.25 11.2 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.57 -0.9 . . . . 10.0 108.57 177.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 84.6 mt -52.88 -35.05 57.33 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.203 -0.908 . . . . 10.0 112.151 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.94 -77.67 0.13 Allowed Glycine 0 CA--C 1.52 0.352 0 N-CA-C 111.84 -0.504 . . . . 10.0 111.84 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -56.94 -32.6 93.16 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.807 2.338 . . . . 10.0 111.742 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 5.6 t -60.0 -50.21 81.02 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.226 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.925 179.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 21.4 p -70.78 -36.43 73.04 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.499 0.19 . . . . 10.0 110.901 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -57.82 -48.78 78.74 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.566 -0.531 . . . . 10.0 109.566 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -76.33 -29.73 57.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.669 -0.696 . . . . 10.0 110.543 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -66.3 -46.99 75.05 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.824 0.345 . . . . 10.0 110.14 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 47.3 m0 -64.86 -37.5 87.82 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.39 -34.19 75.6 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.574 178.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -68.95 -39.35 79.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.761 -1.2 . . . . 10.0 107.761 177.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 69.1 mt -66.33 -25.9 67.05 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.251 -0.886 . . . . 10.0 110.287 178.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -63.0 -53.33 55.61 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.874 -0.787 . . . . 10.0 108.874 178.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -66.87 -31.52 72.17 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.0 -53.81 44.16 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.56 -0.745 . . . . 10.0 110.614 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 9.5 p -69.87 -40.27 75.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.855 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -67.0 -44.54 80.1 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.639 0.257 . . . . 10.0 110.726 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -61.8 -48.6 82.93 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 110.117 -1.193 . . . . 10.0 110.117 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 16.9 mt -61.16 -34.51 75.15 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 110.017 -0.364 . . . . 10.0 110.017 178.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 20.9 mtt85 -65.97 -43.28 88.31 Favored 'General case' 0 C--O 1.22 -0.454 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 178.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -62.92 -33.82 76.13 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-O 121.328 0.585 . . . . 10.0 109.678 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -74.43 -59.6 2.65 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.09 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 75.1 mtm -62.36 -27.9 69.39 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 114.538 1.31 . . . . 10.0 114.538 -177.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 25.4 p -57.52 -59.07 5.72 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.259 0.552 . . . . 10.0 110.144 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 21.6 pttt -74.04 -31.27 62.82 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.334 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.38 -43.28 99.13 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.286 -0.415 . . . . 10.0 110.577 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 81.2 mt -76.46 -42.23 44.5 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.418 -0.355 . . . . 10.0 111.311 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -62.62 -40.6 97.47 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.095 0.474 . . . . 10.0 110.055 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.11 -30.43 62.32 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.961 -0.755 . . . . 10.0 108.961 178.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 1.2 t -57.83 -43.89 85.16 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 CA-C-N 116.068 -0.514 . . . . 10.0 109.819 178.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -67.35 -40.51 85.85 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -69.69 -10.19 57.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.099 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.62 -39.72 6.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.15 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 50.4 t -70.13 -36.4 67.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.797 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -55.08 -61.5 5.8 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 116.778 -0.192 . . . . 10.0 111.429 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.51 -26.37 40.42 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 121.823 1.682 . . . . 10.0 111.502 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.33 -47.93 62.93 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.796 -0.446 . . . . 10.0 109.796 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 17.5 mt -67.42 -32.22 72.96 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.29 -0.633 . . . . 10.0 109.29 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -67.11 -47.88 69.82 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.114 -0.699 . . . . 10.0 109.114 178.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -66.81 -41.11 88.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.962 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -64.9 -40.09 94.54 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.931 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -62.94 -43.51 98.6 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 27.5 mtmt -63.13 -46.39 87.47 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 15.5 mtmm -64.65 -36.97 85.98 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.221 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 36.1 t90 -66.33 -37.23 84.87 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.899 -0.778 . . . . 10.0 108.899 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -64.68 -45.17 87.8 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.536 -0.912 . . . . 10.0 108.536 177.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -61.2 -42.76 99.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.653 178.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . 0.522 ' OE1' ' CD1' ' C' ' 469' ' ' LEU . 0.4 OUTLIER -67.19 -39.51 86.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.968 -0.56 . . . . 10.0 109.877 178.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.11 -43.46 98.36 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 108.989 -0.745 . . . . 10.0 108.989 178.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -63.71 -45.11 91.47 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.133 -1.062 . . . . 10.0 108.133 177.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . 0.522 ' CD1' ' OE1' ' C' ' 466' ' ' GLU . 96.5 mt -56.09 -45.11 79.53 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 115.35 -0.841 . . . . 20.0 109.782 177.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 15.4 m-30 -64.89 -41.82 95.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.521 179.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 59.6 mtt180 -66.57 -44.67 81.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.977 0.418 . . . . 10.0 111.174 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -78.0 -2.94 39.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.043 -0.526 . . . . 10.0 112.188 -179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 62.5 mttt -116.08 -63.2 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.518 0.199 . . . . 10.0 111.29 178.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 66.1 t -57.54 -43.23 82.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.292 0.849 . . . . 10.0 113.292 -178.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.26 -59.74 12.84 Favored Pre-proline 0 CA--C 1.533 0.308 0 N-CA-C 112.34 0.496 . . . . 10.0 112.34 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -65.38 -29.99 53.69 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 121.835 1.69 . . . . 10.0 111.264 178.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 12.5 mt -67.44 -40.75 85.46 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -63.48 -34.78 78.53 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 109.222 -0.658 . . . . 10.0 109.222 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -68.49 -47.29 67.42 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.22 -45.17 94.53 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.857 -0.611 . . . . 10.0 109.589 178.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 62.9 mt -67.39 -33.08 74.46 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.633 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -66.25 -47.12 74.79 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -66.67 -41.91 87.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.615 178.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.22 -39.24 97.67 Favored Glycine 0 N--CA 1.447 -0.586 0 N-CA-C 110.842 -0.903 . . . . 10.0 110.842 178.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.04 -36.74 78.04 Favored 'General case' 0 C--O 1.219 -0.507 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 178.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 64.3 mtt180 -64.52 -39.67 94.21 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.34 -0.615 . . . . 10.0 109.34 178.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -67.67 -43.85 79.25 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 177.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -65.64 -31.87 73.13 Favored 'General case' 0 C--O 1.226 -0.149 0 CA-C-N 115.725 -0.67 . . . . 10.0 109.599 178.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 21.1 mt -66.66 -41.32 88.39 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 108.626 -0.879 . . . . 10.0 108.626 177.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -64.12 -39.48 94.12 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 108.298 -1.001 . . . . 10.0 108.298 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -60.9 -53.6 55.32 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.248 -1.019 . . . . 10.0 108.248 177.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 82.3 mt -57.81 -38.4 75.47 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 115.358 -0.837 . . . . 10.0 111.466 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -61.07 -37.53 83.01 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.886 0.374 . . . . 10.0 110.298 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -81.56 -17.06 49.68 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.603 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 10.5 mtmm -103.64 6.37 37.06 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.685 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 32.6 mt -124.93 -44.08 1.95 Allowed 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 112.093 0.405 . . . . 10.0 112.093 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 10.3 m -66.93 -62.32 3.92 Favored Pre-proline 0 CA--C 1.539 0.534 0 N-CA-C 112.215 0.45 . . . . 10.0 112.215 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -67.18 -21.36 48.57 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 122.158 1.905 . . . . 10.0 111.89 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 12.6 mt -87.1 -41.75 13.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.939 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.49 -45.09 94.15 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 111.446 -0.662 . . . . 10.0 111.446 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -64.48 -32.56 74.24 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 121.239 0.543 . . . . 10.0 109.846 178.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -73.02 -40.24 65.34 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.443 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 87.2 mmm -60.46 -34.69 74.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 10.0 109.652 178.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -70.76 -34.3 71.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.1 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -71.38 -36.81 71.55 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.025 -1.102 . . . . 10.0 108.025 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -62.53 -38.38 89.75 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 107.836 -1.172 . . . . 10.0 107.836 177.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -64.05 -35.48 80.88 Favored 'General case' 0 C--O 1.226 -0.138 0 CA-C-N 115.65 -0.704 . . . . 10.0 109.994 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 -64.16 -32.8 74.51 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.715 -0.846 . . . . 10.0 108.715 178.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -96.57 13.12 29.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.118 -0.946 . . . . 10.0 110.909 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -128.74 -67.56 0.79 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.29 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 47.7 t -69.01 -49.76 59.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.626 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -66.75 -34.18 77.26 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.919 0.39 . . . . 10.0 110.36 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -68.31 -39.31 82.04 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.116 -1.068 . . . . 10.0 108.116 177.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 11.3 mt -67.48 -24.69 65.62 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.452 -0.794 . . . . 10.0 110.366 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -58.75 -51.59 69.3 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.05 -0.722 . . . . 10.0 109.05 178.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.3 9.87 4.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.417 0.627 . . . . 10.0 110.901 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 49.7 m170 -113.89 -39.16 4.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.146 -0.479 . . . . 10.0 109.874 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 95.0 mt -89.39 -30.75 18.13 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.582 -0.736 . . . . 10.0 111.714 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -58.11 -54.63 53.68 Favored Pre-proline 0 CA--C 1.531 0.222 0 C-N-CA 121.235 -0.186 . . . . 10.0 110.739 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -67.47 -32.03 32.75 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 121.31 1.34 . . . . 10.0 110.048 177.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -62.8 -46.08 89.63 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.933 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 3.8 p -68.33 -33.52 74.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.015 0.436 . . . . 10.0 110.084 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -66.18 -45.5 80.63 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 178.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -65.84 -36.4 83.35 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 178.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 19.0 mt -60.81 -39.39 88.79 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.405 178.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 54.7 mtt85 -63.54 -38.46 91.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.179 178.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -62.78 -46.7 86.81 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.449 -0.945 . . . . 10.0 108.449 178.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 48.2 mtt180 -63.16 -41.89 99.34 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 114.896 -1.047 . . . . 10.0 109.77 178.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 76.7 mt -65.24 -41.69 94.09 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.456 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -59.26 -49.63 77.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.227 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -61.7 -47.92 83.13 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.723 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -64.6 -42.19 95.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.484 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 26.3 mt -64.36 -43.11 95.58 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 120.64 0.257 . . . . 10.0 110.34 179.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -63.42 -40.32 96.87 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.949 -0.389 . . . . 10.0 109.949 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.17 -41.21 99.19 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.955 -0.757 . . . . 10.0 108.955 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 96.1 mt -69.97 -19.63 63.35 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.681 179.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -87.46 -41.0 13.85 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 178.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.99 -51.64 52.52 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.722 -0.844 . . . . 10.0 108.722 178.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -70.66 -34.06 71.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.393 -0.821 . . . . 10.0 108.822 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.18 -45.66 85.22 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.956 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.02 -41.11 99.65 Favored Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 110.237 -1.145 . . . . 10.0 110.237 178.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.45 92.58 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 109.327 -0.62 . . . . 10.0 109.327 178.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 74.4 mtt180 -64.72 -38.52 91.27 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.952 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 85.9 mt -61.12 -41.7 97.18 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.555 -0.535 . . . . 10.0 109.555 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -68.34 -43.36 77.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.419 178.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -61.0 -47.53 86.04 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.052 179.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 15.7 m-30 -61.28 -43.56 98.67 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.399 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -59.67 -46.82 87.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.508 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -63.01 -54.86 31.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.564 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -58.63 -39.62 81.01 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.973 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.18 -41.4 90.34 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 116.491 -0.322 . . . . 10.0 110.466 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 47.2 m -62.39 -45.29 93.82 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -64.21 -29.7 70.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.317 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -79.48 -46.68 16.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.33 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 56.2 mt -60.04 -40.7 90.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.52 -0.309 . . . . 10.0 111.144 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 4.8 p -65.6 -47.79 74.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.867 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 12.3 p -68.83 -32.21 71.74 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.881 -0.328 . . . . 10.0 110.808 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 25.4 mt -63.84 -44.87 91.88 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.576 -0.527 . . . . 10.0 109.576 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.4 p -71.84 -34.82 69.6 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.777 -0.453 . . . . 10.0 109.777 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 74.4 mt-10 -63.74 -24.16 67.66 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.686 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 48.1 mttp -97.91 -31.39 12.21 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.141 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -63.84 -39.01 93.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.696 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -56.03 -61.86 5.72 Favored Pre-proline 0 CA--C 1.534 0.327 0 CA-C-N 116.42 -0.354 . . . . 10.0 111.44 179.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -65.65 -35.48 37.28 Favored 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 121.822 1.681 . . . . 10.0 111.736 179.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.8 82.69 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 121.145 -0.222 . . . . 10.0 110.814 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 57.3 mt -64.82 -41.61 95.63 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.204 -0.295 . . . . 10.0 110.204 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . 0.562 ' O ' ' CG ' ' C' ' 571' ' ' GLN . 88.1 mt-10 -64.17 -44.14 92.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.662 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -67.88 -41.1 83.34 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.374 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 33.5 mt -58.79 -49.46 77.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.238 -0.437 . . . . 10.0 109.826 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 59.2 mtt180 -65.85 -38.89 90.06 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.731 -0.47 . . . . 10.0 109.731 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . 0.562 ' CG ' ' O ' ' C' ' 567' ' ' GLU . 98.5 mt-30 -61.51 -40.21 93.8 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.665 -0.698 . . . . 20.0 111.974 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -78.44 -37.31 27.89 Favored Glycine 0 CA--C 1.521 0.445 0 N-CA-C 109.927 -1.269 . . . . 10.0 109.927 179.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 18.8 mt -54.87 -37.21 65.99 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 112.021 0.378 . . . . 10.0 112.021 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 53.4 mt -56.27 -66.02 1.32 Allowed Pre-proline 0 CA--C 1.538 0.484 0 N-CA-C 112.419 0.526 . . . . 10.0 112.419 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -68.72 -32.82 22.75 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 121.578 1.519 . . . . 10.0 112.11 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 15.4 t -65.27 -49.18 80.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.751 -0.204 . . . . 10.0 111.034 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 46.1 mt -65.2 -36.87 85.53 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 110.14 -0.319 . . . . 10.0 110.14 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -66.24 -46.37 77.38 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 110.091 -0.337 . . . . 10.0 110.091 178.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 44.0 m -62.15 -43.12 99.54 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.968 0.414 . . . . 10.0 109.986 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 5.3 m-30 -65.51 -37.37 86.58 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.903 -0.59 . . . . 10.0 109.564 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -60.82 -41.21 95.26 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 95.2 t -61.65 -39.9 84.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.115 -0.698 . . . . 10.0 109.115 178.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 13.4 m -68.92 -36.94 78.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.238 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -70.32 -43.2 70.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.733 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 98.6 mt -61.55 -45.94 92.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.12 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 2.9 p -65.63 -40.94 93.09 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.69 -0.485 . . . . 10.0 109.69 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -60.46 -53.11 61.49 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 115.76 -0.655 . . . . 10.0 110.632 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.3 mt -56.09 -45.13 79.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.868 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -68.91 -39.63 79.57 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.665 0.617 . . . . 10.0 112.665 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -70.93 -41.1 71.61 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.993 0.425 . . . . 10.0 110.814 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -64.52 -39.66 94.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.759 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.38 -25.9 67.77 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.947 0.351 . . . . 10.0 111.947 -179.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -72.95 -39.21 66.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.12 0.486 . . . . 10.0 110.191 179.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -77.03 -26.48 53.74 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.872 -0.604 . . . . 10.0 110.634 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 83.4 mt -95.82 46.8 1.09 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.05 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.428 -0.796 . . . . 10.0 109.665 -179.968 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 7.1 t . . . . . 0 C--O 1.236 0.372 0 CA-C-O 121.716 0.769 . . . . 10.0 110.295 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -108.87 137.53 46.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.341 -0.845 . . . . 10.0 109.639 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -125.84 157.33 37.87 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.809 0.338 . . . . 10.0 111.386 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 mmtm -114.77 112.57 23.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.707 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 25.8 mt -108.65 117.28 33.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.971 0.415 . . . . 10.0 110.841 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 39.8 t -107.42 119.34 56.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.131 0.491 . . . . 10.0 110.724 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 21.6 t -90.63 121.1 40.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.545 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 18.3 m -114.91 165.27 10.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.917 0.389 . . . . 10.0 110.952 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 144.92 163.82 10.28 Favored Glycine 0 N--CA 1.445 -0.7 0 N-CA-C 110.8 -0.92 . . . . 10.0 110.8 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.53 176.1 7.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.293 0.568 . . . . 10.0 111.893 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.64 123.61 6.16 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.915 -0.659 . . . . 10.0 111.963 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 121.23 -20.06 8.54 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.627 -0.797 . . . . 10.0 112.12 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 34.2 m -65.2 -36.43 77.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.795 0.331 . . . . 10.0 111.58 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 104.7 39.26 2.39 Favored Glycine 0 CA--C 1.518 0.257 0 C-N-CA 120.598 -0.811 . . . . 10.0 113.596 179.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -59.73 -51.98 67.45 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.943 0.401 . . . . 10.0 111.267 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -60.04 -36.3 76.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.895 -0.593 . . . . 10.0 111.895 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.92 -50.99 68.65 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.691 0.282 . . . . 10.0 110.745 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 72.0 mt -59.72 -36.83 77.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.456 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 29.2 m -68.79 -51.05 45.13 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.291 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 97.6 mt -63.11 -32.0 54.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-O 120.816 0.341 . . . . 10.0 110.977 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 38.0 tp60 -64.45 -30.34 71.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.533 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 23.8 tp -85.35 -30.71 23.46 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.114 0.483 . . . . 10.0 110.474 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 43.2 mm -73.13 -59.36 3.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.954 -0.567 . . . . 10.0 112.086 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -125.1 4.92 7.9 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 113.179 0.807 . . . . 10.0 113.179 -178.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 54.6 t30 58.27 51.43 8.45 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.293 0.568 . . . . 10.0 111.198 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 40.6 t60 -129.39 120.9 26.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.839 -0.618 . . . . 10.0 110.089 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -84.29 118.26 24.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.414 -0.357 . . . . 10.0 110.64 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 10.1 m -77.39 141.57 15.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.541 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -105.74 -24.02 12.6 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.258 0.551 . . . . 10.0 109.948 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 3.4 pm0 -86.43 140.36 30.06 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.28 -0.873 . . . . 10.0 111.054 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -85.49 68.73 10.54 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.395 0.617 . . . . 10.0 109.814 178.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.3 138.02 84.12 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.724 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -72.25 -178.37 3.22 Favored 'Trans proline' 0 N--CA 1.463 -0.303 0 C-N-CA 123.158 2.572 . . . . 10.0 111.706 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.2 m -166.71 137.39 3.26 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.443 -0.344 . . . . 10.0 110.711 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 76.8 mt -123.01 -52.91 2.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 107.817 -1.179 . . . . 10.0 107.817 177.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -148.1 115.06 6.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.079 -0.964 . . . . 10.0 109.001 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -132.66 133.61 43.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.093 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 2.0 p -120.96 122.27 39.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.987 0.423 . . . . 10.0 111.796 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -122.49 155.52 36.02 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -153.97 141.05 19.39 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.814 0.34 . . . . 10.0 111.21 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -158.48 155.98 29.47 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.726 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -105.24 131.28 52.91 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.529 -0.545 . . . . 10.0 109.529 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 15.7 m -139.02 158.22 29.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.685 0.279 . . . . 10.0 111.104 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 54.6 t -92.43 100.62 11.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.047 -0.723 . . . . 10.0 109.047 178.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 39.1 mt -88.86 104.67 15.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.683 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 58.67 12.77 2.32 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.95 1.093 . . . . 10.0 113.95 178.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 132.45 -33.13 2.71 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.414 -0.898 . . . . 10.0 113.087 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -101.38 134.87 43.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.639 0.257 . . . . 10.0 110.703 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 5.6 t -81.61 140.86 34.19 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 71.3 m -147.09 158.59 43.99 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.833 0.349 . . . . 10.0 111.328 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.04 122.46 40.06 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 82.9 mt -111.87 120.98 43.78 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.541 0.571 . . . . 10.0 112.541 -178.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.88 113.19 24.79 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 107.697 -1.224 . . . . 10.0 107.697 177.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.4 mt -101.5 127.05 55.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 120.811 0.338 . . . . 10.0 110.934 -178.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.6 tp -109.04 113.87 27.12 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.861 -0.609 . . . . 10.0 111.737 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -90.85 101.56 14.32 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.89 -0.781 . . . . 10.0 108.89 178.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 38.0 p -80.95 165.05 22.11 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 112.912 0.708 . . . . 10.0 112.912 -178.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.36 156.83 33.42 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.473 -0.785 . . . . 10.0 111.392 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -79.83 -55.82 3.48 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.786 -0.721 . . . . 10.0 111.969 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -120.32 127.82 52.7 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.762 -0.458 . . . . 20.0 109.762 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -163.02 168.33 21.18 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.697 -0.483 . . . . 10.0 109.697 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -105.37 -136.96 0.36 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.586 -0.279 . . . . 10.0 110.943 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -103.47 90.11 3.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.1 0.476 . . . . 10.0 110.97 -179.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 3.1 m -101.4 139.39 37.13 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.702 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.11 -37.78 88.55 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.006 0.431 . . . . 10.0 111.183 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 39.4 ttp -64.76 -35.77 82.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.036 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 22.6 ttt85 -66.5 -51.53 55.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.545 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.33 -38.99 72.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.876 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 3.0 tp60 -58.53 -56.09 26.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.64 -0.709 . . . . 10.0 112.255 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -67.28 -15.74 63.87 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 113.594 0.961 . . . . 10.0 113.594 -178.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 86.2 mtp -80.16 -18.31 50.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.773 0.321 . . . . 10.0 111.197 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 4.1 mtt-85 -75.15 -29.75 60.57 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.864 0.364 . . . . 10.0 110.715 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.59 -0.39 37.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.853 -0.612 . . . . 10.0 112.468 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -84.92 127.56 8.24 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.331 -0.937 . . . . 10.0 112.44 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -86.93 -42.28 13.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.218 0.532 . . . . 10.0 109.823 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -130.32 144.45 15.75 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 110.538 -1.025 . . . . 10.0 110.538 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -122.64 129.26 51.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.046 0.451 . . . . 10.0 111.861 -178.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 78.7 mt -96.88 108.82 21.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.549 -0.751 . . . . 10.0 109.886 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 19.3 m -85.47 91.08 8.12 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.027 -0.36 . . . . 10.0 110.027 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 47.4 t -89.6 121.61 39.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.542 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -130.51 152.1 50.26 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.661 -0.7 . . . . 10.0 109.882 179.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -91.67 125.97 36.59 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.976 -0.379 . . . . 10.0 109.976 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 43.8 pt -70.44 -8.06 10.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.2 0.524 . . . . 10.0 111.16 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.43 5.56 42.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.104 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -132.07 106.81 8.24 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.402 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -39.52 82.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.906 -0.588 . . . . 10.0 112.479 -179.085 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -59.1 -36.06 74.5 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.778 0.288 . . . . 10.0 111.778 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 21.1 m -64.71 -36.53 84.59 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.001 0.429 . . . . 10.0 110.6 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -70.94 -34.43 71.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.682 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -79.31 -25.78 42.34 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.97 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.75 -2.64 47.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.495 -179.22 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 29.5 mm -58.58 -42.36 84.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.728 0.299 . . . . 10.0 111.104 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 17.2 t60 -68.4 -26.62 65.64 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.986 0.422 . . . . 10.0 110.366 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -66.08 -40.8 91.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.685 -0.689 . . . . 10.0 109.803 179.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -71.7 -44.27 64.48 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.408 -0.96 . . . . 10.0 108.408 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -51.84 -53.47 39.95 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.967 -1.015 . . . . 10.0 111.691 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -64.76 -37.18 86.72 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.126 0.417 . . . . 10.0 112.126 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -61.97 -49.72 74.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.019 -0.363 . . . . 10.0 110.019 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 42.1 mt -62.81 -42.15 95.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 10.0 111.018 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -60.29 -32.86 71.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.545 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 49.2 ttp85 -80.69 -40.14 25.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.938 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 18.8 m -69.16 -26.34 31.73 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 112.469 0.544 . . . . 10.0 112.469 -179.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -98.86 -14.09 19.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.761 0.315 . . . . 10.0 110.868 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 11.4 t70 59.47 39.48 21.8 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.146 -178.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 19.6 m -155.16 139.37 16.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.458 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 7.2 mp0 -85.74 -13.07 49.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.651 0.739 . . . . 10.0 109.46 178.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -102.06 86.03 2.79 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.934 -1.03 . . . . 10.0 110.177 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 55.9 t -130.82 131.84 23.53 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.014 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -64.24 112.13 1.81 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.866 2.378 . . . . 10.0 111.824 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 57.5 mtt -130.54 149.61 52.13 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.126 -0.488 . . . . 10.0 109.746 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 99.4 t -130.97 128.03 61.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.772 -0.455 . . . . 10.0 109.772 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 17.1 tp -82.91 119.56 24.57 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.557 -0.535 . . . . 10.0 109.557 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 51.2 t -117.26 117.03 53.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 120.963 0.411 . . . . 10.0 111.48 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -98.79 115.14 5.22 Favored Glycine 0 N--CA 1.45 -0.388 0 N-CA-C 110.304 -1.118 . . . . 10.0 110.304 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -103.04 164.18 11.77 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 117.204 0.502 . . . . 10.0 112.147 -178.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 13.6 mtmt 69.44 41.68 1.26 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.108 -0.951 . . . . 10.0 113.112 178.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 15.4 p -81.04 -12.49 59.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.21 0.529 . . . . 10.0 110.266 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -76.47 -12.19 60.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.388 -0.824 . . . . 10.0 110.945 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 31.6 mt -95.17 136.86 22.35 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.143 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -72.84 3.54 4.33 Favored 'Trans proline' 0 CA--C 1.53 0.295 0 C-N-CA 122.623 2.216 . . . . 10.0 112.904 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.26 32.56 0.69 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.858 0.361 . . . . 10.0 111.147 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 24.6 ttm-85 -64.4 105.1 0.87 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.899 0.381 . . . . 10.0 111.557 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.5 m -94.12 -40.86 9.83 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.297 0.57 . . . . 10.0 109.661 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 45.7 t -86.7 122.84 39.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.566 -0.743 . . . . 10.0 109.577 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.9 150.14 42.85 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.986 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.38 -35.99 77.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.444 -179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -69.47 -33.99 73.71 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.62 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -62.43 -47.53 83.65 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.046 0.45 . . . . 10.0 110.151 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.33 94.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.741 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -63.2 -44.49 95.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.439 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -62.96 -42.22 99.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.987 0.422 . . . . 10.0 111.221 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 37.1 tp -66.2 -43.88 85.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.046 0.451 . . . . 10.0 110.276 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.22 -43.54 97.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.618 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -61.34 -35.53 77.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.683 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.0 m -67.27 -33.95 76.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.875 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -83.41 -19.84 35.25 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.231 0.539 . . . . 10.0 110.194 178.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.21 30.46 25.25 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 111.03 -0.828 . . . . 10.0 111.03 -179.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 48.7 pt -123.37 151.63 63.09 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.763 -0.218 . . . . 10.0 110.74 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.36 156.96 33.07 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.384 2.056 . . . . 10.0 112.059 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -122.73 129.84 52.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.512 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 33.2 mm -125.97 125.59 68.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.142 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -87.32 124.41 33.33 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.208 -1.034 . . . . 10.0 108.208 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 40.2 p -126.82 172.94 9.95 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.577 0.955 . . . . 10.0 113.577 -177.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 26.5 t -159.79 125.16 4.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.245 -1.343 . . . . 10.0 107.615 178.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.47 -27.2 65.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.946 0.403 . . . . 10.0 111.828 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -73.79 -55.74 5.85 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.603 0.594 . . . . 10.0 112.603 -179.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 44.4 p -83.22 -14.81 52.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.641 -0.254 . . . . 10.0 111.591 -178.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 27.0 ttt180 68.32 22.88 7.86 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.622 0.725 . . . . 10.0 109.834 -178.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -62.05 111.45 1.94 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.907 -1.042 . . . . 10.0 111.833 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 67.89 9.38 56.32 Favored Glycine 0 C--O 1.227 -0.303 0 N-CA-C 114.658 0.623 . . . . 10.0 114.658 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.68 -53.34 48.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 117.511 0.655 . . . . 10.0 111.17 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -62.01 -45.1 95.07 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.118 0.485 . . . . 10.0 110.373 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -63.48 -36.13 82.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.852 -0.613 . . . . 10.0 112.53 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.0 -47.85 81.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.908 0.385 . . . . 10.0 110.196 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -66.91 -42.02 86.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.686 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -62.99 -42.34 99.82 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.18 -0.463 . . . . 10.0 110.598 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 66.1 m -60.09 -41.4 92.4 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.807 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 41.0 tp -57.8 -43.65 85.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.495 -0.321 . . . . 10.0 110.222 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 46.4 t -64.78 -36.72 78.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.117 -0.492 . . . . 10.0 109.929 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 67.3 mtt180 -63.25 -44.63 94.62 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.126 179.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -64.39 -38.07 89.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.095 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 96.1 mt -65.02 -43.64 96.05 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.201 179.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -63.16 -40.33 97.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.534 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -65.5 -31.62 72.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.241 0.543 . . . . 10.0 109.653 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 20.8 t-80 -67.23 -35.65 80.03 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.913 178.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -63.26 -48.93 76.09 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.789 -0.641 . . . . 10.0 109.623 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -61.37 -42.81 99.31 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.243 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -58.47 -46.39 86.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.943 -0.572 . . . . 10.0 110.474 179.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 16.8 ttm -67.01 -24.39 66.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.625 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 C--N 1.327 -0.376 0 CA-C-O 121.018 0.437 . . . . 10.0 110.977 179.551 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 N-CA-C 111.946 -0.462 . . . . 10.0 111.946 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 1.6 p -126.15 130.11 50.38 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.618 0.247 . . . . 10.0 110.944 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 45.7 t -117.81 128.7 74.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.154 -0.476 . . . . 10.0 109.804 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 13.3 pttp -93.34 119.35 32.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.163 0.506 . . . . 10.0 111.395 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 35.0 t -96.62 129.11 47.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.868 -0.605 . . . . 10.0 109.465 179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -90.71 139.25 30.9 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.062 0.458 . . . . 10.0 111.194 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 68.4 mt -112.4 154.94 44.37 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.507 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.91 55.13 1.71 Allowed 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.038 2.492 . . . . 10.0 112.649 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -151.3 19.65 0.75 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.164 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 67.0 mttm 62.12 31.97 17.59 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.715 -0.675 . . . . 10.0 111.22 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -141.91 173.47 11.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.254 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.48 171.02 18.73 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.793 0.33 . . . . 10.0 111.708 -179.149 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 9.7 t -138.12 141.49 40.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.725 -0.671 . . . . 10.0 109.357 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 47.2 t -92.33 110.84 23.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.973 0.416 . . . . 10.0 111.333 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 17.3 t -102.07 141.5 18.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.247 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.99 135.77 35.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.46 -0.337 . . . . 10.0 110.095 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 57.3 t -75.14 116.3 17.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 110.231 -0.285 . . . . 10.0 110.231 179.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 23.6 mtp180 -129.26 109.5 11.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.995 0.426 . . . . 10.0 111.196 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -70.21 114.54 8.46 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.477 0.656 . . . . 10.0 110.186 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 147.71 -34.75 1.23 Allowed Glycine 0 N--CA 1.446 -0.65 0 N-CA-C 110.118 -1.193 . . . . 10.0 110.118 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 10.7 ptm -98.0 150.29 21.53 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.447 -0.377 . . . . 10.0 110.132 179.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.36 176.73 6.19 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.301 -179.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 92.3 t -59.05 -37.29 67.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 52.9 t80 -58.09 -49.7 76.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.497 -0.774 . . . . 10.0 110.912 179.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -68.42 -38.36 81.15 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.08 -0.509 . . . . 10.0 112.05 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 5.4 m -73.02 -43.45 62.06 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.814 0.672 . . . . 10.0 112.814 -178.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.22 -15.02 58.67 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.454 0.539 . . . . 10.0 112.454 -178.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -56.3 -52.44 64.52 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.056 0.391 . . . . 10.0 112.056 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 5.2 mmmm -59.55 -36.39 76.07 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.062 0.393 . . . . 10.0 112.062 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -71.34 -38.3 71.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.915 0.388 . . . . 10.0 111.294 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 90.4 mt -75.03 -45.22 43.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.275 -0.42 . . . . 10.0 111.184 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -58.91 -37.97 77.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.019 -0.537 . . . . 10.0 112.224 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 3.2 p -71.12 -12.75 16.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 121.073 0.463 . . . . 10.0 111.407 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -110.65 -2.0 16.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.838 0.351 . . . . 10.0 111.061 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 77.65 24.4 65.13 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.999 -0.62 . . . . 10.0 112.443 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 93.3 mt -106.52 143.93 33.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.545 0.212 . . . . 10.0 110.481 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -109.32 159.34 17.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.259 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -78.15 62.57 2.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.791 0.329 . . . . 10.0 110.995 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -134.32 -67.16 0.59 Allowed 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.123 -0.489 . . . . 10.0 112.046 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 1.7 p -87.78 -17.05 32.47 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.229 0.537 . . . . 10.0 110.707 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 4.6 m -83.43 128.59 34.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.982 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 5.0 p -121.35 137.94 53.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.3 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 20.7 t -98.62 127.31 51.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.779 -179.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -108.04 135.92 48.59 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.19 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -87.2 169.88 11.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.002 -0.544 . . . . 10.0 109.564 178.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.42 78.65 1.45 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.461 0.648 . . . . 10.0 111.049 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 65.8 mt -91.66 94.24 4.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.227 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt 58.58 28.39 17.02 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.51 -0.768 . . . . 10.0 112.157 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 102.25 -19.85 47.13 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 121.042 -0.599 . . . . 10.0 112.13 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.48 111.61 19.21 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.925 0.393 . . . . 10.0 111.3 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -69.95 112.9 6.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.892 178.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -110.35 134.49 52.24 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.792 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 46.1 t -68.81 123.68 22.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.661 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 1.8 t -105.22 172.8 6.6 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.184 -0.302 . . . . 10.0 110.184 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -114.34 163.59 15.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.985 0.421 . . . . 10.0 110.817 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -82.6 -21.44 35.17 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.539 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.91 -16.58 58.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.668 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 2.9 m -69.49 138.81 53.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.647 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -76.43 151.55 36.48 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.671 -0.492 . . . . 10.0 109.671 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 7.3 tp -82.93 0.59 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 121.104 0.478 . . . . 10.0 112.155 -179.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -61.29 -56.05 37.67 Favored Pre-proline 0 CA--C 1.543 0.707 0 N-CA-C 113.67 0.989 . . . . 10.0 113.67 -179.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.44 3.77 5.03 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 121.984 1.789 . . . . 10.0 113.001 -179.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -85.76 -11.99 52.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.007 0.432 . . . . 10.0 111.402 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -64.09 114.97 4.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.362 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 133.77 -30.18 3.01 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.76 -0.733 . . . . 10.0 112.508 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -119.78 -167.62 1.46 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.59 0.233 . . . . 10.0 110.937 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -131.7 153.71 49.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.114 -0.493 . . . . 10.0 110.286 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 70.6 mt -114.51 144.82 42.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.716 0.294 . . . . 10.0 111.622 -178.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 3.2 mp -123.7 123.7 67.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 17.3 t -103.44 135.77 39.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 120.649 0.261 . . . . 10.0 111.009 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.79 164.89 28.43 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 45.0 t -106.21 127.06 61.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 120.67 0.271 . . . . 10.0 110.57 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 94.7 mt . . . . . 0 C--O 1.252 1.207 0 CA-C-O 118.392 -0.813 . . . . 10.0 111.088 -179.998 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 82.8 mt . . . . . 0 N--CA 1.456 -0.157 0 CA-C-O 120.873 0.368 . . . . 10.0 110.585 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -64.64 -46.35 82.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.706 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 1.3 tt -61.23 -36.94 81.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.92 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 75.8 mt -61.4 -44.48 97.07 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.44 -179.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.37 -39.85 38.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.284 -0.416 . . . . 10.0 111.551 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -62.48 -45.14 94.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.839 0.352 . . . . 10.0 110.532 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -68.55 -26.27 65.33 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.827 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -65.12 -39.95 93.8 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 3.1 m -65.64 -31.72 72.9 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 109.15 -0.685 . . . . 10.0 109.15 177.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 65.6 t -66.1 -49.02 79.43 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 115.866 -0.607 . . . . 10.0 109.575 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.17 -29.21 69.46 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.905 -0.405 . . . . 10.0 109.905 178.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 50.7 m -76.95 -2.15 32.27 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.413 0.625 . . . . 10.0 110.217 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 81.9 m -108.19 -41.17 4.98 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 177.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -59.89 -37.74 80.26 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.234 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.3 -49.66 73.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.439 178.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 53.0 mmtt -61.36 -38.0 85.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.675 -0.693 . . . . 10.0 109.918 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 59.2 mt -64.81 -40.39 95.12 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.822 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -68.19 -36.91 80.31 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.697 -0.483 . . . . 10.0 109.697 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -70.74 -21.72 62.5 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.239 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -88.01 -48.62 7.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.537 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 76.3 mt -58.1 -30.29 66.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.867 -0.606 . . . . 10.0 112.091 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -53.48 -71.32 0.71 Allowed Glycine 0 C--N 1.333 0.364 0 C-N-CA 121.053 -0.594 . . . . 10.0 111.71 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -62.21 -32.84 82.56 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.236 1.958 . . . . 10.0 111.227 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 4.8 t -58.35 -48.9 83.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 N-CA-C 111.732 0.271 . . . . 10.0 111.732 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 2.9 p -63.43 -35.31 80.0 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.902 -0.319 . . . . 10.0 110.589 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -69.85 -50.12 45.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.401 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -61.79 -39.88 93.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 10.0 109.919 179.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.95 -45.82 87.46 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.617 178.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 8.4 m95 -65.75 -38.91 90.39 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.262 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -58.35 -49.56 76.75 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 178.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 -66.95 -37.98 85.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.41 -0.814 . . . . 10.0 109.767 179.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 12.9 mt -63.84 -39.74 94.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.478 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -62.25 -47.48 84.2 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 109.55 -0.537 . . . . 10.0 109.55 178.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 25.1 mtmt -56.49 -44.99 81.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.055 0.455 . . . . 10.0 109.879 179.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -66.19 -52.36 48.83 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.713 -0.676 . . . . 10.0 111.105 179.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 24.4 p -62.88 -35.93 81.63 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.645 0.609 . . . . 10.0 112.645 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -64.85 -44.41 89.86 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.235 -1.024 . . . . 10.0 108.235 178.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -64.57 -41.01 98.04 Favored Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 109.847 -1.301 . . . . 10.0 109.847 178.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 76.7 mt -62.85 -36.94 84.89 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 110.031 -0.359 . . . . 10.0 110.031 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -66.27 -50.33 64.06 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -58.29 -45.3 88.21 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.444 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -63.87 -44.84 91.88 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.978 -1.01 . . . . 10.0 110.479 179.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -65.15 -27.48 68.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.908 179.336 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 24.8 m -63.03 -49.16 75.72 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 108.411 -0.959 . . . . 10.0 108.411 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -70.55 -42.42 71.17 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.142 -0.688 . . . . 10.0 109.142 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.29 -65.02 0.64 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.277 -0.874 . . . . 10.0 110.934 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 45.2 mt -58.5 -45.97 87.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.817 -0.629 . . . . 10.0 111.972 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -61.03 -48.25 82.62 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.947 0.351 . . . . 10.0 111.947 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -65.19 -40.83 94.75 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.116 -0.328 . . . . 10.0 110.116 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 24.8 t -63.51 -42.85 97.63 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.441 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.547 179.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -72.38 -43.43 63.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.829 0.347 . . . . 10.0 111.398 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.94 -34.73 78.1 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.321 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 45.4 mtpt -88.57 -25.49 22.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.398 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.84 -26.22 38.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.739 0.304 . . . . 10.0 110.548 179.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -60.93 9.04 Favored Pre-proline 0 CA--C 1.535 0.388 0 CA-C-N 116.188 -0.46 . . . . 10.0 109.809 178.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -65.39 -24.41 57.34 Favored 'Trans proline' 0 C--N 1.36 1.176 0 C-N-CA 121.725 1.617 . . . . 10.0 111.059 177.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -65.53 -52.97 48.6 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 177.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 83.8 mt -66.44 -41.21 89.48 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.556 -0.747 . . . . 10.0 110.007 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -60.18 -43.91 95.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.065 0.459 . . . . 10.0 110.391 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -65.55 -47.24 76.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.278 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -65.92 -45.94 80.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.782 -0.644 . . . . 10.0 111.646 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 23.1 tt0 -64.9 -34.71 79.05 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-O 120.497 0.189 . . . . 10.0 110.537 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 2.8 ttmp? -60.83 -49.57 76.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.507 0.67 . . . . 10.0 109.283 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 41.7 mttt -70.64 -35.11 72.74 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.342 -0.844 . . . . 10.0 110.199 179.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 9.2 t90 -62.44 -35.73 80.19 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.746 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -62.02 -46.05 90.88 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 108.827 -0.805 . . . . 10.0 108.827 178.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -62.74 -43.55 98.51 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -56.81 -48.9 76.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.68 179.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 81.3 mmm -71.64 -43.17 66.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.754 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -61.51 -49.94 74.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.902 -0.135 . . . . 10.0 111.113 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 86.8 mt -64.58 -36.27 83.68 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.867 -0.42 . . . . 10.0 109.867 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -61.67 -50.03 74.14 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.479 178.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 50.3 mtt85 -67.05 -36.03 81.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.706 0.288 . . . . 10.0 110.588 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -61.2 -45.34 94.99 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.797 -0.638 . . . . 10.0 109.923 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 63.1 mttt -80.52 -31.65 37.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.428 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 1.4 t -53.95 -37.64 34.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 O-C-N 123.123 0.264 . . . . 10.0 111.42 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -58.96 -63.37 4.23 Favored Pre-proline 0 CA--C 1.533 0.296 0 N-CA-C 112.332 0.493 . . . . 10.0 112.332 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -60.68 -35.69 88.3 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 122.11 1.873 . . . . 10.0 111.601 178.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 16.6 mt -65.19 -41.61 94.38 Favored 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 109.931 -0.396 . . . . 10.0 109.931 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 20.4 ttm180 -67.55 -35.07 78.34 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -65.82 -44.17 86.43 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.261 178.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -60.46 -45.08 95.01 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 108.953 -0.758 . . . . 10.0 108.953 178.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 84.3 mt -62.71 -47.14 84.89 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.459 -0.791 . . . . 10.0 109.884 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -62.98 -56.71 14.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.91 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -61.92 -43.97 97.74 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.884 0.374 . . . . 10.0 110.576 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -61.98 -47.2 91.6 Favored Glycine 0 N--CA 1.444 -0.819 0 N-CA-C 110.857 -0.897 . . . . 10.0 110.857 178.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.61 -34.5 78.41 Favored 'General case' 0 C--O 1.218 -0.595 0 N-CA-C 110.187 -0.301 . . . . 10.0 110.187 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -57.81 -44.92 86.7 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -68.83 -53.2 22.83 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.655 -0.498 . . . . 10.0 109.655 178.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 53.6 mttt -52.82 -49.74 65.07 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.668 -0.696 . . . . 10.0 111.515 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 84.1 mt -68.11 -45.48 73.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.487 -0.324 . . . . 10.0 111.355 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 43.8 t60 -59.84 -47.72 84.61 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.686 -0.234 . . . . 10.0 110.683 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -63.03 -35.27 79.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.689 179.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 36.6 mt -70.94 -38.6 72.87 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.066 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -63.57 -35.39 80.34 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 108.65 -0.87 . . . . 10.0 108.65 177.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -73.2 -7.44 51.45 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.081 -0.963 . . . . 10.0 110.349 178.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 2.6 mmpp? -100.87 -44.28 5.82 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.757 -0.831 . . . . 10.0 108.757 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 90.7 mt -60.82 -22.85 64.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.598 -0.728 . . . . 10.0 111.267 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 18.5 m -73.77 -67.09 0.45 Allowed Pre-proline 0 CA--C 1.542 0.642 0 C-N-CA 120.841 -0.344 . . . . 10.0 111.41 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.84 -44.59 7.61 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.04 1.827 . . . . 10.0 112.25 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 85.0 mt -69.89 -22.01 63.27 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.024 0.44 . . . . 10.0 110.007 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -77.99 -45.22 10.62 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 109.169 -1.573 . . . . 10.0 109.169 177.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -61.57 -41.95 98.13 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.6 -0.889 . . . . 10.0 108.6 177.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.07 -36.88 85.07 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.272 -0.876 . . . . 10.0 109.448 178.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 11.2 tpt -64.81 -46.13 83.31 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.511 -0.551 . . . . 10.0 109.511 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 27.8 mtt180 -63.52 -43.55 96.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.419 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -64.19 -40.04 95.26 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.253 -0.431 . . . . 10.0 110.348 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . 1.195 ' CD ' ' CD1' ' C' ' 469' ' ' LEU . 5.1 mmp_? -69.55 -36.72 76.62 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.912 -0.774 . . . . 10.0 108.912 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -65.39 -35.07 79.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.739 -0.664 . . . . 10.0 109.783 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -58.37 -55.22 37.86 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 109.026 -0.731 . . . . 10.0 109.026 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -62.28 -39.89 94.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.613 178.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.29 -54.45 45.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.738 179.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 57.7 t -73.75 -41.77 54.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.813 -0.63 . . . . 10.0 112.24 -178.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.1 -39.15 93.84 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.998 -0.281 . . . . 10.0 111.309 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -68.21 -28.73 67.5 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 108.569 -0.9 . . . . 10.0 108.569 177.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 16.5 mt -73.86 -37.17 64.84 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-N 115.428 -0.806 . . . . 10.0 108.889 178.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -61.58 -49.37 76.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.933 0.397 . . . . 10.0 110.163 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -69.18 -10.35 57.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.818 -0.628 . . . . 10.0 112.063 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 17.5 m80 -106.31 -50.49 3.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.652 -0.249 . . . . 10.0 111.372 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 82.8 mt -63.12 -38.57 91.71 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.539 0.57 . . . . 10.0 112.539 -179.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.19 -60.24 9.54 Favored Pre-proline 0 CA--C 1.534 0.345 0 C-N-CA 121.206 -0.198 . . . . 10.0 111.292 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -66.43 -32.73 39.72 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 121.444 1.429 . . . . 10.0 111.239 178.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 5.2 m-30 -60.6 -48.66 80.78 Favored 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 110.333 -0.247 . . . . 10.0 110.333 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 25.4 p -69.97 -35.05 74.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.859 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -67.04 -46.83 73.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.935 0.398 . . . . 10.0 110.161 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -67.77 -30.21 69.61 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.066 -0.716 . . . . 10.0 109.066 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.66 -29.61 68.95 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 108.952 -0.759 . . . . 10.0 108.952 178.01 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -64.96 -38.45 91.02 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 108.611 -0.885 . . . . 10.0 108.611 178.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -69.12 -40.76 78.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.111 178.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 13.5 ttm180 -65.17 -44.99 86.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.652 -0.704 . . . . 10.0 109.391 178.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 48.5 mt -65.12 -34.32 78.12 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.826 -0.624 . . . . 10.0 109.572 178.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -63.93 -43.07 96.99 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -64.2 -42.73 96.52 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.076 -0.713 . . . . 10.0 109.076 178.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 6.7 mmt180 -61.28 -52.35 65.1 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.593 -0.73 . . . . 10.0 109.285 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 43.7 mt -61.51 -37.74 84.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.543 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -61.17 -48.86 79.61 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.42 -43.12 95.34 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.929 -0.578 . . . . 10.0 109.916 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 69.5 mt -63.09 -32.61 74.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 10.0 111.274 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -76.46 -46.39 27.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.662 0.268 . . . . 10.0 110.507 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -65.48 -48.99 70.71 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.128 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -65.68 -38.04 88.16 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -60.34 -42.98 99.06 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.472 -0.785 . . . . 10.0 111.544 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.75 -37.88 93.08 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 110.731 -0.948 . . . . 10.0 110.731 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -73.16 -44.82 59.41 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.446 -0.576 . . . . 10.0 109.446 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -53.92 -49.33 68.9 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.969 178.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 95.3 mt -63.67 -40.56 97.14 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.325 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -64.29 -47.32 79.94 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.157 0.503 . . . . 10.0 109.839 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -66.67 -41.38 88.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.788 179.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 1.8 m-30 -61.22 -39.33 89.86 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.937 -0.394 . . . . 10.0 109.937 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -65.64 -39.92 91.96 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.395 -0.594 . . . . 10.0 109.395 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -65.7 -50.82 63.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.676 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 16.4 mttm -60.72 -37.57 82.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.575 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -64.89 -44.59 89.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.023 178.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 32.4 m -61.04 -41.79 97.25 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.832 -0.433 . . . . 10.0 109.832 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -63.19 -40.02 96.31 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 17.7 m80 -65.79 -45.18 83.37 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.484 -0.78 . . . . 10.0 109.852 179.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 96.5 mt -59.49 -34.98 73.26 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.649 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 29.7 m -63.26 -49.19 75.06 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.057 -0.519 . . . . 10.0 110.258 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 21.0 p -72.63 -28.22 62.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.084 0.468 . . . . 10.0 109.942 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 28.9 mt -64.45 -47.65 78.24 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.164 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 1.4 p -64.69 -34.87 79.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.817 0.341 . . . . 10.0 110.591 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -68.48 -9.02 46.19 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.426 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 7.5 mtmp? -116.88 -29.81 5.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.604 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -73.5 -14.69 61.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.281 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -117.09 -68.86 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 112.401 0.519 . . . . 10.0 112.401 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.42 -56.07 2.06 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.141 1.894 . . . . 10.0 112.445 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -64.07 -42.62 96.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.207 -0.452 . . . . 10.0 111.367 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 9.2 mt -65.68 -37.57 86.86 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 120.908 -0.317 . . . . 10.0 111.248 179.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . 0.532 ' O ' ' CG ' ' A' ' 373' ' ' GLN . 9.6 mt-10 -68.77 -32.75 72.72 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.998 -0.371 . . . . 10.0 109.998 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.22 -45.0 78.13 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.413 -0.958 . . . . 10.0 108.413 177.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.51 -47.95 79.61 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.171 -0.922 . . . . 10.0 109.908 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -65.13 -39.9 93.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.933 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.532 ' CG ' ' O ' ' A' ' 369' ' ' GLU . 98.8 mt-30 -64.32 -34.58 78.47 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.15 -0.477 . . . . 20.0 110.704 178.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -77.43 -34.65 39.61 Favored Glycine 0 C--N 1.332 0.336 0 N-CA-C 109.698 -1.361 . . . . 10.0 109.698 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 18.0 mt -61.26 -28.39 69.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.758 -0.221 . . . . 10.0 111.186 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 56.3 mt -59.47 -65.07 2.27 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 121.083 -0.247 . . . . 10.0 111.089 179.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -65.09 -34.07 47.92 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 121.819 1.68 . . . . 10.0 111.212 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 16.0 t -62.3 -53.36 48.48 Favored 'Isoleucine or valine' 0 C--O 1.231 0.095 0 CA-C-N 116.702 -0.226 . . . . 10.0 110.433 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 40.4 mt -62.09 -41.47 98.23 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 109.957 -0.386 . . . . 10.0 109.957 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -61.78 -46.65 88.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.765 179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 30.0 p -64.45 -34.11 77.43 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.867 0.365 . . . . 10.0 110.346 178.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -68.55 -41.4 79.88 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.06 -0.718 . . . . 10.0 109.06 178.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 83.0 mttt -63.22 -40.28 97.01 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 178.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 54.5 t -59.98 -45.86 94.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-N 116.057 -0.52 . . . . 10.0 109.927 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.26 -43.06 71.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.522 -0.308 . . . . 10.0 111.491 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -63.68 -48.31 77.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.767 0.318 . . . . 10.0 111.38 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 99.2 mt -63.07 -39.76 95.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.432 -0.349 . . . . 10.0 111.363 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 31.4 p -72.52 -39.31 67.66 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.856 -0.338 . . . . 10.0 110.896 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -66.01 -31.07 71.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.261 0.553 . . . . 10.0 110.318 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 27.6 mt -61.4 -22.0 64.6 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.752 -0.658 . . . . 10.0 111.113 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -64.02 -50.36 68.81 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.902 -0.777 . . . . 10.0 108.902 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 20.5 mp0 -61.56 -44.05 97.75 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.32 -0.855 . . . . 10.0 111.658 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -54.04 -42.52 69.27 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 123.683 0.614 . . . . 10.0 112.169 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 30.2 m -82.88 -38.88 22.3 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.396 0.517 . . . . 10.0 112.396 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -77.37 -2.74 36.63 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.808 0.67 . . . . 10.0 112.808 -178.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.29 -22.53 11.68 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 120.132 -0.627 . . . . 10.0 111.297 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -108.26 2.18 22.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.795 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 . . . . . 0 C--O 1.237 0.428 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 -179.832 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.9 mm? . . . . . 0 CA--C 1.521 -0.156 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 23.0 mtpt -81.21 2.12 29.19 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.336 -0.847 . . . . 10.0 110.173 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 1.7 mt -62.76 -24.39 67.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.471 -0.786 . . . . 10.0 111.003 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 56.9 mt -64.6 -38.06 89.71 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.156 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.84 -43.55 75.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.617 0.722 . . . . 10.0 109.484 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -66.91 -44.73 80.03 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.391 -0.822 . . . . 10.0 110.667 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -29.19 69.81 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.224 -0.444 . . . . 10.0 111.176 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.23 -37.16 79.49 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 109.406 -0.59 . . . . 10.0 109.406 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 69.6 m -69.8 -28.63 65.89 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.408 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 57.6 t -69.93 -38.16 74.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.479 -0.782 . . . . 10.0 108.89 178.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 1.6 m -62.54 -41.82 99.13 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.5 -0.926 . . . . 10.0 108.5 177.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 3.8 m -63.82 -33.18 75.09 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.044 -0.725 . . . . 10.0 109.044 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 95.7 m -65.93 -41.83 90.88 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 108.847 -0.797 . . . . 10.0 108.847 178.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -61.87 -42.3 98.89 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.291 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 8.5 m -61.17 -44.73 96.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.012 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 35.0 mmtt -61.71 -37.58 84.7 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.127 0.489 . . . . 10.0 110.007 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 83.9 mt -68.83 -38.24 79.7 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.663 178.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -65.0 -31.74 73.13 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.431 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -65.25 -35.54 81.34 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -80.56 -33.49 36.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.723 -0.672 . . . . 10.0 109.972 178.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 53.2 mt -63.94 -15.88 60.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.636 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -89.0 -95.76 1.05 Allowed Glycine 0 N--CA 1.444 -0.803 0 C-N-CA 120.801 -0.714 . . . . 10.0 111.969 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -54.05 -39.96 83.34 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.553 2.835 . . . . 10.0 114.345 -178.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 76.0 t -63.61 -48.18 87.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 117.953 0.342 . . . . 10.0 111.062 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 4.9 m -68.59 -39.16 81.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.817 0.342 . . . . 10.0 110.096 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -61.97 -42.28 98.95 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.276 -0.639 . . . . 10.0 109.276 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -64.8 -39.74 94.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.205 -0.907 . . . . 10.0 108.676 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.37 -38.86 88.52 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.048 -0.723 . . . . 10.0 109.048 178.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -66.98 -38.16 85.55 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.602 178.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -64.7 -36.92 85.83 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -68.2 -39.94 82.3 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 177.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 43.2 mt -61.21 -34.12 74.59 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.518 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -63.76 -35.61 81.16 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -72.89 -36.83 67.41 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.567 -0.901 . . . . 10.0 108.567 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -63.59 -48.62 76.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.039 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.75 -42.85 97.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.91 -0.587 . . . . 10.0 110.227 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -63.03 -40.92 99.19 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.92 -44.94 96.66 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 110.405 -1.078 . . . . 10.0 110.405 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 98.1 mt -63.39 -31.32 72.44 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 50.1 mtt180 -77.07 -3.45 39.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.089 0.471 . . . . 10.0 110.453 178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -111.41 -23.68 10.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.684 -0.858 . . . . 10.0 108.684 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -91.93 -61.0 1.72 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.927 -1.033 . . . . 10.0 110.494 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 97.4 mmm -62.66 -30.83 71.67 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.952 -0.567 . . . . 10.0 112.459 -178.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.5 p -60.17 -46.04 91.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.127 0.489 . . . . 10.0 109.725 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -78.83 -40.79 31.78 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.432 -0.804 . . . . 10.0 109.653 179.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.15 -52.91 63.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.739 -179.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 62.2 mt -58.85 -44.16 90.92 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -68.15 -38.17 81.83 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.7 -0.481 . . . . 10.0 109.7 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -61.99 -38.68 89.53 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 178.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 32.2 t -66.4 -51.2 60.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-N 115.24 -0.891 . . . . 10.0 109.354 178.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -58.09 -48.53 79.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.767 0.318 . . . . 10.0 111.413 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -67.27 -11.78 58.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.184 -0.462 . . . . 10.0 112.031 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 43.3 mttp -108.19 -33.1 7.24 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.025 0.38 . . . . 10.0 112.025 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 18.9 t -66.21 -37.93 80.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 O-C-N 123.158 0.286 . . . . 10.0 110.653 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -57.38 -60.57 9.33 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 121.011 -0.275 . . . . 10.0 110.742 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -67.06 -24.37 45.13 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 121.679 1.586 . . . . 10.0 111.674 178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -69.02 -48.08 63.85 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 109.35 -0.611 . . . . 10.0 109.35 179.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 24.6 mt -69.41 -27.18 65.06 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.755 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -71.78 -48.89 43.57 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -65.5 -37.42 86.74 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -67.19 -36.56 82.0 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.371 -0.831 . . . . 10.0 109.348 178.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -64.8 -39.42 93.56 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.031 -0.729 . . . . 10.0 109.031 178.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 40.6 mttp -60.88 -48.39 82.01 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.699 -0.852 . . . . 10.0 108.699 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 16.1 mtmm -64.95 -39.24 93.2 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.512 -0.767 . . . . 10.0 110.665 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 1.3 m95 -62.8 -41.02 99.11 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.102 -0.703 . . . . 10.0 109.102 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -49.89 73.55 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.061 -0.718 . . . . 10.0 109.061 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . 0.694 ' O ' ' CG ' ' C' ' 469' ' ' LEU . 42.4 mt-10 -55.96 -44.89 78.9 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.356 179.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -66.11 -52.78 45.46 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.88 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 88.3 mmm -59.63 -48.07 83.13 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.049 0.388 . . . . 10.0 112.049 -179.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -63.96 -46.14 86.0 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.554 -0.536 . . . . 10.0 109.554 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . 1.195 ' CD1' ' CD ' ' A' ' 308' ' ' ARG . 96.4 mt -59.89 -43.23 94.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.623 -0.717 . . . . 20.0 110.659 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 13.0 m-30 -68.49 -36.75 79.38 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.049 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 -63.83 -39.37 94.06 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.329 -0.619 . . . . 10.0 109.329 178.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -81.47 10.44 5.8 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.629 -0.714 . . . . 10.0 111.244 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -124.58 -54.2 1.66 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.281 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 79.2 t -58.15 -43.24 85.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.524 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -60.7 -62.18 6.47 Favored Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 120.966 -0.294 . . . . 10.0 111.75 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.11 -40.1 63.61 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 121.985 1.79 . . . . 10.0 112.057 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 26.0 mt -65.31 -43.91 89.53 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.45 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 38.6 mtt180 -62.38 -39.84 94.5 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 109.665 -0.495 . . . . 10.0 109.665 179.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -63.92 -48.54 76.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.039 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -66.53 -39.83 88.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.489 179.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 23.1 mt -67.47 -32.03 72.59 Favored 'General case' 0 C--O 1.219 -0.552 0 N-CA-C 109.585 -0.524 . . . . 10.0 109.585 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -67.72 -46.95 70.72 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.55 -0.537 . . . . 10.0 109.55 178.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -65.32 -40.51 93.81 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -66.64 -35.58 90.08 Favored Glycine 0 N--CA 1.445 -0.714 0 N-CA-C 110.646 -0.982 . . . . 10.0 110.646 178.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -71.77 -36.78 70.47 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 109.071 -0.715 . . . . 10.0 109.071 178.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -66.35 -37.4 85.23 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -66.06 -42.65 89.17 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 107.91 -1.144 . . . . 10.0 107.91 176.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -65.11 -39.43 93.11 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.596 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 58.5 mt -63.38 -46.63 85.59 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.164 -0.68 . . . . 10.0 109.164 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -60.92 -41.39 96.09 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 108.968 -0.753 . . . . 10.0 108.968 178.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -59.65 -53.2 60.8 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 84.2 mt -56.27 -43.63 78.97 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.908 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -61.96 -51.47 67.96 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.95 -0.389 . . . . 10.0 109.95 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -70.66 -8.64 53.4 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.949 0.722 . . . . 10.0 112.949 -178.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 13.2 mttm -102.13 -49.97 3.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.96 0.409 . . . . 10.0 110.047 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 85.3 mt -71.3 -19.75 62.29 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.972 0.73 . . . . 10.0 112.972 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 68.4 m -71.73 -60.9 2.25 Favored Pre-proline 0 C--N 1.329 -0.29 0 C-N-CA 120.563 -0.455 . . . . 10.0 111.113 178.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -63.38 -37.54 48.85 Favored 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 121.835 1.69 . . . . 10.0 110.851 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 40.8 mt -72.04 -29.73 64.45 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 116.345 -0.389 . . . . 10.0 109.994 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -69.71 -46.82 52.17 Favored Glycine 0 N--CA 1.449 -0.47 0 N-CA-C 110.212 -1.155 . . . . 10.0 110.212 178.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -61.45 -42.2 98.4 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.312 -0.996 . . . . 10.0 108.312 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.64 -44.91 92.47 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 114.955 -1.021 . . . . 10.0 109.882 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 47.4 mmm -61.79 -34.31 75.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.706 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -68.97 -38.33 79.32 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.693 -0.484 . . . . 10.0 109.693 178.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.0 -30.14 61.07 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.932 -0.766 . . . . 10.0 108.932 178.027 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 38.8 mtt180 -64.64 -46.02 84.35 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 107.056 -1.461 . . . . 10.0 107.056 176.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -62.18 -39.07 91.46 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 114.812 -1.085 . . . . 10.0 108.989 178.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 43.0 mtt180 -61.78 -54.16 46.18 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.849 -0.797 . . . . 10.0 108.849 178.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -61.81 -22.42 65.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.349 -0.841 . . . . 10.0 112.766 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -95.24 -52.12 4.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.58 0.229 . . . . 10.0 111.389 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 96.6 t -67.18 -44.26 87.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.46 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -64.87 -33.59 76.37 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.18 -47.29 77.47 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 107.136 -1.431 . . . . 10.0 107.136 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 75.8 mt -61.15 -36.62 80.29 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.177 178.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -62.12 -23.35 66.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.963 0.411 . . . . 10.0 109.965 178.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 1.6 m -113.24 8.31 18.1 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.454 0.645 . . . . 10.0 110.236 179.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -118.15 -47.2 2.58 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.207 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 76.2 mt -82.45 -29.43 30.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.886 -0.597 . . . . 10.0 111.247 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -60.1 -57.86 23.61 Favored Pre-proline 0 C--N 1.331 -0.216 0 C-N-CA 121.094 -0.243 . . . . 10.0 111.009 179.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -66.83 -27.7 43.69 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 121.242 1.294 . . . . 10.0 110.367 178.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -65.51 -45.25 84.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.226 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 4.4 p -70.25 -34.54 72.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.859 0.361 . . . . 10.0 110.06 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.33 -45.53 76.14 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 178.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -61.41 -45.54 93.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.442 -0.947 . . . . 10.0 108.442 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 16.2 mt -61.58 -32.81 72.93 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.506 -0.77 . . . . 10.0 110.726 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 37.7 mtt180 -64.1 -43.06 96.52 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 110.135 -0.32 . . . . 10.0 110.135 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -67.74 -44.35 77.75 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.994 -0.743 . . . . 10.0 108.994 178.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 77.9 mtt180 -61.61 -43.17 99.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.924 -1.034 . . . . 10.0 110.739 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 57.2 mt -69.03 -35.48 76.67 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 116.176 -0.466 . . . . 10.0 110.203 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -63.13 -47.88 80.88 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.591 -0.522 . . . . 10.0 109.591 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -61.92 -40.23 94.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.717 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 -66.73 -40.49 88.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.497 -0.774 . . . . 10.0 110.168 178.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 17.2 mt -62.46 -40.8 97.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.129 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -63.77 -39.44 94.26 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.845 -0.428 . . . . 10.0 109.845 178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -66.13 -40.61 90.78 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 97.3 mt -68.67 -33.43 73.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.262 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -77.06 -37.01 55.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.431 -0.349 . . . . 10.0 111.205 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -64.16 -53.35 50.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.114 0.483 . . . . 10.0 109.706 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -72.75 -32.75 65.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.474 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.43 -45.33 86.49 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.863 -0.684 . . . . 10.0 111.426 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -63.31 -35.64 92.33 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 110.72 -0.952 . . . . 10.0 110.72 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -70.49 -46.02 64.52 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.754 -0.832 . . . . 10.0 108.754 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 48.2 mtt85 -59.81 -36.66 77.21 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.73 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 74.1 mt -60.77 -41.82 96.24 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.605 -0.517 . . . . 10.0 109.605 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.98 -46.49 71.19 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.22 -47.82 82.3 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.503 -0.771 . . . . 10.0 110.151 178.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -61.45 -40.91 96.22 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 116.345 -0.388 . . . . 10.0 110.494 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -63.32 -39.48 94.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.909 0.385 . . . . 10.0 110.177 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -66.99 -46.47 74.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.374 178.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -36.71 84.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.144 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.93 -38.22 90.27 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.588 -0.893 . . . . 10.0 108.588 178.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 91.3 m -65.41 -44.55 87.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.474 -0.785 . . . . 10.0 108.895 178.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -63.43 -41.11 98.68 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.332 -0.618 . . . . 10.0 109.332 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -63.85 -42.64 97.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.778 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 49.3 mt -65.61 -38.24 88.88 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 18.1 m -67.57 -38.45 84.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.388 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 2.9 p -78.29 -9.56 59.29 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.153 0.502 . . . . 10.0 110.162 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 19.4 mt -90.77 -25.33 20.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.785 -0.643 . . . . 10.0 109.434 178.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.9 m -60.89 -37.89 83.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.047 -0.524 . . . . 10.0 109.948 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.79 0.52 15.13 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.583 179.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -117.2 -45.83 2.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.015 0.436 . . . . 10.0 110.521 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -75.47 -8.76 57.56 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.101 -0.5 . . . . 10.0 112.151 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -113.62 -75.73 0.01 OUTLIER Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 113.043 0.757 . . . . 10.0 113.043 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -65.86 -45.16 6.64 Favored 'Trans proline' 0 C--N 1.357 0.989 0 C-N-CA 121.404 1.403 . . . . 10.0 112.355 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.79 -40.98 96.13 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.487 0.184 . . . . 10.0 111.275 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -40.76 96.78 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.863 -0.421 . . . . 10.0 109.863 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -67.84 -35.52 78.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.998 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -66.46 -43.94 84.12 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.749 -0.834 . . . . 10.0 108.749 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.44 -42.97 97.22 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.647 178.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 65.0 mtt180 -63.88 -42.52 97.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.052 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -64.93 -21.96 66.91 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.571 -0.741 . . . . 20.0 111.794 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -89.39 -42.15 5.59 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 109.556 -1.418 . . . . 10.0 109.556 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 54.1 mt -59.25 -41.17 88.15 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.068 0.396 . . . . 10.0 112.068 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 87.9 mt -51.61 -64.38 1.47 Allowed Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 112.716 0.635 . . . . 10.0 112.716 -179.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.46 -32.15 50.11 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.773 1.649 . . . . 10.0 111.964 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 12.1 t -64.41 -48.02 86.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.649 -0.25 . . . . 10.0 110.527 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 49.1 mt -62.24 -37.45 85.48 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.461 -0.57 . . . . 10.0 109.461 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.75 -49.1 76.34 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.758 -0.656 . . . . 10.0 109.919 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 37.3 m -64.34 -37.39 87.33 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.396 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -66.52 -40.16 89.02 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.223 -0.658 . . . . 10.0 109.223 178.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 78.1 mttt -61.11 -43.88 98.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.157 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 97.4 t -59.86 -45.1 95.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 121.197 0.522 . . . . 10.0 109.926 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 9.5 m -68.25 -35.61 78.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.417 -0.81 . . . . 10.0 111.109 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -72.24 -47.0 53.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.234 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 52.0 mt -58.94 -45.38 90.55 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.828 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 9.4 p -63.24 -46.73 85.57 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.568 -0.53 . . . . 10.0 109.568 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -56.18 -45.74 79.64 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.89 179.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 97.2 mt -55.67 -54.14 47.91 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.277 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -62.34 -46.83 86.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 10.0 111.7 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -59.0 -47.95 83.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.463 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -66.32 -43.13 87.03 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.296 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 35.9 m -61.47 -35.91 78.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.743 0.306 . . . . 10.0 111.014 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -64.99 -34.62 78.87 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.952 0.352 . . . . 10.0 111.952 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -92.95 -14.17 27.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.966 0.412 . . . . 10.0 111.776 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 94.0 mt -106.91 34.93 3.2 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.295 0.569 . . . . 10.0 110.16 179.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 60.8 t30 . . . . . 0 C--O 1.246 0.886 0 CA-C-O 118.49 -0.767 . . . . 10.0 110.502 -179.649 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 73.9 mmm . . . . . 0 C--O 1.231 0.118 0 CA-C-O 121.223 0.535 . . . . 10.0 110.856 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 2.9 m -82.23 117.68 22.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.421 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -108.18 132.9 53.15 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.748 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -117.29 142.89 46.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.658 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 50.8 mmtt -101.92 113.43 26.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.518 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 33.4 mt -112.13 125.97 54.69 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.522 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 59.2 t -110.13 122.81 65.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 120.941 -0.303 . . . . 10.0 110.504 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 59.5 t -102.18 108.86 24.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.357 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 9.6 m -109.57 153.53 11.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.543 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 168.76 168.72 31.23 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 111.227 -0.749 . . . . 10.0 111.227 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.2 155.92 37.83 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.253 0.549 . . . . 10.0 111.545 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -66.13 119.3 12.81 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.672 -0.694 . . . . 10.0 111.788 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 124.43 -20.4 6.98 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.706 -0.759 . . . . 10.0 112.605 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 35.6 m -65.28 -24.64 35.47 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.34 45.83 3.96 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.569 -0.824 . . . . 10.0 113.568 178.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -65.12 -44.0 90.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.668 0.27 . . . . 10.0 110.79 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.84 -46.91 84.07 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.084 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.83 -47.75 83.75 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.779 -0.646 . . . . 10.0 111.346 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 25.1 mt -57.68 -46.73 83.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.432 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.4 m -68.64 -47.75 65.8 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.083 -0.508 . . . . 10.0 112.198 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 88.6 mt -62.24 -31.77 52.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-O 120.806 0.336 . . . . 10.0 111.077 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -66.3 -28.11 68.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.112 0.482 . . . . 10.0 110.581 179.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 29.4 tp -86.64 -33.86 19.98 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.934 0.397 . . . . 10.0 110.658 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 46.3 mm -73.0 -78.36 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 112.421 0.526 . . . . 10.0 112.421 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -98.42 -1.05 42.36 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.058 0.392 . . . . 10.0 112.058 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 4.0 t30 60.55 55.29 3.45 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.214 179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -135.72 123.72 22.8 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.761 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -80.88 133.95 35.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.301 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 23.7 m -85.94 166.98 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.54 -0.3 . . . . 10.0 110.482 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -133.58 -17.19 2.28 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.364 0.602 . . . . 10.0 110.898 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 17.0 pm0 -97.68 165.52 11.93 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.464 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -83.23 96.77 8.56 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 178.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -69.54 112.86 13.41 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.78 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -78.88 54.41 5.12 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.894 2.396 . . . . 10.0 111.919 -179.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -56.75 133.38 54.09 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.057 -0.974 . . . . 10.0 112.098 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 79.6 mt -126.34 -53.98 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -154.61 95.01 1.74 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.126 -0.943 . . . . 10.0 108.745 178.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -140.21 124.22 17.54 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.693 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.92 150.05 23.91 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.723 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -131.42 121.74 25.1 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 28.8 ttp85 -118.14 126.5 52.34 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.727 0.298 . . . . 10.0 111.585 -178.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 52.7 tttt -140.92 161.95 36.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.5 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -120.77 127.09 51.64 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 110.11 -0.33 . . . . 10.0 110.11 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 7.3 m -138.83 169.22 18.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.966 0.412 . . . . 10.0 111.021 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 42.2 t -102.66 111.22 31.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 179.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 32.7 mt -111.14 110.73 33.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.919 -178.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 61.65 38.96 14.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.698 -0.683 . . . . 10.0 111.941 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.6 -15.07 56.5 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.832 -0.622 . . . . 10.0 113.816 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -104.36 130.45 52.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 117.118 0.459 . . . . 10.0 111.331 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 1.2 t -75.53 127.68 33.63 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 73.8 m -137.0 139.71 41.62 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-O 121.14 0.495 . . . . 10.0 111.726 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 46.0 tp -95.27 121.04 36.51 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 107.609 -1.256 . . . . 10.0 107.609 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 88.0 mt -108.31 119.83 40.62 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 112.331 0.493 . . . . 10.0 112.331 -178.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -108.49 98.74 8.22 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.117 -1.068 . . . . 10.0 108.117 177.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 10.1 mt -90.57 127.12 43.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.477 -0.783 . . . . 10.0 111.369 -178.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 61.1 tp -102.43 111.74 24.17 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.303 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -104.5 103.07 12.7 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.861 -0.608 . . . . 10.0 109.507 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 11.4 p -105.36 171.58 7.25 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.04 -0.527 . . . . 10.0 112.383 -178.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.96 145.75 52.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 10.0 112.06 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -108.74 25.54 18.83 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.62 -0.718 . . . . 10.0 111.4 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -136.0 34.88 2.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.055 0.455 . . . . 20.0 111.756 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -96.99 143.39 27.89 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.289 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -84.78 -74.18 0.4 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.387 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -158.38 87.32 0.9 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.167 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -105.55 141.19 37.45 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.866 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.34 -35.36 79.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.031 0.443 . . . . 10.0 110.28 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 50.3 ttp -62.76 -39.44 94.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.846 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 46.5 ttt85 -65.89 -46.6 77.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.132 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -55.59 -44.46 76.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.717 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -64.34 -48.65 74.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.781 -0.645 . . . . 10.0 112.377 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . 0.256 0.5 OUTLIER -70.78 -19.6 62.69 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.527 0.936 . . . . 10.0 113.527 -178.795 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 40.7 mmm -74.45 -24.24 59.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.181 0.515 . . . . 10.0 110.081 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -73.47 -30.75 63.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.5 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.3 -5.2 43.45 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.979 0.733 . . . . 10.0 112.979 -179.251 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -87.87 130.78 10.26 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.383 -0.913 . . . . 10.0 111.799 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -80.94 -65.02 1.07 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.743 0.306 . . . . 10.0 110.275 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -103.18 147.75 16.96 Favored Glycine 0 N--CA 1.446 -0.7 0 N-CA-C 111.046 -0.822 . . . . 10.0 111.046 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -123.79 136.22 54.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.268 0.556 . . . . 10.0 111.909 -179.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 79.8 mt -107.61 120.45 42.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.316 179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 18.2 m -92.69 88.7 6.37 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 27.3 t -88.1 116.03 29.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.987 -0.551 . . . . 10.0 112.048 -178.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -129.11 159.68 35.22 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.558 178.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -96.97 132.37 42.83 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 110.129 -0.323 . . . . 10.0 110.129 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 2.5 pt -68.3 -10.94 13.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.91 0.386 . . . . 10.0 111.442 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.25 5.47 34.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.434 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -124.3 104.44 8.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.172 0.511 . . . . 10.0 110.306 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.46 -34.57 78.06 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.579 -0.737 . . . . 10.0 111.875 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -60.55 -41.54 94.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.863 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 11.2 m -63.42 -37.95 89.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.43 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -64.98 -35.43 81.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.022 0.439 . . . . 10.0 110.766 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -80.37 -32.72 37.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.063 0.459 . . . . 10.0 110.574 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -73.91 -7.47 52.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.772 -0.649 . . . . 10.0 112.034 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 23.8 mm -58.91 -37.9 69.9 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 CA-C-O 121.148 0.499 . . . . 10.0 109.985 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 16.0 t-80 -64.0 -33.46 75.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.196 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -62.77 -42.65 99.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.802 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -64.38 -44.79 90.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.084 -0.507 . . . . 10.0 109.695 179.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -56.67 -48.41 77.68 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.309 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -66.39 -41.55 89.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.447 -0.342 . . . . 10.0 111.614 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -60.67 -45.86 92.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.942 0.401 . . . . 10.0 110.691 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 54.3 mt -65.79 -40.89 88.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.802 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 39.3 mtpt -58.15 -37.18 74.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.004 -0.543 . . . . 10.0 111.259 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 59.8 ttp85 -76.98 -47.65 20.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.018 -0.537 . . . . 10.0 112.407 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 32.7 m -66.85 -30.1 48.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 N-CA-C 112.654 0.612 . . . . 10.0 112.654 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -91.72 -12.51 33.78 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 121.112 -0.235 . . . . 10.0 111.382 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 28.0 t0 60.0 34.8 21.5 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.696 0.76 . . . . 10.0 110.971 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 42.9 m -156.43 147.16 21.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.736 -0.665 . . . . 10.0 109.858 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 20.7 mp0 -93.88 -26.67 16.8 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.972 0.415 . . . . 10.0 110.503 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -94.0 77.18 4.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.69 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 57.8 t -120.06 133.38 23.93 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.749 -0.659 . . . . 10.0 110.081 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -59.55 114.97 2.28 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.843 2.362 . . . . 10.0 112.324 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 41.1 mtt -136.71 156.5 48.45 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.386 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 87.0 t -135.38 132.38 52.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 110.049 -0.352 . . . . 10.0 110.049 179.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 19.9 tp -84.53 121.89 28.23 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.381 -0.6 . . . . 10.0 109.381 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 47.7 t -117.11 115.13 47.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.031 0.443 . . . . 10.0 111.769 -178.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.69 97.25 1.76 Allowed Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 110.49 -1.044 . . . . 10.0 110.49 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -87.28 161.41 18.0 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.853 0.359 . . . . 10.0 111.925 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 91.4 mttt 69.54 35.18 2.56 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.336 -0.847 . . . . 10.0 112.148 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 29.1 p -74.33 -12.97 60.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.479 -0.328 . . . . 10.0 111.797 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -81.39 -20.64 40.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.398 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 73.7 mt -67.92 142.42 95.44 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.013 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -61.66 -32.36 86.92 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.914 2.409 . . . . 10.0 111.947 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.87 118.7 17.14 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.33 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 18.0 ttt180 -141.93 115.47 9.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.806 0.336 . . . . 10.0 111.094 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.56 -24.78 11.64 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.571 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 38.5 t -104.34 114.29 43.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.56 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -75.61 152.42 37.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.676 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.2 m -56.75 -42.29 79.04 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.838 -0.619 . . . . 10.0 112.094 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -64.91 -44.7 88.68 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 121.256 -0.178 . . . . 10.0 111.294 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -58.16 -45.97 86.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.851 0.357 . . . . 10.0 110.805 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.6 -44.94 76.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.307 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -62.7 -39.79 95.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.847 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -61.7 -41.29 97.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.342 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 37.8 tp -64.78 -44.19 90.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.009 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.22 -43.98 97.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.184 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -60.35 -36.5 78.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.803 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 20.6 m -66.65 -30.42 70.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.688 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -85.82 -18.18 33.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.582 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.64 28.94 28.12 Favored Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 111.259 -0.736 . . . . 10.0 111.259 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 50.4 pt -128.19 159.07 69.04 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.723 -0.238 . . . . 10.0 110.444 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -82.83 158.36 15.98 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 122.569 2.179 . . . . 10.0 112.42 179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -119.07 124.38 46.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.398 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 23.0 mm -119.13 121.42 66.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.947 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -85.24 123.6 30.92 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.676 -1.231 . . . . 10.0 107.676 177.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 70.1 p -130.09 170.45 14.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.783 0.801 . . . . 10.0 113.073 -176.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 8.7 t -155.44 108.16 2.71 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.672 -1.149 . . . . 10.0 108.495 178.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -66.15 -24.94 66.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.739 0.304 . . . . 10.0 111.611 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 23.1 ttpp -74.85 -35.28 62.38 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.123 0.416 . . . . 10.0 112.123 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 69.6 p -100.68 -7.46 23.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.942 0.401 . . . . 10.0 111.156 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 1.8 ttt-85 67.07 23.3 9.71 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 115.588 -0.733 . . . . 10.0 111.781 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -90.08 127.42 36.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.395 -0.366 . . . . 10.0 111.541 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 75.11 -4.85 37.02 Favored Glycine 0 CA--C 1.52 0.362 0 N-CA-C 114.635 0.614 . . . . 10.0 114.635 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 65.6 t -55.61 -60.91 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 117.1 0.45 . . . . 10.0 111.88 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.88 -34.01 76.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.974 0.416 . . . . 10.0 110.597 -179.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -59.76 -43.35 94.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.696 -0.684 . . . . 10.0 111.383 -179.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -59.64 -45.4 92.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.671 179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -64.52 -43.99 92.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.806 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -59.88 -40.66 89.46 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.915 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 18.4 m -62.99 -43.07 99.81 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.789 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 39.6 tp -60.66 -44.11 96.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.42 . . . . 10.0 111.128 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 58.1 t -61.9 -38.53 80.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.181 0.515 . . . . 10.0 110.332 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -67.09 -33.66 75.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.177 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -68.07 -40.61 82.68 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 109.763 -0.458 . . . . 10.0 109.763 178.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 81.2 mt -62.62 -45.5 98.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.341 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 76.0 mtt180 -61.03 -46.75 89.47 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.671 -0.695 . . . . 10.0 109.709 178.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -54.4 -47.53 72.62 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.674 -0.693 . . . . 10.0 111.42 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -64.65 -45.84 85.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.205 0.446 . . . . 10.0 112.205 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -66.96 -40.31 87.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.264 -0.425 . . . . 10.0 112.098 -179.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -65.6 -43.66 88.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.957 0.408 . . . . 10.0 110.351 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.7 tttm -60.23 -44.58 95.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.024 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 77.0 mtp -66.17 -31.92 73.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.416 -0.356 . . . . 10.0 111.783 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 22.0 m -76.06 -30.78 58.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.679 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -110.73 20.51 17.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.025 0.44 . . . . 10.0 111.108 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -74.0 -67.35 0.61 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.386 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 175.08 73.74 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.213 -0.994 . . . . 10.0 113.278 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -73.21 -48.39 35.49 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.108 0.48 . . . . 10.0 109.766 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.59 -0.44 53.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.457 0.646 . . . . 10.0 109.926 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -86.43 -13.67 45.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.304 -0.862 . . . . 10.0 109.663 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 18.7 mtpt 65.97 62.5 0.61 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.817 -0.628 . . . . 10.0 110.985 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 26.9 tttm -110.56 91.31 3.61 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.523 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 42.7 tttm 62.07 95.15 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.831 0.678 . . . . 10.0 112.831 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -121.29 -57.91 1.82 Allowed 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.468 179.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp 62.15 -160.3 0.31 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.681 -0.691 . . . . 10.0 112.044 -179.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 3.4 m -140.21 -41.23 0.42 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.283 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -99.26 99.78 10.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.936 0.398 . . . . 10.0 111.125 179.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 78.5 m . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.604 -179.611 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 111.779 -0.528 . . . . 10.0 111.779 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 9.3 p -123.79 133.68 53.78 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.598 -0.301 . . . . 10.0 110.561 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 8.8 t -123.45 135.44 63.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.282 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 13.9 pttp -99.99 116.5 32.17 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.073 0.463 . . . . 10.0 111.112 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 32.2 t -96.11 133.36 37.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.571 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.06 134.22 35.33 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.795 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 47.1 mt -99.71 150.28 36.67 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.132 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -67.75 0.64 4.02 Favored 'Trans proline' 0 CA--C 1.534 0.485 0 C-N-CA 122.999 2.466 . . . . 10.0 113.069 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -98.03 17.18 18.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.017 0.437 . . . . 10.0 110.076 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 28.1 tttp 66.89 48.35 1.32 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 115.369 -0.832 . . . . 10.0 110.565 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -150.05 -179.32 7.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.497 -0.774 . . . . 10.0 109.508 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.7 160.76 41.81 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.463 -0.199 . . . . 10.0 110.463 178.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 6.6 t -142.61 132.89 24.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.387 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 57.1 t -91.82 117.68 35.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.076 0.465 . . . . 10.0 111.593 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 27.4 m -115.06 164.16 11.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.072 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.26 135.5 34.42 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.78 0.324 . . . . 10.0 110.948 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 21.3 t -83.04 125.36 40.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 179.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 7.6 mtp180 -121.9 151.45 40.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.867 0.365 . . . . 10.0 110.823 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -91.7 37.38 0.96 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.497 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . -143.78 -66.79 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.449 -0.882 . . . . 10.0 113.047 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 11.5 ptm -58.44 155.62 11.7 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 113.072 0.767 . . . . 10.0 113.072 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.06 178.21 5.34 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.59 -0.732 . . . . 10.0 111.136 -179.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 79.3 t -60.12 -43.36 92.75 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 109.765 -0.457 . . . . 10.0 109.765 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -55.36 -45.2 76.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.278 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -69.16 -48.13 63.11 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.976 -0.557 . . . . 10.0 111.601 -179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 4.3 m -63.78 -40.32 96.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.88 -179.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.89 -9.52 59.27 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 111.902 0.334 . . . . 10.0 111.902 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -62.61 -51.89 65.52 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 120.622 0.249 . . . . 10.0 110.552 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 13.3 mmmt -60.45 -29.99 69.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.947 -0.569 . . . . 10.0 111.22 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -75.66 -42.62 50.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.167 -0.469 . . . . 10.0 111.085 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 30.8 mt -76.14 -41.08 51.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.724 0.297 . . . . 10.0 111.74 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -63.36 -26.27 68.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.431 -0.35 . . . . 10.0 111.259 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -80.52 -17.66 12.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.114 0.483 . . . . 10.0 111.147 -179.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 4.8 mmt180 -106.54 -0.62 23.77 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.37 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 77.5 32.89 45.23 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.762 -0.733 . . . . 10.0 112.105 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 62.5 mt -115.17 161.11 18.87 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.711 0.291 . . . . 10.0 110.745 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -122.38 152.0 40.63 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.112 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 19.0 mp0 -78.42 21.5 0.37 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.906 0.706 . . . . 10.0 112.906 -178.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 37.4 p-10 -95.4 -40.68 9.38 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.422 0.527 . . . . 10.0 112.422 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 62.1 m -109.04 6.66 25.25 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.901 0.334 . . . . 10.0 111.901 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 36.2 m -106.61 144.75 32.82 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.91 0.386 . . . . 10.0 111.006 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 7.3 p -132.82 137.99 52.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.922 -0.581 . . . . 10.0 109.733 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 18.1 t -99.83 139.49 21.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 120.768 0.318 . . . . 10.0 110.636 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -119.23 132.62 55.95 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.987 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -79.21 171.37 15.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.351 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.73 96.23 5.39 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.439 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 33.6 mt -133.36 115.76 23.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.537 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 3.4 mmpt? 63.78 42.38 6.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.663 -0.699 . . . . 10.0 111.681 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 76.66 -31.32 1.46 Allowed Glycine 0 N--CA 1.452 -0.239 0 CA-C-N 115.796 -0.638 . . . . 10.0 113.742 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 857' ' ' ARG . . . . . 0.447 ' NH2' ' N1 ' ' A' ' 37' ' ' 17F . 20.5 mtp180 -91.53 158.4 16.48 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.281 0.562 . . . . 10.0 112.0 -179.166 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -87.68 148.95 24.55 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.455 -0.793 . . . . 10.0 111.223 -179.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 1.3 m -127.99 137.21 52.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.453 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 8.6 t -66.07 130.35 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.688 0.28 . . . . 10.0 111.421 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 2.1 t -127.68 160.79 30.58 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.955 -0.387 . . . . 10.0 109.955 178.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -103.57 159.45 15.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.865 0.364 . . . . 10.0 111.591 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -79.0 -30.8 44.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.038 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.61 -29.76 70.97 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.508 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 2.2 m -64.36 145.51 55.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.417 -179.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -73.5 161.83 29.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.118 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 6.2 tp -93.98 -1.84 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.088 0.471 . . . . 10.0 111.097 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -54.29 -51.8 74.65 Favored Pre-proline 0 CA--C 1.539 0.546 0 N-CA-C 113.582 0.956 . . . . 10.0 113.582 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -79.83 19.34 1.01 Allowed 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 122.466 2.111 . . . . 10.0 113.04 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -107.64 22.22 16.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.258 0.551 . . . . 10.0 110.741 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -87.38 108.12 18.84 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.564 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 127.93 -55.25 0.76 Allowed Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.665 -0.779 . . . . 10.0 112.767 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -85.41 172.06 11.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.833 0.349 . . . . 10.0 111.33 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -118.37 159.2 23.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.253 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 24.8 mt -122.9 154.32 38.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.019 0.438 . . . . 10.0 111.875 -178.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 61.1 mt -126.17 122.29 61.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.222 -0.659 . . . . 10.0 109.222 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 40.3 t -93.18 131.99 38.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.762 0.315 . . . . 10.0 111.146 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.89 162.78 20.38 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.717 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 50.6 t -114.84 133.16 61.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 120.91 0.386 . . . . 10.0 110.652 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 99.2 mt . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.343 -0.837 . . . . 10.0 110.075 179.626 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' 17F . . . . . 0.456 ' N1 ' ' P1 ' ' A' ' 33' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' 17F . . . . . 0.447 ' N1 ' ' NH2' ' D' ' 857' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' 17F . . . . . 0.408 ' C1 ' ' C4 ' ' A' ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 201' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 87.0 mt . . . . . 0 CA--C 1.519 -0.235 0 CA-C-O 121.163 0.506 . . . . 10.0 109.759 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 25.7 mttp -64.48 -27.95 69.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.391 -0.822 . . . . 10.0 110.342 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 39.3 mt -71.06 -32.56 69.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.131 179.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.91 -38.01 85.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.485 . . . . 10.0 109.858 179.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -65.77 -38.59 89.48 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 115.798 -0.637 . . . . 10.0 109.649 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 -72.53 -52.94 13.5 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.217 -0.901 . . . . 10.0 111.147 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 38.4 m0 -57.83 -39.43 77.63 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.56 0.578 . . . . 10.0 112.56 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -59.46 -40.17 86.02 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.033 0.444 . . . . 10.0 110.481 179.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 49.8 m -74.17 -35.66 64.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.183 178.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 77.8 t -63.39 -45.59 97.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.64 179.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 8.6 p -64.69 -46.78 80.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.072 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 2.5 p -62.1 -38.53 89.25 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.887 0.375 . . . . 10.0 110.192 179.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 92.3 m -64.48 -42.81 95.67 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -62.49 -43.08 99.68 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.816 -0.438 . . . . 10.0 109.816 178.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 57.7 m -60.56 -45.9 92.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.125 -0.489 . . . . 10.0 109.918 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 11.2 mmtp -66.12 -34.69 78.62 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.229 -0.442 . . . . 10.0 110.446 178.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 48.1 mt -64.3 -41.95 96.6 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.086 -0.709 . . . . 10.0 109.086 178.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -66.38 -36.05 81.87 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.398 -0.593 . . . . 10.0 109.398 178.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -68.41 -18.72 64.51 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.444 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -93.31 -46.74 7.23 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.529 -0.915 . . . . 10.0 108.529 178.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 89.1 mt -59.35 -35.2 73.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.553 -0.749 . . . . 10.0 111.782 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -53.57 -70.33 0.96 Allowed Glycine 0 C--N 1.332 0.31 0 N-CA-C 111.783 -0.527 . . . . 10.0 111.783 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.6 -33.05 87.68 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.077 1.851 . . . . 10.0 111.266 178.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 2.3 t -59.55 -47.22 91.72 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-N 116.48 -0.327 . . . . 10.0 111.168 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 3.0 p -65.29 -36.61 84.61 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 120.636 -0.426 . . . . 10.0 109.943 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -63.61 -47.16 82.55 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -64.47 -37.96 89.34 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.687 -0.688 . . . . 10.0 109.54 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -66.86 -43.89 82.42 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.289 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 3.3 m95 -60.1 -47.21 86.83 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.662 -0.496 . . . . 10.0 109.662 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.01 -42.59 98.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.458 178.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -62.64 -46.08 89.88 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.274 -0.639 . . . . 10.0 109.274 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 84.4 mt -65.84 -30.13 70.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.222 -0.899 . . . . 10.0 110.598 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -60.89 -49.42 77.55 Favored 'General case' 0 C--O 1.223 -0.314 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 178.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 14.5 mtmm -62.34 -42.14 99.14 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.509 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -65.93 -44.15 85.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.003 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 26.9 p -70.46 -26.69 63.75 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.419 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -69.39 -46.25 67.34 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.369 -0.974 . . . . 10.0 108.369 177.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -63.11 -39.96 98.62 Favored Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 109.732 -1.347 . . . . 10.0 109.732 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 33.6 mt -68.24 -33.82 75.1 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.986 -0.376 . . . . 10.0 109.986 178.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 21.6 mtm180 -65.79 -43.1 89.73 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.13 -0.692 . . . . 10.0 109.13 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -64.98 -41.1 95.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.608 -0.724 . . . . 10.0 109.172 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -65.73 -45.78 81.38 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.298 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 48.1 mmm -60.4 -48.25 82.58 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.964 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.9 p -59.53 -37.82 79.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.054 0.454 . . . . 10.0 111.236 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -78.61 -59.44 2.78 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.17 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -56.23 -50.13 72.18 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.983 0.735 . . . . 10.0 112.983 -178.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 21.4 mt -56.5 -51.59 67.92 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.582 0.23 . . . . 10.0 111.437 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -67.65 -33.01 74.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.531 -0.304 . . . . 10.0 111.355 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.64 -43.5 76.14 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 48.4 t -67.91 -41.91 85.2 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.409 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.867 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 44.0 mttm -64.28 -42.96 96.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.712 0.291 . . . . 10.0 110.826 179.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -64.43 -40.81 96.47 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.109 -0.496 . . . . 10.0 109.945 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 7.7 mtpt -77.93 -21.81 50.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.811 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.55 -26.26 37.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.413 -0.358 . . . . 10.0 110.057 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -62.45 -61.79 6.94 Favored Pre-proline 0 N--CA 1.451 -0.408 0 CA-C-N 115.922 -0.581 . . . . 10.0 109.599 178.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -62.61 -27.06 76.01 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 121.741 1.627 . . . . 10.0 110.818 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -62.13 -60.61 3.35 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.838 -0.801 . . . . 10.0 108.838 178.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 86.5 mt -64.3 -35.01 79.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.915 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -64.55 -55.08 22.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.543 -0.299 . . . . 10.0 110.548 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -64.3 -42.05 96.55 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.325 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 4.7 m-30 -62.04 -38.69 89.68 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.422 -0.354 . . . . 10.0 110.122 178.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -67.81 -43.2 80.19 Favored 'General case' 0 C--O 1.22 -0.471 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -58.99 -49.34 78.26 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -63.94 -55.28 23.68 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.734 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -39.97 80.45 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.049 0.388 . . . . 10.0 112.049 -179.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 43.0 tt0 -63.47 -47.45 81.72 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -64.44 -44.66 90.44 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.724 -0.473 . . . . 10.0 109.724 178.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.11 -38.05 84.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.653 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 14.9 ttt -70.56 -46.27 63.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.061 179.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -63.84 -45.91 87.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.472 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 74.3 mt -63.47 -29.99 71.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.004 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.77 -45.98 48.45 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.103 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -61.62 -37.66 84.76 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.343 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -62.92 -20.4 65.15 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.216 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 51.5 mttp -99.85 -30.86 11.8 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.952 178.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 42.6 t -62.04 -42.56 95.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.879 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -55.77 -59.25 12.02 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 111.695 0.257 . . . . 10.0 111.695 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -66.67 -36.97 23.01 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 121.639 1.559 . . . . 10.0 111.397 178.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 3.0 mt -60.16 -44.76 94.74 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 120.666 0.269 . . . . 10.0 110.722 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 23.2 ttm180 -58.62 -42.14 87.52 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.174 -0.676 . . . . 10.0 109.174 179.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -69.73 -47.87 61.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.842 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -58.25 -47.29 84.03 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.016 0.436 . . . . 10.0 110.399 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 61.1 mt -66.93 -41.6 86.73 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.933 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -62.78 -56.4 17.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.495 0.188 . . . . 10.0 111.335 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -66.33 -41.57 89.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.892 0.377 . . . . 10.0 110.695 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -62.03 -49.43 75.29 Favored Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 111.621 -0.592 . . . . 10.0 111.621 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -67.17 -35.57 79.94 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 109.93 -0.396 . . . . 10.0 109.93 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 39.2 ttm180 -60.42 -45.14 94.68 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 178.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -63.1 -54.18 41.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.061 178.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 73.3 mttt -58.14 -46.42 85.68 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.476 -0.784 . . . . 10.0 111.551 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 60.7 mt -68.53 -42.4 78.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.576 -0.284 . . . . 10.0 111.622 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -61.19 -46.91 88.54 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.35 -0.241 . . . . 10.0 110.35 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -65.75 -36.31 83.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.762 0.315 . . . . 10.0 111.006 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 36.9 mt -69.86 -41.86 74.3 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 178.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -67.66 -37.46 82.42 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.021 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.3 -30.86 70.83 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.913 -0.585 . . . . 10.0 109.602 178.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 18.6 tttp -82.25 -26.24 33.39 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.381 178.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 18.9 mt -67.01 -24.72 66.05 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.719 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 31.4 m -65.85 -63.54 3.19 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.837 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -61.64 -47.08 12.1 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 121.632 1.555 . . . . 10.0 111.732 178.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 80.2 mt -65.24 -28.62 69.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.726 0.298 . . . . 10.0 111.38 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -81.46 -45.58 7.32 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 110.802 -0.919 . . . . 10.0 110.802 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -62.22 -43.41 98.88 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.852 -0.425 . . . . 10.0 109.852 178.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -66.86 -31.72 72.51 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 109.535 -0.543 . . . . 10.0 109.535 178.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 12.9 tpt -67.86 -45.45 74.54 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 178.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 49.5 mtt85 -66.95 -36.21 81.71 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.896 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -64.46 -47.52 78.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.24 178.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 13.0 mmt180 -70.76 -33.32 70.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.168 178.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -63.62 -36.78 84.94 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 35.2 ttm105 -60.3 -50.89 71.85 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.17 -1.048 . . . . 10.0 108.17 177.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.16 88.45 Favored 'General case' 0 C--N 1.331 -0.203 0 O-C-N 123.702 0.626 . . . . 10.0 110.222 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -56.98 -57.61 11.78 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.958 -0.564 . . . . 10.0 109.886 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 47.8 t -68.56 -39.17 80.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.446 -0.797 . . . . 10.0 112.308 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -62.71 -45.69 91.6 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.579 0.228 . . . . 10.0 111.369 -179.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -65.46 -32.05 73.46 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.984 -0.747 . . . . 10.0 108.984 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 36.1 mt -71.88 -34.3 69.08 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 115.223 -0.899 . . . . 10.0 109.809 178.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 64.2 mtt180 -62.58 -49.89 73.47 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.636 -0.505 . . . . 10.0 109.636 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 2.9 m -66.57 -13.38 60.95 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.482 -0.781 . . . . 10.0 111.23 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -100.99 -43.0 6.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.4 -0.364 . . . . 10.0 110.754 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 64.2 mt -67.65 -30.87 70.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.444 -0.344 . . . . 10.0 111.398 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -57.32 -60.86 8.43 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 121.268 -0.173 . . . . 10.0 110.698 179.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -66.16 -38.02 23.01 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.246 1.297 . . . . 10.0 110.385 177.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -55.57 -52.68 62.92 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 111.83 0.307 . . . . 10.0 111.83 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 22.0 p -63.96 -43.68 95.08 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 123.088 0.243 . . . . 10.0 111.603 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -65.88 -41.78 91.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.996 0.427 . . . . 10.0 110.819 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 73.0 mt-10 -70.81 -30.11 66.47 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 13.4 mt -66.34 -35.65 80.89 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 108.231 -1.025 . . . . 10.0 108.231 177.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -64.99 -35.56 81.57 Favored 'General case' 0 C--O 1.223 -0.294 0 N-CA-C 108.676 -0.861 . . . . 10.0 108.676 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -67.48 -41.55 84.42 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.103 -0.703 . . . . 10.0 109.103 178.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 4.6 mtp-105 -65.31 -45.54 83.93 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 108.984 -0.747 . . . . 10.0 108.984 178.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 44.2 mt -64.34 -38.24 90.32 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.89 179.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -63.55 -45.06 92.23 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.92 -44.76 94.12 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.304 -0.628 . . . . 10.0 109.304 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -63.72 -43.27 97.04 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.989 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 55.4 mt -65.18 -44.99 86.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.668 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -59.21 -42.48 91.05 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.572 -0.529 . . . . 10.0 109.572 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -69.83 -39.8 76.26 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.246 -0.65 . . . . 10.0 109.246 178.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 7.0 tp -62.37 -28.66 69.92 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.402 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -70.43 -44.53 67.68 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.844 -0.428 . . . . 10.0 109.844 178.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -71.52 -49.8 37.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.444 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -61.3 -46.57 89.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.363 -0.835 . . . . 10.0 109.938 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -64.95 -44.25 94.79 Favored Glycine 0 N--CA 1.449 -0.5 0 N-CA-C 111.687 -0.565 . . . . 10.0 111.687 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.87 -43.59 97.87 Favored Glycine 0 C--N 1.332 0.309 0 N-CA-C 110.756 -0.938 . . . . 10.0 110.756 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -66.08 -45.01 82.8 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.281 -0.637 . . . . 10.0 109.281 178.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -56.48 -48.46 77.1 Favored 'General case' 0 C--O 1.224 -0.257 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 81.9 mt -61.18 -39.73 91.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.979 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -66.63 -48.81 68.25 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.563 -0.532 . . . . 10.0 109.563 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -59.39 -46.83 87.58 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.898 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -62.42 -42.09 99.18 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.092 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 6.4 m80 -62.43 -43.93 97.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.747 0.308 . . . . 10.0 110.377 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.99 -45.16 94.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.932 0.396 . . . . 10.0 109.947 178.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 11.0 mttp -67.75 -35.89 79.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.877 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.64 -35.88 81.23 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 52.2 m -61.34 -50.86 71.23 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.771 -0.825 . . . . 10.0 108.771 178.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -65.75 -28.14 68.82 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.669 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -64.84 -40.2 94.79 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.249 -1.019 . . . . 10.0 108.249 177.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 83.0 mt -72.82 -41.43 64.91 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.413 -0.812 . . . . 10.0 109.573 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 4.9 m -56.01 -53.87 51.69 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.062 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 61.3 p -70.9 -19.65 62.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.004 -0.543 . . . . 10.0 110.789 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 34.8 tp -68.43 -42.85 78.3 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.393 -0.595 . . . . 10.0 109.393 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.44 -30.32 70.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.271 0.558 . . . . 10.0 109.893 178.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -78.19 5.8 9.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.441 -0.799 . . . . 10.0 111.311 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 27.0 mttp -131.1 -46.38 1.01 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.025 -0.534 . . . . 10.0 109.65 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.17 -11.69 61.07 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.964 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -108.79 -72.77 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.43 0 CA-C-O 119.336 -0.364 . . . . 10.0 111.97 178.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -64.16 -51.32 2.2 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 121.553 1.502 . . . . 10.0 112.862 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -61.98 -42.32 99.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 10.0 111.384 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 9.3 mt -67.39 -36.82 82.08 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.99 -0.284 . . . . 10.0 110.874 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . 0.407 ' O ' ' CG ' ' A' ' 373' ' ' GLN . 68.9 mt-10 -66.66 -35.34 79.93 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.905 -0.776 . . . . 10.0 108.905 177.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -63.94 -47.01 82.17 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.636 -0.876 . . . . 10.0 108.636 178.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 1.5 mt -59.76 -44.48 93.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.309 179.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 58.8 mtt180 -66.79 -42.34 86.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.045 179.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.407 ' CG ' ' O ' ' A' ' 369' ' ' GLU . 98.6 mt-30 -60.96 -34.79 75.3 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.686 -0.688 . . . . 20.0 111.413 178.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -79.19 -35.32 30.5 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 109.583 -1.407 . . . . 10.0 109.583 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 18.8 mt -57.64 -35.49 70.56 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.667 0.247 . . . . 10.0 111.667 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 22.0 mt -56.59 -65.83 1.46 Allowed Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 111.737 0.273 . . . . 10.0 111.737 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -65.22 -33.95 47.23 Favored 'Trans proline' 0 C--N 1.357 1.012 0 C-N-CA 121.72 1.614 . . . . 10.0 111.828 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 19.2 t -62.68 -50.86 78.05 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 N-CA-C 110.429 -0.211 . . . . 10.0 110.429 179.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 56.0 mt -61.84 -35.99 79.87 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -62.99 -52.65 62.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.309 178.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.8 p -61.54 -36.71 81.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.736 0.303 . . . . 10.0 110.482 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -65.92 -43.52 87.87 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 178.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 79.7 mttt -67.04 -39.14 86.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.697 179.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 54.1 t -60.72 -45.74 97.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 109.67 -0.493 . . . . 10.0 109.67 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.0 p -69.34 -41.98 75.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.446 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -63.03 -49.48 74.46 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.597 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 82.8 mt -58.82 -38.39 78.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.968 0.413 . . . . 10.0 111.017 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 14.7 m -72.73 -37.36 67.78 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.12 178.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -70.07 -34.5 73.27 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.931 0.396 . . . . 10.0 110.661 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 70.0 mt -58.87 -47.07 86.2 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.277 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 77.0 mt-10 -68.62 -29.67 68.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.195 0.522 . . . . 10.0 110.039 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.42 -36.92 83.88 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.699 179.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -68.26 -46.57 70.06 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.149 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.2 -30.27 70.97 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.288 -0.415 . . . . 10.0 111.96 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -72.47 -15.67 61.8 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.02 0.438 . . . . 10.0 110.946 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.98 -48.78 5.28 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.518 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 96.6 mt -86.85 59.74 5.82 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.675 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 . . . . . 0 N--CA 1.471 0.586 0 N-CA-C 112.632 0.604 . . . . 10.0 112.632 178.861 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 78.4 mt . . . . . 0 CA--C 1.518 -0.277 0 N-CA-C 109.876 -0.416 . . . . 10.0 109.876 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 1.6 mtmm -60.41 -38.08 82.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.886 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 57.4 mt -64.85 -40.75 95.65 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.379 -0.828 . . . . 10.0 111.152 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 98.4 mt -71.8 -40.4 69.21 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 120.862 0.363 . . . . 10.0 111.238 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.09 -46.62 77.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.448 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -65.19 -38.29 90.03 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 179.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -61.1 -34.88 75.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.437 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -64.81 -45.53 85.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.132 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 1.6 m -61.71 -36.33 80.63 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.092 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 96.9 t -67.01 -37.75 79.99 Favored 'Isoleucine or valine' 0 C--O 1.231 0.107 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 178.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 38.6 m -62.93 -42.6 99.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.737 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 14.5 m -62.44 -30.64 71.38 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 47.1 m -66.81 -33.57 75.91 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.745 178.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -70.52 -38.47 74.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.13 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 2.0 m -63.15 -40.94 99.03 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 36.9 mmtt -69.25 -31.85 70.67 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.033 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 46.1 tp -71.06 -37.92 72.51 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -66.7 -23.32 66.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.631 -0.713 . . . . 10.0 111.03 179.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -64.56 -36.08 83.07 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 108.243 -1.021 . . . . 10.0 108.243 177.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -81.66 -30.03 32.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.033 -0.985 . . . . 10.0 109.277 178.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 71.6 mt -69.27 -11.62 60.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.318 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -97.89 -99.75 2.07 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.159 -0.543 . . . . 10.0 112.038 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -49.44 -43.67 37.6 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.789 2.993 . . . . 10.0 113.769 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 55.1 t -59.66 -46.95 92.78 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-O 120.531 0.205 . . . . 10.0 111.085 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 5.0 m -65.97 -39.65 90.56 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.952 -0.388 . . . . 10.0 109.952 178.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -60.54 -45.72 92.82 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -64.3 -30.88 71.91 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.715 -0.675 . . . . 10.0 109.551 178.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -67.6 -38.17 83.6 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.885 -0.783 . . . . 10.0 108.885 178.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 44.4 m95 -67.05 -41.66 86.13 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 108.178 -1.045 . . . . 10.0 108.178 177.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -60.56 -40.52 91.93 Favored 'General case' 0 C--N 1.333 -0.11 0 N-CA-C 108.349 -0.982 . . . . 10.0 108.349 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -63.95 -46.53 84.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.447 178.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 50.0 mt -61.69 -28.82 69.67 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.106 179.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -64.96 -46.43 81.55 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.612 -0.885 . . . . 10.0 108.612 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -62.64 -40.91 98.5 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 108.405 -0.961 . . . . 10.0 108.405 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -60.08 -55.43 34.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.115 -0.948 . . . . 10.0 110.914 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 3.1 p -59.14 -38.3 79.36 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.967 0.358 . . . . 10.0 111.967 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -63.55 -50.6 68.88 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 110.03 -0.359 . . . . 10.0 110.03 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.8 -48.03 76.57 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.677 -0.773 . . . . 10.0 111.358 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 74.5 mt -57.74 -40.04 78.73 Favored 'General case' 0 C--O 1.22 -0.455 0 O-C-N 123.556 0.21 . . . . 10.0 110.986 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -66.47 -33.56 75.97 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.706 -0.398 . . . . 10.0 110.914 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -67.52 -41.38 84.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.839 -0.8 . . . . 10.0 108.839 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -69.84 -53.48 17.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.328 -0.851 . . . . 10.0 109.77 178.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 80.7 mmm -57.92 -41.04 81.84 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.977 0.732 . . . . 10.0 112.977 -178.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 33.4 p -60.91 -49.91 75.56 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.643 -0.423 . . . . 10.0 110.003 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 8.1 tttt -67.71 -37.92 82.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.741 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.32 -51.52 69.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.285 178.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 85.2 mt -65.98 -37.33 85.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.917 -0.583 . . . . 10.0 111.119 179.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -63.3 -47.13 83.58 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.108 -0.701 . . . . 10.0 109.108 178.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -65.84 -36.0 82.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.594 -0.73 . . . . 10.0 109.308 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.38 -47.12 93.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.871 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 69.7 mttt -66.28 -30.44 70.86 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.962 0.411 . . . . 10.0 110.87 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -86.3 5.29 35.22 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.543 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 37.8 mttp -124.93 -36.67 2.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.703 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.0 -44.52 99.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 110.29 -0.263 . . . . 10.0 110.29 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -59.31 -58.84 16.49 Favored Pre-proline 0 CA--C 1.535 0.365 0 CA-C-N 116.541 -0.3 . . . . 10.0 111.014 179.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -60.65 -34.77 91.78 Favored 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 122.035 1.824 . . . . 10.0 112.013 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -67.17 -50.14 62.2 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.209 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 28.1 mt -64.8 -39.94 94.41 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 110.203 -0.295 . . . . 10.0 110.203 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.73 -47.03 88.11 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -72.73 -34.15 66.89 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.445 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -70.64 -32.33 69.59 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 178.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -62.51 -34.47 76.96 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 178.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 58.4 mttt -66.09 -43.39 87.47 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.542 -0.91 . . . . 10.0 108.542 177.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -60.93 -45.46 94.59 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.448 -0.797 . . . . 10.0 108.975 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -60.68 -39.53 88.82 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.395 178.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -66.97 -49.09 66.49 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 110.095 -0.335 . . . . 10.0 110.095 178.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . 1.226 ' O ' ' CG ' ' C' ' 469' ' ' LEU . 49.0 mt-10 -57.09 -37.5 71.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.816 0.341 . . . . 10.0 110.163 179.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.25 -52.56 10.58 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.903 -0.59 . . . . 10.0 111.078 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 74.3 mmm -60.79 -49.0 79.24 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.615 0.245 . . . . 10.0 111.47 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -67.27 -37.28 83.22 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.679 -0.489 . . . . 10.0 109.679 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . 1.226 ' CG ' ' O ' ' C' ' 465' ' ' GLU . 96.5 mt -61.96 -44.47 96.68 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 115.803 -0.635 . . . . 20.0 109.513 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -70.85 -22.95 62.25 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.497 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 26.9 mtt180 -67.76 -33.85 75.66 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 108.801 -0.814 . . . . 10.0 108.801 178.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -93.04 10.09 32.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.324 -0.853 . . . . 10.0 109.905 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 75.9 mttt -121.46 -67.3 0.98 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.755 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 61.8 t -55.77 -42.2 69.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.01 -0.541 . . . . 10.0 112.229 -178.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -59.93 -62.61 5.55 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 112.293 0.479 . . . . 10.0 112.293 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -64.19 -32.97 62.22 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 121.69 1.594 . . . . 10.0 111.424 179.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 23.6 mt -65.9 -42.72 89.86 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 120.993 -0.283 . . . . 10.0 110.25 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -62.88 -38.22 90.02 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -66.13 -50.73 62.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.892 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.27 -39.48 94.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.785 0.326 . . . . 10.0 110.198 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 17.9 mt -65.57 -33.71 76.54 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 178.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -71.93 -38.91 69.78 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 178.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -64.64 -43.1 94.76 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.352 -0.981 . . . . 10.0 108.352 177.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -69.25 -33.44 73.44 Favored Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 110.826 -0.91 . . . . 10.0 110.826 178.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.77 -45.58 70.99 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 57.0 mtt180 -61.73 -36.68 81.67 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.215 -0.661 . . . . 10.0 109.215 178.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -65.74 -49.32 68.83 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 177.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -63.43 -37.09 85.95 Favored 'General case' 0 C--O 1.226 -0.159 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.276 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 60.4 mt -64.95 -32.33 74.0 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 6.3 m80 -73.87 -43.14 59.5 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.26 -1.015 . . . . 10.0 108.26 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -58.77 -44.1 90.55 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.289 -0.869 . . . . 10.0 109.2 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 90.1 mt -74.95 -39.95 61.06 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 115.431 -0.804 . . . . 10.0 111.703 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -62.57 -44.48 96.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.792 0.33 . . . . 10.0 110.607 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -75.27 4.65 6.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.412 0.625 . . . . 10.0 110.844 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -114.39 -46.33 2.98 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.18 178.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 74.1 mt -63.8 -35.82 81.87 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.992 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 22.9 m -62.68 -59.8 11.67 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 120.67 -0.412 . . . . 10.0 111.253 179.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -65.85 -40.78 15.75 Favored 'Trans proline' 0 C--N 1.356 0.936 0 C-N-CA 121.629 1.552 . . . . 10.0 111.721 178.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 12.8 mt -66.81 -37.07 83.81 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 121.237 -0.185 . . . . 10.0 110.837 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.71 -45.56 92.42 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.06 -1.216 . . . . 10.0 110.06 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -62.69 -42.01 99.41 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.237 -0.653 . . . . 10.0 109.237 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -65.27 -47.67 75.88 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.293 -0.867 . . . . 10.0 109.74 179.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 77.1 mmm -60.98 -36.83 80.47 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.999 -0.371 . . . . 10.0 109.999 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 90.8 mtt180 -62.54 -48.0 81.44 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -65.8 -38.29 88.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.02 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -60.93 -47.99 83.87 Favored 'General case' 0 CA--C 1.522 -0.125 0 N-CA-C 108.291 -1.003 . . . . 10.0 108.291 177.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.95 -42.89 95.05 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.43 -0.805 . . . . 10.0 109.878 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 57.1 mtt180 -59.65 -51.05 71.46 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 109.612 -0.514 . . . . 10.0 109.612 178.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -59.57 -38.38 80.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.157 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -71.27 -56.94 5.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.566 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 75.9 t -61.46 -39.27 82.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.941 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.75 -41.96 98.35 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.9 -36.46 82.31 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.968 -0.752 . . . . 10.0 108.968 178.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 93.1 mt -67.39 -37.78 83.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.258 178.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 83.9 mtt180 -58.43 -56.01 27.63 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.16 0.505 . . . . 10.0 110.256 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.75 22.74 0.46 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.6 0.593 . . . . 10.0 112.6 -179.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -138.95 -43.48 0.47 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 121.87 -0.518 . . . . 10.0 111.562 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 86.0 mt -73.79 -38.43 64.63 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -61.79 -56.39 32.89 Favored Pre-proline 0 CA--C 1.535 0.397 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.373 179.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -62.0 -38.08 60.2 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 121.549 1.499 . . . . 10.0 111.607 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -68.24 -39.28 82.33 Favored 'General case' 0 C--N 1.334 -0.091 0 C-N-CA 120.677 -0.409 . . . . 10.0 111.69 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 10.2 p -66.36 -34.28 77.62 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 109.119 -0.697 . . . . 10.0 109.119 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -68.73 -36.6 78.6 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 177.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -62.79 -44.78 95.29 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 107.64 -1.244 . . . . 10.0 107.64 176.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 93.5 mt -61.89 -43.8 98.1 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 114.962 -1.017 . . . . 10.0 109.69 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 66.2 mtt180 -56.98 -45.66 82.76 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.991 -0.374 . . . . 10.0 109.991 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -62.72 -49.39 75.24 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.169 -0.469 . . . . 10.0 111.043 179.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 52.9 mtt85 -66.32 -42.4 88.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.162 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 67.2 mt -66.16 -33.48 75.87 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.416 -0.356 . . . . 10.0 110.25 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -64.84 -42.82 94.61 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.885 -0.784 . . . . 10.0 108.885 178.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.67 -40.69 84.43 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.621 178.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 24.2 ttm180 -64.38 -42.32 96.22 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 34.8 mt -64.47 -36.95 85.84 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.959 -0.564 . . . . 10.0 109.566 178.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -58.41 -47.82 82.67 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.713 -0.847 . . . . 10.0 108.713 178.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.18 -37.99 89.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.557 -0.747 . . . . 10.0 109.769 178.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 76.7 mt -68.29 -27.03 65.96 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.627 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -81.65 -40.27 23.15 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -68.83 -53.45 21.4 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.517 -0.549 . . . . 10.0 109.517 178.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -66.94 -40.56 87.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.562 179.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -63.46 -45.85 93.91 Favored Glycine 0 C--O 1.226 -0.348 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.989 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -61.33 -40.35 98.5 Favored Glycine 0 N--CA 1.449 -0.441 0 N-CA-C 110.754 -0.938 . . . . 10.0 110.754 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -66.19 -44.65 83.34 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 178.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 69.9 mtt180 -61.46 -39.5 91.07 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.747 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 62.6 mt -61.35 -41.8 97.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.717 0.294 . . . . 10.0 110.569 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -70.58 -38.78 74.09 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.4 -0.593 . . . . 10.0 109.4 178.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -63.22 -49.22 75.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.257 -0.883 . . . . 10.0 109.709 178.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -59.14 -42.52 90.85 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 115.694 -0.684 . . . . 10.0 109.913 178.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.3 m170 -60.83 -48.68 80.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.962 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -62.56 -47.82 82.19 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.864 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.65 -31.66 72.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.138 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.26 -49.98 65.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.251 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.23 -35.24 75.0 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.937 0.399 . . . . 10.0 110.507 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -69.09 -31.46 70.19 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.479 179.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 62.1 m170 -82.74 -26.02 32.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.518 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 82.2 mt -64.48 -35.38 80.74 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.88 -42.57 94.71 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.937 -0.764 . . . . 10.0 108.937 178.432 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.75 -38.39 88.97 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.647 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 51.8 mt -66.32 -34.64 78.45 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 178.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 70.9 m -66.23 -31.4 72.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.582 178.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -64.63 -25.21 67.86 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 121.515 0.674 . . . . 10.0 109.518 178.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.64 -27.36 14.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.532 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -79.47 -27.2 41.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 10.0 112.087 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -105.88 -73.87 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.3 -52.49 3.99 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.279 1.986 . . . . 10.0 112.876 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -63.15 -45.58 91.22 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.672 0.619 . . . . 10.0 112.672 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 12.0 mt -62.57 -36.6 83.19 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.85 -0.34 . . . . 10.0 111.061 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . 0.763 ' O ' ' CG ' ' C' ' 571' ' ' GLN . 53.3 tt0 -67.9 -36.14 79.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.974 -0.75 . . . . 10.0 108.974 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -68.57 -44.4 74.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.487 -0.778 . . . . 10.0 109.323 178.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 77.5 mt -61.42 -46.29 90.74 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.534 179.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 45.5 mtt180 -71.09 -29.35 65.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.92 0.391 . . . . 10.0 110.391 179.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . 0.763 ' CG ' ' O ' ' C' ' 567' ' ' GLU . 99.0 mt-30 -65.3 -29.69 70.48 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.667 -0.697 . . . . 20.0 109.98 178.107 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -90.15 -27.0 22.3 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 109.519 -1.432 . . . . 10.0 109.519 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 14.5 mt -59.12 -43.08 91.92 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.56 0.207 . . . . 10.0 111.56 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 93.8 mt -55.57 -61.04 6.86 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 112.126 0.417 . . . . 10.0 112.126 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -58.85 -35.98 97.72 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 122.092 1.861 . . . . 10.0 111.737 178.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 18.0 t -65.41 -45.21 93.74 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 110.052 -0.351 . . . . 10.0 110.052 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 63.2 mt -63.13 -38.7 92.2 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -65.17 -49.32 70.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.887 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 2.8 p -62.5 -41.39 98.79 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.025 0.44 . . . . 10.0 110.175 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -64.71 -41.02 96.3 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.805 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -61.33 -47.16 87.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.12 178.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 84.1 t -60.43 -42.24 90.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.869 -0.419 . . . . 10.0 109.869 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 20.0 m -64.29 -44.27 92.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.319 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -66.06 -46.64 77.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.842 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 29.5 mt -55.65 -48.48 74.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.803 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 5.1 m -66.56 -42.14 87.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.175 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -61.65 -42.51 99.01 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.287 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 84.7 mt -59.09 -40.82 86.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.06 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -66.62 -38.4 86.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.961 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -72.6 -40.46 66.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.084 0.469 . . . . 10.0 110.853 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 8.4 m-30 -66.25 -44.93 82.3 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.962 -0.563 . . . . 10.0 112.172 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 2.7 p -59.5 -33.48 71.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.81 0.338 . . . . 10.0 111.699 -179.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -69.0 -20.23 64.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.194 0.521 . . . . 10.0 111.349 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.13 -2.93 51.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.891 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 81.9 mt -119.79 16.59 12.7 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.12 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.616 -0.707 . . . . 10.0 109.664 179.811 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.6 ttt . . . . . 0 C--O 1.233 0.234 0 CA-C-O 121.064 0.459 . . . . 10.0 110.321 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.36 132.54 47.24 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.628 -0.715 . . . . 10.0 111.446 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -96.22 124.14 40.11 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.458 -0.571 . . . . 10.0 109.458 178.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -114.76 120.97 41.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.785 0.326 . . . . 10.0 110.452 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.421 ' NZ ' ' O1P' ' A' ' 14' ' ' PCW . 23.9 mtmm -91.01 111.05 22.34 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.248 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 15.0 mt -107.75 119.62 39.95 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.478 -178.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 55.4 t -103.44 124.25 57.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 120.914 0.388 . . . . 10.0 110.632 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 22.9 t -98.8 112.53 31.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.564 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 22.9 m -109.41 161.6 7.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.789 0.328 . . . . 10.0 111.075 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 156.95 -179.67 32.57 Favored Glycine 0 N--CA 1.446 -0.661 0 N-CA-C 111.22 -0.752 . . . . 10.0 111.22 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -83.66 173.87 11.0 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.957 0.408 . . . . 10.0 111.11 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -84.6 118.07 4.64 Favored Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 120.597 -0.811 . . . . 10.0 112.016 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 110.96 -1.94 28.61 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.419 -0.896 . . . . 10.0 112.959 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 27.8 m -73.05 -38.69 56.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 111.996 0.369 . . . . 10.0 111.996 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 113.9 33.72 1.8 Allowed Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.383 -0.913 . . . . 10.0 113.264 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 38.5 mtmt -62.28 -58.79 6.41 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.835 0.35 . . . . 10.0 111.119 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.89 -33.22 68.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.519 -0.764 . . . . 10.0 111.616 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.54 -41.45 94.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.955 0.407 . . . . 10.0 110.273 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 91.5 mt -67.4 -39.23 85.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.012 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 2.1 m -64.42 -49.28 72.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.879 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.08 -31.11 52.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.107 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -68.92 -30.56 69.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.661 0.267 . . . . 10.0 110.906 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.2 tp -87.6 -35.36 18.12 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.182 0.515 . . . . 10.0 111.088 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 43.7 mm -80.83 -55.57 8.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 112.548 0.573 . . . . 10.0 112.548 -178.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 15.3 mt-30 -96.98 -15.58 21.03 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.735 0.642 . . . . 10.0 112.735 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 65.58 29.73 10.88 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.71 0.767 . . . . 10.0 109.208 -178.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -128.76 138.09 51.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.858 -1.064 . . . . 10.0 109.479 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -94.61 139.17 31.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.301 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 m -103.39 114.16 42.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.057 -0.519 . . . . 10.0 110.752 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -91.55 6.82 44.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.343 0.592 . . . . 10.0 109.782 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -94.72 158.73 15.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.306 -0.861 . . . . 10.0 110.207 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -105.43 79.96 1.52 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.0 0.428 . . . . 10.0 110.054 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -98.64 130.81 27.08 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.383 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -69.16 -172.84 0.55 Allowed 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.196 2.598 . . . . 10.0 112.286 179.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -169.94 143.48 2.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.389 -0.369 . . . . 10.0 111.121 -179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 11.5 mt -115.99 -62.58 2.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 108.458 -0.942 . . . . 10.0 108.458 178.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -154.74 92.5 1.48 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.298 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -109.21 160.05 16.42 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.187 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.6 p -148.24 138.3 22.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 112.274 0.472 . . . . 10.0 112.274 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . 0.446 ' CE2' ' CG2' ' D' ' 840' ' ' VAL . 1.5 m-85 -128.55 151.5 49.38 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.847 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -137.25 126.46 24.64 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.521 0.2 . . . . 10.0 110.634 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 8.6 tttm -151.06 141.03 22.02 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.369 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -88.94 135.14 33.7 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.14 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 21.7 m -137.54 167.21 23.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.852 0.358 . . . . 10.0 111.227 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 58.9 t -115.48 114.41 46.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.669 -0.696 . . . . 10.0 109.744 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 46.1 mt -127.27 121.0 56.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.337 -179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 66.25 21.88 10.99 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.432 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.51 -20.39 50.88 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 121.033 -0.604 . . . . 10.0 112.45 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -88.46 150.43 23.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.997 0.427 . . . . 10.0 110.907 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 9.8 t -103.58 137.5 41.57 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 108.505 -0.924 . . . . 10.0 108.505 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 3.6 p -147.84 153.24 38.89 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.954 0.407 . . . . 10.0 111.529 -178.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 26.5 tp -100.93 117.03 34.18 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.619 -0.882 . . . . 10.0 108.619 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 46.7 mt -92.43 120.52 33.0 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.464 0.542 . . . . 10.0 112.464 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -104.77 90.75 3.58 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 106.992 -1.484 . . . . 10.0 106.992 177.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 13.5 mt -84.9 134.56 26.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.729 -0.669 . . . . 10.0 112.055 -177.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 63.7 tp -112.36 111.12 21.76 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.582 -0.735 . . . . 10.0 111.348 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -89.95 91.04 8.42 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.34 -0.985 . . . . 10.0 108.34 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 81.7 p -78.36 171.7 14.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.87 -178.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.04 158.71 27.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.692 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -82.86 -47.83 5.72 Favored Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 110.573 -1.011 . . . . 10.0 110.573 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -127.31 118.99 25.26 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.28 -0.637 . . . . 20.0 109.28 178.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -137.71 166.95 22.7 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.502 -179.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -115.59 -160.49 0.75 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.053 -0.521 . . . . 10.0 109.969 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -71.38 104.56 3.23 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.75 -0.463 . . . . 10.0 109.75 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 68.4 m -136.99 135.49 37.68 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.974 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.96 -33.55 76.08 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.543 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 63.6 mmm -61.65 -41.52 97.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 10.0 109.984 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 58.9 ttt85 -64.18 -45.77 86.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.604 -0.726 . . . . 10.0 110.797 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -62.05 -38.38 88.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.194 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 18.7 tp60 -69.02 -47.4 65.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.626 -0.716 . . . . 10.0 112.099 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . 0.292 0.2 OUTLIER -69.01 -23.18 64.06 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 114.14 1.163 . . . . 10.0 114.14 -178.722 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 55.4 mtm -87.42 -25.67 23.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.198 0.523 . . . . 10.0 110.3 178.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 15.4 ttm180 -67.34 -28.7 68.19 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.914 -0.584 . . . . 10.0 111.363 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -89.63 -1.45 58.02 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.346 0.499 . . . . 10.0 112.346 -179.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.27 149.66 34.27 Favored Glycine 0 C--O 1.237 0.305 0 C-N-CA 120.647 -0.787 . . . . 10.0 113.102 -179.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -102.99 -55.35 2.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.061 0.457 . . . . 10.0 109.873 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -115.01 142.77 17.83 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 110.992 -0.843 . . . . 10.0 110.992 179.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 73.8 m-85 -122.35 126.34 47.83 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.121 0.486 . . . . 10.0 112.155 -178.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 56.5 mt -98.79 117.59 33.61 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.864 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 9.6 m -91.21 91.57 8.27 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 50.0 t -90.01 119.96 38.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.08 0.467 . . . . 10.0 112.167 -178.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -132.12 140.06 48.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.021 178.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -82.77 128.03 34.0 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.829 -0.434 . . . . 10.0 109.829 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 43.1 pt -72.25 -5.9 6.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 112.083 0.401 . . . . 10.0 112.083 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -98.45 1.14 46.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.942 179.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -129.23 119.45 24.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.635 -0.712 . . . . 10.0 110.335 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.67 -38.11 76.94 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 -178.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 52.3 tttp -59.73 -39.12 83.67 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.906 0.384 . . . . 10.0 111.062 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 49.2 m -59.42 -38.18 79.99 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.701 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -68.62 -36.71 79.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.116 0.484 . . . . 10.0 111.115 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -79.82 -30.72 40.54 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.683 -179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.36 -16.28 63.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.19 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 38.7 mm -56.74 -42.29 76.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.677 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -66.6 -36.99 83.94 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.912 0.387 . . . . 10.0 110.223 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -62.82 -39.36 94.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.042 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -78.96 -34.09 44.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.385 -0.371 . . . . 10.0 111.061 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -57.68 -50.01 74.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.314 179.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -68.2 -32.44 72.66 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.993 -0.548 . . . . 10.0 111.026 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -63.38 -47.43 82.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.002 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 55.3 mt -63.13 -35.8 73.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.29 179.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 49.7 mtpt -62.62 -31.4 72.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.513 179.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.01 -20.06 33.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.85 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 15.0 m -87.99 -33.72 6.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.599 -0.441 . . . . 10.0 111.586 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -95.95 -15.84 22.1 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.473 179.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 63.12 48.11 3.89 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.454 -0.794 . . . . 10.0 112.054 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 9.2 t -166.68 164.88 16.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.659 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -101.58 -20.21 15.15 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -91.91 77.15 5.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.626 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 39.6 t -123.43 132.83 24.28 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.26 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -65.71 106.97 0.98 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.852 2.368 . . . . 10.0 111.881 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 61.4 mtt -127.81 152.34 47.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.862 -0.608 . . . . 10.0 109.891 179.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 88.6 t -135.67 127.99 46.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.744 -0.465 . . . . 10.0 109.744 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 18.7 tp -80.43 114.52 19.38 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 45.3 t -111.15 110.23 31.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.518 -178.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -86.35 128.89 9.1 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 109.335 -1.506 . . . . 10.0 109.335 178.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -114.89 155.94 25.92 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 117.42 0.61 . . . . 10.0 112.372 -178.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 80.3 mttt 71.99 46.05 0.37 Allowed 'General case' 0 N--CA 1.462 0.146 0 O-C-N 124.174 0.921 . . . . 10.0 112.65 179.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 26.3 p -79.0 -15.31 58.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.032 0.444 . . . . 10.0 110.642 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -86.22 1.29 51.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.165 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 24.4 mt -100.27 137.09 19.93 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.568 179.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.92 -3.16 13.5 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.914 2.409 . . . . 10.0 112.326 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 13.2 t -85.51 26.47 0.93 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.923 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 -64.52 107.0 1.26 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.052 0.453 . . . . 10.0 111.927 -179.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 2.8 m -97.25 -34.47 11.08 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.762 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 46.5 t -87.41 119.24 34.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.894 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -72.78 153.8 40.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.521 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.25 -41.88 85.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.858 -0.61 . . . . 10.0 112.152 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -69.64 -38.03 77.0 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.308 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -55.39 -45.38 76.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.179 0.514 . . . . 10.0 110.517 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.97 -41.96 77.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.458 -0.792 . . . . 10.0 110.929 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -60.43 -40.68 91.95 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.959 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -62.5 -45.5 92.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.9 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 32.3 tp -62.85 -45.86 90.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.873 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.67 -45.97 90.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.968 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -61.05 -31.8 71.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.516 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 32.3 m -70.8 -29.81 66.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.459 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -93.5 -6.78 46.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.797 0.332 . . . . 10.0 110.879 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 75.09 29.72 60.13 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.976 -0.631 . . . . 10.0 111.843 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 49.0 pt -122.02 154.82 61.44 Favored Pre-proline 0 C--N 1.329 -0.306 0 N-CA-C 110.55 -0.167 . . . . 10.0 110.55 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -80.51 150.96 19.57 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.922 2.415 . . . . 10.0 112.268 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -113.14 121.51 44.74 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.502 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 11.9 mm -118.12 117.9 56.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.54 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -82.9 123.76 29.7 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.023 -1.103 . . . . 10.0 108.023 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 76.3 p -135.89 172.66 12.69 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 113.568 0.951 . . . . 10.0 113.568 -177.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -163.8 121.41 1.81 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 113.953 -1.476 . . . . 10.0 107.635 178.142 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -72.61 -25.63 61.38 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.317 0.488 . . . . 10.0 112.317 -178.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 22.5 tttt -66.26 -47.96 72.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.848 0.356 . . . . 10.0 111.6 -179.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.1 0.82 41.45 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.2 -0.455 . . . . 10.0 111.522 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 18.3 ttt85 54.5 47.81 21.92 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.18 -179.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -90.05 111.85 23.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.609 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 66.94 10.19 55.31 Favored Glycine 0 CA--C 1.519 0.286 0 N-CA-C 114.594 0.598 . . . . 10.0 114.594 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 90.6 t -59.68 -49.15 84.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 117.046 0.423 . . . . 10.0 111.119 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -63.75 -45.01 91.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.301 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -61.64 -38.35 87.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.863 -0.608 . . . . 10.0 112.055 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.92 -50.63 72.69 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.838 0.352 . . . . 10.0 110.915 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -65.81 -41.52 91.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.816 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -63.01 -41.67 99.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.682 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 98.8 m -57.89 -41.5 82.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.798 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 30.3 tp -58.06 -50.75 72.38 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.212 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 39.3 t -62.73 -38.88 82.84 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.458 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 43.7 mtm-85 -61.76 -34.36 75.71 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.495 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -76.42 -37.13 57.52 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.194 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 78.5 mt -64.01 -44.5 97.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.849 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 29.0 ttm180 -59.53 -52.19 66.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.761 0.315 . . . . 10.0 110.646 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -61.19 -33.52 73.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.156 0.503 . . . . 10.0 110.244 179.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -65.09 -39.43 93.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.591 -0.731 . . . . 10.0 111.042 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -70.48 -42.64 71.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.455 -0.338 . . . . 10.0 110.464 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -71.56 -15.46 62.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.265 0.555 . . . . 10.0 110.145 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -80.5 -39.2 28.39 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.957 -0.757 . . . . 10.0 108.957 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 17.0 mmt -67.99 -30.5 69.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.454 -0.794 . . . . 10.0 111.781 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 12.9 m -70.92 -13.18 61.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.782 0.325 . . . . 10.0 111.322 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 54.1 mttp -99.22 -2.4 36.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.83 0.348 . . . . 10.0 110.7 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -87.86 151.34 22.92 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.272 -179.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . -178.6 -139.29 3.45 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.183 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 1.6 ttpm? -79.31 81.12 5.62 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.901 0.381 . . . . 10.0 110.86 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 56.1 tptt -146.96 113.15 5.86 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.835 -0.432 . . . . 10.0 109.835 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . 0.435 ' NZ ' ' N1 ' ' A' ' 38' ' ' 17F . 61.8 tttt -121.53 125.84 47.77 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.11 0.481 . . . . 10.0 110.572 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 4.6 tptp -86.84 -17.72 32.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.835 -0.621 . . . . 10.0 111.406 -179.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -123.75 105.49 9.72 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.108 0.48 . . . . 10.0 111.632 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 19.4 ttmm -96.64 94.04 7.09 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 1.3 m -132.0 102.43 5.82 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.765 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -87.21 38.49 0.82 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.374 0.607 . . . . 10.0 110.259 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 7.5 t -160.1 147.98 16.68 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.771 -0.649 . . . . 10.0 109.86 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -117.25 38.09 3.66 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.209 0.528 . . . . 10.0 110.254 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 7.1 m . . . . . 0 C--N 1.321 -0.631 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.176 -179.552 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.266 0 N-CA-C 111.79 -0.524 . . . . 10.0 111.79 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 36.1 p -121.42 118.08 28.49 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.359 -0.238 . . . . 10.0 110.359 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 3.5 t -101.69 134.23 42.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.036 0.446 . . . . 10.0 111.209 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 38.3 mtpt -83.35 114.54 21.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.653 -0.703 . . . . 10.0 110.326 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 44.4 t -100.88 122.61 53.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -89.86 137.76 32.06 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.462 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 19.4 mt -109.35 147.92 37.0 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 115.647 -0.706 . . . . 10.0 110.782 -178.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -73.93 56.76 3.69 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.322 2.681 . . . . 10.0 111.79 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -163.47 33.48 0.09 Allowed 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 107.975 -1.12 . . . . 10.0 107.975 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 31.3 mtpt 52.51 39.79 28.57 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 114.357 -1.292 . . . . 10.0 111.66 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -139.18 -173.94 3.73 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 113.23 0.826 . . . . 10.0 113.23 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.51 172.02 17.81 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.678 -0.692 . . . . 10.0 112.218 -177.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 12.1 t -150.99 139.26 20.28 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.346 -1.353 . . . . 10.0 107.346 177.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 2.3 t -110.03 107.53 23.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 120.331 -0.548 . . . . 10.0 111.295 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 10.6 t -109.49 143.59 19.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.01 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.57 136.37 39.26 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.521 -0.309 . . . . 10.0 110.73 179.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 59.1 t -89.02 127.45 41.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.917 0.389 . . . . 10.0 110.418 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -131.01 155.23 47.2 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.77 154.13 36.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.007 0.432 . . . . 10.0 110.883 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 95.49 -55.59 1.71 Allowed Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.817 -0.706 . . . . 10.0 113.071 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 10.2 ptm -64.67 147.73 52.42 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.406 0.622 . . . . 10.0 112.483 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.05 177.88 4.96 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.429 -0.805 . . . . 10.0 110.777 -179.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 69.6 t -59.06 -44.54 91.63 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -55.83 -34.23 65.2 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.32 179.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -68.5 -64.58 0.84 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.675 -178.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 1.2 m -61.69 -38.56 88.29 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.382 0.512 . . . . 10.0 112.382 -179.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.4 -17.55 60.17 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.933 0.716 . . . . 10.0 112.933 -178.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -62.13 -48.88 78.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.95 0.405 . . . . 10.0 109.939 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 3.4 mmmm -67.43 -25.93 66.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.362 179.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -81.67 -18.34 44.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.57 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 16.3 mt -99.26 -47.12 5.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.042 0.448 . . . . 10.0 111.007 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 28.9 mmtp -62.01 -27.49 68.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.898 -0.592 . . . . 10.0 111.061 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 840' ' ' VAL . . . . . 0.446 ' CG2' ' CE2' ' B' ' 40' ' ' TYR . 10.1 p -57.73 -22.84 19.09 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 O-C-N 123.739 0.649 . . . . 10.0 111.208 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 2.5 mtp-105 -120.6 10.15 11.0 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.224 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 73.49 33.35 58.59 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.975 -0.631 . . . . 10.0 112.801 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 90.8 mt -104.93 142.69 34.31 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -108.56 153.82 22.83 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.523 -0.308 . . . . 10.0 111.22 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -76.49 51.36 0.72 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.245 0.545 . . . . 10.0 111.795 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -118.79 -71.74 0.72 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.85 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -92.73 32.45 1.24 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.817 -0.629 . . . . 10.0 111.597 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 36.2 m -125.0 137.84 54.23 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.74 -0.467 . . . . 10.0 109.74 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 4.7 p -126.9 137.8 56.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.622 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 43.4 t -101.58 126.85 55.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 121.066 0.46 . . . . 10.0 111.05 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -109.32 144.74 37.08 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.9 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 27.8 mtm180 -92.13 179.43 5.58 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.252 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.32 56.76 1.17 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.333 0.587 . . . . 10.0 110.455 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 61.4 mt -83.21 100.96 7.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.816 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? 63.8 14.37 8.23 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.938 -0.573 . . . . 10.0 111.302 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 102.62 -13.26 56.62 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 121.067 -0.587 . . . . 10.0 111.92 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -83.05 130.53 35.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.007 0.432 . . . . 10.0 110.649 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -84.07 104.37 14.08 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.102 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.95 136.68 41.36 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.962 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 42.3 t -67.07 126.41 26.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.922 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 5.1 m -119.49 142.85 47.91 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -86.89 162.49 17.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.785 0.326 . . . . 10.0 111.591 -178.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 73.0 m95 -78.97 -25.3 43.49 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.886 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -72.95 -22.94 60.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.705 -0.679 . . . . 10.0 111.319 -179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 5.3 m -62.96 146.19 53.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.388 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -78.0 149.79 34.0 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.107 -0.331 . . . . 10.0 110.107 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 7.9 tp -92.0 -10.41 9.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.111 0.481 . . . . 10.0 111.498 -179.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -55.07 -52.68 69.07 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 113.749 1.018 . . . . 10.0 113.749 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -77.51 9.85 2.73 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 121.864 1.709 . . . . 10.0 113.369 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -104.25 4.7 34.09 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.045 0.387 . . . . 10.0 112.045 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -69.22 104.14 2.12 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.501 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 145.17 -13.55 1.87 Allowed Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.05 -1.071 . . . . 10.0 113.811 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -128.42 -174.85 3.34 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 117.554 0.677 . . . . 10.0 112.201 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -109.33 153.05 24.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.142 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 47.8 mt -121.18 128.53 52.56 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.178 -0.305 . . . . 10.0 110.178 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 2.4 mp -113.65 122.23 67.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.835 0.35 . . . . 10.0 110.806 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 17.6 t -106.42 130.13 58.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.1 163.34 24.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.765 0.317 . . . . 10.0 110.962 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 59.0 t -93.24 130.0 42.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.433 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 49.2 mt . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.551 -0.738 . . . . 10.0 110.46 179.54 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PCW . . . . . 0.421 ' O1P' ' NZ ' ' B' ' 5' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' 17F . . . . . 0.435 ' N1 ' ' NZ ' ' B' ' 177' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 201' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 52.6 mt . . . . . 0 C--O 1.236 0.375 0 CA-C-O 120.845 0.355 . . . . 10.0 110.652 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -64.57 -49.4 71.34 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 115.798 -0.637 . . . . 10.0 111.077 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 96.0 mt -77.07 14.63 0.84 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.871 0.367 . . . . 10.0 111.574 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 90.0 mt -113.71 -59.95 1.95 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.357 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -73.31 -38.08 65.97 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.004 0.372 . . . . 10.0 112.004 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -63.97 -41.74 97.47 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 16.8 m0 -69.23 -29.06 66.92 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.409 -0.814 . . . . 10.0 110.565 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -60.71 -48.74 80.45 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 109.177 -0.675 . . . . 10.0 109.177 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.9 m -57.75 -45.7 85.53 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 63.0 t -60.52 -37.51 75.21 Favored 'Isoleucine or valine' 0 C--O 1.231 0.11 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.178 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 24.3 m -61.52 -45.2 95.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.113 -0.494 . . . . 10.0 109.778 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.27 -38.28 89.78 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.743 -0.466 . . . . 10.0 109.743 179.027 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 24.1 m -61.94 -42.91 99.65 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.749 -0.463 . . . . 10.0 109.749 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -63.27 -41.53 99.03 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.372 -0.377 . . . . 10.0 110.201 178.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 14.9 m -64.87 -48.78 73.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.08 -0.509 . . . . 10.0 109.867 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -61.38 -33.31 73.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.762 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 23.9 mt -70.86 -39.4 72.93 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.065 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 38.1 mtt180 -68.1 -39.85 82.75 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -70.07 -12.98 62.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.142 178.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -95.49 -42.79 8.28 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.415 -0.811 . . . . 10.0 108.898 178.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 38.1 mt -59.27 -32.58 70.15 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.119 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -55.28 -69.36 1.29 Allowed Glycine 0 C--N 1.332 0.312 0 N-CA-C 111.244 -0.742 . . . . 10.0 111.244 178.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -59.41 -37.02 92.39 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.316 2.011 . . . . 10.0 111.199 178.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 5.9 t -57.54 -48.86 82.14 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.199 0 CA-C-N 116.523 -0.308 . . . . 10.0 111.242 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 9.5 p -66.14 -38.3 87.82 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.873 -0.331 . . . . 10.0 110.395 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -62.4 -50.92 69.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.451 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -66.95 -38.47 86.18 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.392 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -62.24 -44.73 95.91 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 178.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -70.66 -34.08 71.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.696 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -60.33 -39.36 86.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.508 0.671 . . . . 10.0 109.367 178.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -78.54 -35.05 46.69 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 14.5 mt -61.77 -35.61 78.66 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.406 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -61.58 -47.75 84.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.271 -0.422 . . . . 10.0 109.967 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -64.27 -36.97 85.82 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.048 -0.523 . . . . 10.0 109.66 179.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.15 -49.37 70.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.485 -0.78 . . . . 10.0 110.013 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 3.1 p -67.02 -36.57 82.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.301 -0.409 . . . . 10.0 111.013 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -62.04 -49.64 75.18 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -62.09 -47.58 88.95 Favored Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 111.248 -0.741 . . . . 10.0 111.248 178.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 69.7 mt -62.72 -38.08 89.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.544 0.211 . . . . 10.0 111.329 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 30.2 ttm180 -66.95 -44.03 81.61 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 178.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -61.07 -44.7 96.97 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 108.362 -0.977 . . . . 10.0 108.362 178.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -59.11 -55.88 29.36 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.225 -0.898 . . . . 10.0 109.892 178.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 81.4 mmm -58.57 -35.18 71.97 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 112.763 0.653 . . . . 10.0 112.763 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 51.1 m -62.07 -38.02 87.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.168 0.508 . . . . 10.0 109.762 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -84.15 -40.43 18.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.004 -0.543 . . . . 10.0 109.539 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -56.61 -51.58 68.13 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.068 179.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 52.8 mt -60.02 -41.72 92.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.928 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -66.67 -49.22 66.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.623 -0.262 . . . . 10.0 110.882 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.04 -43.47 98.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.017 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 41.9 t -67.25 -46.95 82.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.577 0 CA-C-N 116.429 -0.35 . . . . 10.0 111.323 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 53.6 mttm -68.15 -47.46 68.01 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.449 0.537 . . . . 10.0 112.449 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.53 -29.95 71.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.553 0.216 . . . . 10.0 111.285 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -92.8 -26.8 17.54 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 121.142 -0.223 . . . . 10.0 111.563 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 1.1 p -64.0 -28.5 45.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.573 0.225 . . . . 10.0 110.922 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -61.33 -62.13 6.54 Favored Pre-proline 0 CA--C 1.533 0.314 0 N-CA-C 109.487 -0.56 . . . . 10.0 109.487 178.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -62.44 -31.6 80.79 Favored 'Trans proline' 0 C--N 1.359 1.114 0 C-N-CA 121.633 1.555 . . . . 10.0 111.262 177.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 5.5 m-30 -62.53 -53.57 52.82 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 178.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 49.1 mt -68.99 -34.3 75.07 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.763 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -59.93 -45.19 93.4 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.976 -0.749 . . . . 10.0 108.976 178.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -63.88 -43.92 94.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.359 -0.837 . . . . 10.0 109.625 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -63.81 -39.74 94.96 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.681 179.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -65.25 -40.08 93.53 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 178.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 39.1 mttp -63.73 -47.24 81.87 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.562 -0.903 . . . . 10.0 108.562 178.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -58.34 -51.33 70.25 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.543 -0.753 . . . . 10.0 109.446 178.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -56.06 -38.65 70.92 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.956 179.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -45.13 91.02 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -61.31 -48.04 83.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.18 -0.464 . . . . 10.0 109.795 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -61.49 -52.58 63.91 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.865 -0.607 . . . . 10.0 111.075 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 89.4 mmm -62.13 -47.7 83.43 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.549 0.574 . . . . 10.0 112.549 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -59.71 -44.78 93.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.498 0.19 . . . . 10.0 110.601 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 41.4 mt -67.43 -37.33 82.87 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.843 -0.428 . . . . 10.0 109.843 178.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -60.42 -50.52 73.25 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.571 -0.529 . . . . 10.0 109.571 178.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.06 -42.24 98.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.244 179.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -61.62 -23.54 66.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.458 -0.792 . . . . 10.0 110.694 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 14.8 mmtp -94.52 -40.6 9.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.673 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 26.0 t -50.61 -44.38 25.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 O-C-N 123.175 0.297 . . . . 10.0 111.784 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -57.18 -62.18 5.71 Favored Pre-proline 0 CA--C 1.536 0.432 0 N-CA-C 113.041 0.756 . . . . 10.0 113.041 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -67.03 -37.94 17.66 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 121.902 1.735 . . . . 10.0 112.344 179.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 33.7 mt -62.77 -42.45 99.69 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.624 0.249 . . . . 10.0 110.423 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 10.5 ttt180 -64.23 -36.46 84.15 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.14 -0.689 . . . . 10.0 109.14 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.56 -42.85 95.4 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.976 -0.556 . . . . 10.0 109.786 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -64.98 -46.37 81.76 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.59 -0.522 . . . . 10.0 109.59 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 89.0 mt -63.75 -40.66 97.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.119 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.48 -50.35 65.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.188 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -58.78 -46.17 88.15 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.557 -0.534 . . . . 10.0 109.557 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.75 -43.93 97.03 Favored Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 111.101 -0.8 . . . . 10.0 111.101 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.3 -44.23 92.26 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 110.585 -0.154 . . . . 10.0 110.585 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 -56.0 -45.41 79.04 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.829 0.347 . . . . 10.0 110.105 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -68.68 -56.82 6.89 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.692 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 37.3 mttt -55.45 -39.49 70.38 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.203 -0.453 . . . . 10.0 112.131 -179.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 39.4 mt -69.88 -43.51 71.69 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.889 -0.411 . . . . 10.0 109.889 178.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 53.5 t60 -65.9 -39.07 90.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.123 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -61.54 -39.38 90.84 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.739 -0.837 . . . . 10.0 108.739 178.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 59.0 mt -69.06 -38.13 78.92 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.218 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -60.69 -41.47 95.22 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.169 0.509 . . . . 10.0 109.906 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -71.5 -4.68 28.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.269 -0.878 . . . . 10.0 111.276 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 9.4 mmtp -111.2 -43.2 3.77 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 178.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 87.8 mt -60.76 -32.16 71.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.021 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 13.1 m -69.36 -63.46 2.03 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 112.052 0.39 . . . . 10.0 112.052 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.03 -46.81 2.08 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 121.902 1.734 . . . . 10.0 112.942 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 89.5 mt -67.64 -32.6 73.41 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.645 -0.502 . . . . 10.0 109.645 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -69.45 -46.47 55.72 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 109.681 -1.368 . . . . 10.0 109.681 178.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -60.15 -42.34 94.69 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -62.36 -44.06 97.36 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.959 178.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 4.1 tpt -64.83 -37.83 88.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.316 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 47.5 mtt180 -69.31 -38.1 78.09 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -65.73 -45.34 83.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.762 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -68.45 -28.41 67.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.654 -0.703 . . . . 10.0 109.386 178.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -67.47 -34.28 76.84 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.692 -0.855 . . . . 10.0 108.692 177.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 74.4 mtt180 -60.83 -49.54 77.08 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 108.432 -0.951 . . . . 10.0 108.432 177.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -66.62 -39.85 88.5 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.69 178.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -54.29 -54.72 36.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.596 -0.729 . . . . 10.0 110.031 178.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 61.7 t -73.05 -38.21 55.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.534 -0.757 . . . . 10.0 111.968 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -58.88 -53.18 61.26 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 110.392 -0.225 . . . . 10.0 110.392 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -60.97 -31.04 70.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.289 0.566 . . . . 10.0 109.918 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 13.6 mt -71.42 -40.91 70.14 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.732 178.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 84.9 mtt180 -64.22 -43.64 94.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.604 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 2.8 m -65.07 -15.53 62.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.616 179.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 12.0 m80 -101.14 -39.76 7.52 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.22 -0.445 . . . . 10.0 110.322 178.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 47.5 mt -60.96 -40.03 91.8 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.593 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.62 -60.59 8.82 Favored Pre-proline 0 CA--C 1.535 0.381 0 O-C-N 123.135 0.272 . . . . 10.0 111.309 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -66.71 -36.3 25.15 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 121.337 1.358 . . . . 10.0 111.517 178.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 -58.68 -48.74 80.06 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.638 0.256 . . . . 10.0 111.035 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 49.7 p -67.59 -38.62 84.27 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -63.52 -40.93 98.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.194 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -64.36 -40.9 96.76 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 108.276 -1.009 . . . . 10.0 108.276 177.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 68.7 mt -63.25 -33.74 76.14 Favored 'General case' 0 C--O 1.221 -0.412 0 CA-C-N 115.386 -0.824 . . . . 10.0 109.604 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -62.59 -42.49 99.6 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -70.43 -47.51 60.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.942 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -61.55 -48.98 78.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.051 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 49.3 mt -62.35 -34.67 77.11 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 116.539 -0.301 . . . . 10.0 110.477 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.9 -47.26 85.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -63.76 -43.23 97.03 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.03 178.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 3.6 mmt85 -58.97 -52.06 67.38 Favored 'General case' 0 C--O 1.227 -0.108 0 N-CA-C 109.425 -0.583 . . . . 10.0 109.425 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 58.1 mt -63.82 -37.38 87.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.36 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -61.5 -45.14 95.49 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.268 -0.271 . . . . 10.0 110.268 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.17 -39.68 86.48 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 82.2 mt -67.53 -19.56 65.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.579 -0.737 . . . . 10.0 111.084 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 33.9 mtpt -91.47 -46.38 8.02 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.633 -0.506 . . . . 10.0 109.633 178.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -58.8 -53.38 59.05 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.983 -0.747 . . . . 10.0 108.983 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -76.17 -23.6 54.73 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.477 178.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -66.71 -46.09 78.55 Favored Glycine 0 CA--C 1.507 -0.455 0 N-CA-C 111.308 -0.717 . . . . 10.0 111.308 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.95 -38.38 95.95 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 110.113 -1.195 . . . . 10.0 110.113 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.13 -43.13 92.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.072 -0.714 . . . . 10.0 109.072 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 -60.19 -49.96 75.57 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.074 178.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 94.8 mt -60.03 -44.39 94.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.42 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.72 -48.16 80.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.032 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -62.03 -36.6 82.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.295 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -66.97 -38.66 86.48 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.543 -0.54 . . . . 10.0 109.543 178.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 34.5 m-70 -66.02 -39.5 90.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 10.0 109.975 178.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -63.88 -47.12 81.91 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.127 -0.694 . . . . 10.0 109.127 178.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 27.7 mttp -66.85 -33.28 75.26 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.762 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.11 -44.61 79.52 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 56.8 m -61.13 -47.32 86.8 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -61.59 -44.53 96.83 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.905 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.35 -48.28 81.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.154 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 62.7 mt -61.11 -35.57 77.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.574 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 19.2 m -63.9 -51.98 62.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.015 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.36 -30.88 71.76 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.087 0.47 . . . . 10.0 110.098 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 19.4 mt -68.23 -35.4 77.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.423 178.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 26.6 p -67.22 -27.73 67.48 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.561 -0.533 . . . . 10.0 109.561 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -77.23 -0.85 26.8 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 115.613 -0.722 . . . . 10.0 110.068 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -116.78 -42.33 2.98 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.396 -0.82 . . . . 10.0 108.823 178.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -63.29 -21.14 66.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.538 -0.756 . . . . 10.0 111.573 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -104.98 -69.24 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.457 0 N-CA-C 112.172 0.434 . . . . 10.0 112.172 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -66.28 -50.33 1.51 Allowed 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.502 2.134 . . . . 10.0 113.319 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.37 93.95 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.678 0.275 . . . . 10.0 111.74 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 13.8 mt -67.11 -35.99 80.96 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.763 -0.375 . . . . 10.0 110.278 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -66.11 -38.2 87.61 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.527 -0.916 . . . . 10.0 108.527 178.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.04 -43.06 96.69 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 178.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 19.0 mt -62.28 -45.58 92.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.601 -0.727 . . . . 10.0 110.638 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 17.9 mtt180 -67.53 -37.84 83.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.943 0.402 . . . . 10.0 109.941 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -67.27 -16.92 64.56 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 115.569 -0.741 . . . . 20.0 111.34 178.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -96.3 -40.36 3.99 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 108.746 -1.742 . . . . 10.0 108.746 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 62.4 mt -58.24 -36.84 73.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.66 -0.27 . . . . 10.0 111.672 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 96.1 mt -59.65 -63.8 3.78 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 120.925 -0.31 . . . . 10.0 111.364 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -61.83 -35.14 80.3 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 121.994 1.796 . . . . 10.0 111.676 178.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 6.1 t -61.26 -49.5 84.33 Favored 'Isoleucine or valine' 0 C--O 1.231 0.108 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 178.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 34.3 mt -63.06 -33.66 75.92 Favored 'General case' 0 C--O 1.224 -0.255 0 N-CA-C 109.759 -0.459 . . . . 10.0 109.759 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.51 -55.51 30.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.017 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.3 p -63.37 -35.45 80.44 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.006 0.432 . . . . 10.0 110.136 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.9 m-30 -63.76 -47.33 81.39 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.144 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -57.8 -40.5 80.07 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 68.8 t -58.09 -50.82 76.86 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.103 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.844 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -66.45 -34.63 78.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.731 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 22.0 m-30 -69.34 -45.58 69.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.904 0.383 . . . . 10.0 110.109 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.45 -38.02 89.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.223 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 3.4 p -74.71 -31.89 61.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.8 0.333 . . . . 10.0 110.906 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -71.16 -34.89 71.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.367 179.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 87.3 mt -59.37 -37.19 77.28 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.256 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -64.43 -45.3 88.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.469 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -61.12 -49.95 75.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.518 -0.765 . . . . 10.0 111.609 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -57.4 -43.87 84.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.708 0.29 . . . . 10.0 111.228 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 27.5 m -63.98 -50.26 69.28 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.277 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -62.99 -38.15 90.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.864 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.69 -40.17 73.06 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.298 -0.41 . . . . 10.0 112.06 -179.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 64.8 mt -68.69 -46.58 68.65 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.059 0.457 . . . . 10.0 110.648 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 11.5 p30 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.236 -179.768 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.5 mm? . . . . . 0 CA--C 1.522 -0.13 0 CA-C-O 121.111 0.482 . . . . 10.0 110.222 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.59 15.81 18.86 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.706 -0.679 . . . . 10.0 109.92 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 92.7 mt -64.51 -31.41 72.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.758 -0.655 . . . . 10.0 110.277 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 85.2 mt -71.67 -31.51 66.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.395 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -67.32 -45.98 74.85 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.892 -0.781 . . . . 10.0 108.892 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -64.31 -40.32 95.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.439 178.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -35.85 79.6 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.328 179.132 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -60.55 -49.18 78.59 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.008 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 1.1 m -59.27 -42.14 90.51 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.936 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 70.8 t -64.41 -44.22 97.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.316 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 30.0 m -62.4 -45.99 90.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.396 -0.366 . . . . 10.0 110.496 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 25.2 m -63.17 -45.55 91.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.467 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 12.8 p -67.14 -36.94 82.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.698 0.285 . . . . 10.0 111.11 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -67.87 -39.72 83.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.994 179.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 47.4 m -64.34 -43.28 95.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.307 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -66.14 -32.42 73.86 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.245 0.545 . . . . 10.0 109.969 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 7.7 mt -65.62 -44.24 87.1 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.067 -0.716 . . . . 10.0 109.067 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -65.6 -34.3 77.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.259 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.58 -40.69 93.04 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -67.56 -33.91 75.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.862 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 85.7 mt -62.11 -12.84 21.58 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-N 115.722 -0.672 . . . . 10.0 111.867 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -74.32 -75.72 0.76 Allowed Glycine 0 CA--C 1.522 0.509 0 C-N-CA 120.494 -0.86 . . . . 10.0 111.058 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -58.33 -39.6 82.82 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 123.12 2.547 . . . . 10.0 112.612 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 49.0 t -59.89 -43.12 91.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 87.8 m -68.44 -39.19 81.59 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.823 -0.436 . . . . 10.0 109.823 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -61.1 -48.31 82.27 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -62.69 -47.72 82.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.36 -0.837 . . . . 10.0 109.783 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -57.59 -41.12 80.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.3 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -67.84 -42.36 81.55 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.175 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -63.59 -37.75 88.5 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.321 -0.622 . . . . 10.0 109.321 179.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -67.84 -43.39 79.62 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.486 -0.779 . . . . 10.0 108.96 178.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 30.5 mt -61.28 -36.57 80.42 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.915 -0.584 . . . . 10.0 109.74 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -67.4 -33.87 76.08 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.241 178.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 56.9 mttp -67.59 -47.78 68.75 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.028 -1.101 . . . . 10.0 108.028 177.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -59.72 -47.6 85.01 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 114.951 -1.022 . . . . 10.0 111.106 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 2.8 p -63.41 -37.37 87.02 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.599 0.238 . . . . 10.0 110.825 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -62.98 -49.51 74.41 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.753 -0.832 . . . . 10.0 108.753 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.48 -46.38 93.94 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.885 -0.886 . . . . 10.0 110.885 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 59.2 mt -59.27 -34.12 71.88 Favored 'General case' 0 C--O 1.222 -0.385 0 CA-C-O 120.503 0.192 . . . . 10.0 110.564 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 52.3 mtt85 -69.24 -36.49 77.23 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 178.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -72.11 -33.02 67.51 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.997 -0.742 . . . . 10.0 108.997 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -71.06 -53.39 14.86 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.182 -0.917 . . . . 10.0 109.197 178.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 64.1 mtt -65.58 -29.16 69.73 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.616 0.969 . . . . 10.0 113.616 -178.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 1.8 p -61.17 -47.46 86.08 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.018 -0.673 . . . . 10.0 109.442 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -78.07 -39.61 41.11 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.954 -0.567 . . . . 10.0 109.855 178.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -56.04 -60.32 3.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.095 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 96.0 mt -60.31 -41.97 94.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.954 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.91 -39.79 90.89 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.851 -0.339 . . . . 10.0 110.91 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.67 -38.08 80.11 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.739 -0.838 . . . . 10.0 108.739 178.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 8.9 t -58.98 -43.42 88.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.292 0 CA-C-N 115.753 -0.658 . . . . 10.0 109.232 178.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -65.97 -40.77 91.54 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 178.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -74.48 -3.97 33.93 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.491 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -106.34 -42.94 4.91 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.412 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 31.3 t -61.77 -41.47 90.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.678 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -55.41 -60.48 8.27 Favored Pre-proline 0 CA--C 1.536 0.433 0 O-C-N 123.164 0.29 . . . . 10.0 111.461 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -67.74 -26.46 38.93 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 122.106 1.871 . . . . 10.0 111.334 178.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -53.11 54.33 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 179.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 68.1 mt -66.31 -38.3 87.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.729 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -59.57 -44.9 93.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.327 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -78.96 -33.6 45.09 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.917 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.85 -43.4 98.91 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 178.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -63.66 -42.18 98.11 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 123.368 0.417 . . . . 10.0 110.051 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -58.8 -43.09 90.42 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.213 0.53 . . . . 10.0 109.621 178.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -72.72 -40.6 65.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.306 -0.861 . . . . 10.0 110.436 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 1.2 m95 -62.49 -38.81 91.35 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.337 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -67.72 -42.97 81.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.161 178.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -62.61 -35.53 79.85 Favored 'General case' 0 C--N 1.333 -0.117 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -76.73 -48.21 19.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.148 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 9.8 ttt -61.4 -57.06 13.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.001 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -65.56 -38.67 90.25 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.252 -0.647 . . . . 10.0 109.252 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 96.4 mt -59.34 -36.27 75.39 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.358 -0.837 . . . . 20.0 109.925 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . 0.403 ' O ' ' N ' ' C' ' 474' ' ' VAL . 3.2 m-30 -77.19 -39.38 48.99 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.62 178.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -60.98 -38.65 86.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.996 0.427 . . . . 10.0 110.189 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -81.4 6.74 13.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.536 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 51.3 mttp -123.0 -50.29 1.93 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.277 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . 0.403 ' N ' ' O ' ' C' ' 470' ' ' TYR . 78.0 t -61.12 -36.89 75.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.691 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.28 -59.49 10.84 Favored Pre-proline 0 CA--C 1.534 0.327 0 N-CA-C 111.758 0.281 . . . . 10.0 111.758 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -60.96 -37.39 77.24 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 121.584 1.523 . . . . 10.0 111.051 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 38.5 mt -67.06 -33.85 76.4 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.006 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 24.9 mtt180 -63.55 -38.61 91.78 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 178.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -64.98 -45.76 84.27 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 178.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.68 -44.18 94.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.716 178.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 63.3 mt -65.92 -41.82 90.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.922 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -63.72 -49.68 72.11 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -65.06 -42.13 94.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.928 0.394 . . . . 10.0 110.278 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.54 -36.42 93.33 Favored Glycine 0 N--CA 1.447 -0.615 0 N-CA-C 111.011 -0.835 . . . . 10.0 111.011 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -76.12 -39.84 54.19 Favored 'General case' 0 C--O 1.219 -0.511 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 63.2 mtt180 -61.89 -43.78 98.16 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.978 -0.749 . . . . 10.0 108.978 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -65.74 -40.06 91.76 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 108.812 -0.81 . . . . 10.0 108.812 178.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -65.77 -34.81 79.04 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 109.614 -0.514 . . . . 10.0 109.614 178.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 57.9 mt -65.48 -41.44 93.29 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.728 -0.841 . . . . 10.0 108.728 178.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -68.55 -40.44 80.65 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.722 -0.844 . . . . 10.0 108.722 178.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -60.29 -44.26 95.52 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 108.521 -0.918 . . . . 10.0 108.521 177.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 46.7 mt -69.87 -33.06 71.73 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.854 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -61.09 -40.14 92.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.924 0.393 . . . . 10.0 110.56 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -79.57 11.66 2.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.586 0.708 . . . . 10.0 110.36 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -125.59 -57.6 1.45 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.628 -0.715 . . . . 10.0 109.806 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 90.2 mt -60.71 -35.22 75.77 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.443 0.534 . . . . 10.0 112.443 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 6.8 m -76.13 -62.84 0.67 Allowed Pre-proline 0 CA--C 1.538 0.517 0 C-N-CA 121.052 -0.259 . . . . 10.0 111.457 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.73 -54.54 2.76 Favored 'Trans proline' 0 C--N 1.357 1.015 0 C-N-CA 122.077 1.851 . . . . 10.0 111.787 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 48.1 mt -65.92 -27.58 68.3 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 109.926 -0.398 . . . . 10.0 109.926 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -65.86 -47.12 77.89 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 110.127 -1.189 . . . . 10.0 110.127 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -64.8 -39.46 93.62 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.879 -0.785 . . . . 10.0 108.879 178.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -61.72 -52.39 64.46 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.64 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 88.0 mmm -58.87 -38.16 78.15 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.359 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -63.79 -45.57 89.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.853 0.359 . . . . 10.0 110.262 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -68.17 -45.52 73.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.696 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -63.73 -43.1 97.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.243 179.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -65.14 -33.42 75.97 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 177.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -62.94 -43.92 97.48 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 108.685 -0.858 . . . . 10.0 108.685 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -65.74 -33.45 75.9 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.657 -0.702 . . . . 10.0 109.36 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -66.76 -51.12 59.55 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.103 -0.703 . . . . 10.0 109.103 178.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 95.9 t -64.25 -42.33 95.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.659 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -61.95 -39.01 90.64 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -64.98 -40.22 94.65 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.332 -0.988 . . . . 10.0 108.332 177.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 87.6 mt -62.29 -29.71 70.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.472 178.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -66.11 -30.68 71.22 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.396 -0.594 . . . . 10.0 109.396 178.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.4 10.94 33.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.605 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 42.6 m170 -122.82 -49.64 1.98 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.332 -0.395 . . . . 10.0 111.435 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 89.8 mt -86.62 -42.77 13.18 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -56.18 -56.3 32.66 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 111.793 0.294 . . . . 10.0 111.793 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -62.99 -29.89 76.05 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 121.857 1.704 . . . . 10.0 110.627 178.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.28 -39.63 94.32 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 15.8 m -62.52 -40.56 97.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.669 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.68 -47.58 74.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.392 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -65.01 -37.08 86.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.615 -0.72 . . . . 10.0 110.804 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 23.8 mt -64.11 -38.41 90.95 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.117 -0.698 . . . . 10.0 109.117 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 50.6 mtt85 -62.94 -37.5 87.28 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.069 178.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -59.87 -42.92 94.78 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 10.0 mtt180 -74.0 -44.44 54.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.103 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 68.0 mt -58.38 -38.82 78.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.031 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.6 -40.15 96.03 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.407 -0.361 . . . . 10.0 110.331 179.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.75 -41.33 79.08 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.127 -0.694 . . . . 10.0 109.127 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 19.1 ttm180 -60.18 -42.29 94.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.357 -0.838 . . . . 10.0 109.108 178.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.68 -32.39 73.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.626 -0.716 . . . . 10.0 110.48 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -67.38 -44.65 78.39 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.57 -39.67 94.98 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.226 178.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 93.8 mt -68.7 -22.73 64.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.748 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -83.15 -47.25 11.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.289 -0.414 . . . . 10.0 109.972 179.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -64.69 -53.73 42.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.184 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -68.13 -43.28 78.72 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.311 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -58.49 -51.12 60.66 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.964 -0.636 . . . . 10.0 111.821 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.43 -41.88 99.74 Favored Glycine 0 N--CA 1.451 -0.361 0 N-CA-C 111.677 -0.569 . . . . 10.0 111.677 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -64.14 -50.35 68.56 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.982 -0.377 . . . . 10.0 109.982 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 50.9 mtt180 -58.3 -35.55 72.0 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.624 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 33.2 mt -62.19 -47.09 86.03 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.696 -0.483 . . . . 10.0 109.696 178.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -64.45 -39.53 93.99 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.89 -0.596 . . . . 10.0 109.635 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 78.9 mt-10 -65.46 -47.69 75.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.777 178.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 15.7 m-30 -60.03 -40.86 90.8 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.323 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 29.8 m-70 -62.63 -46.14 89.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.827 0.346 . . . . 10.0 110.378 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.06 -47.5 77.11 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.354 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.39 -32.24 73.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.636 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.22 -37.1 80.5 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 23.1 m -66.2 -47.44 73.87 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.398 -0.964 . . . . 10.0 108.398 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -61.85 -33.98 75.16 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.717 -0.674 . . . . 10.0 109.521 178.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -74.0 -33.62 63.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.141 179.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 44.0 mt -69.34 -44.02 72.47 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.78 -0.452 . . . . 10.0 109.78 178.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 10.1 m -61.97 -40.73 96.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.471 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 4.6 p -72.87 -17.57 61.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.247 0.546 . . . . 10.0 110.526 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 15.6 mt -87.09 -40.2 14.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.858 -0.61 . . . . 10.0 109.513 178.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.5 p -67.26 -28.03 67.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.217 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -72.75 -5.49 38.16 Favored 'General case' 0 C--N 1.339 0.12 0 CA-C-O 121.405 0.621 . . . . 10.0 110.106 178.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -116.79 -39.3 3.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.241 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -65.87 -16.58 63.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.856 -0.611 . . . . 10.0 111.179 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -103.59 -70.29 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.409 0 CA-C-O 119.311 -0.376 . . . . 10.0 111.199 178.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -64.04 -49.75 3.58 Favored 'Trans proline' 0 C--N 1.36 1.154 0 C-N-CA 122.405 2.07 . . . . 10.0 113.263 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.58 -38.95 92.78 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 121.14 -0.224 . . . . 10.0 111.54 -179.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 7.1 mt -66.64 -38.62 87.26 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -66.63 -36.87 83.62 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 178.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.62 -47.28 84.45 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.742 -0.836 . . . . 10.0 108.742 177.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 89.4 mt -61.59 -40.89 96.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.455 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -65.62 -46.93 77.41 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.015 -0.365 . . . . 10.0 110.015 178.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -65.86 -22.74 66.55 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 115.788 -0.642 . . . . 20.0 111.983 179.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -86.15 -40.09 7.64 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 109.189 -1.564 . . . . 10.0 109.189 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 29.8 mt -64.88 -32.13 73.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.579 -0.31 . . . . 10.0 111.624 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 35.7 mt -54.35 -62.28 4.22 Favored Pre-proline 0 CA--C 1.54 0.581 0 N-CA-C 112.357 0.502 . . . . 10.0 112.357 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -66.05 -31.09 46.72 Favored 'Trans proline' 0 C--N 1.357 0.974 0 C-N-CA 121.966 1.777 . . . . 10.0 111.001 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 11.6 t -64.65 -46.37 92.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.058 -0.519 . . . . 10.0 109.828 179.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 46.3 mt -64.71 -38.6 91.54 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -60.17 -50.84 72.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.55 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 2.7 p -68.27 -38.13 81.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.678 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -60.21 -44.44 95.14 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.246 178.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -62.1 -36.89 83.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.654 178.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 53.2 t -62.29 -46.3 96.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 178.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.63 -34.29 77.88 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.352 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -69.38 -44.44 71.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.287 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 88.0 mt -57.29 -47.2 82.06 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.538 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 1.9 p -68.81 -46.15 69.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.613 179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -57.8 -54.0 51.88 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.441 -0.345 . . . . 10.0 111.743 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 88.9 mt -57.66 -41.06 80.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.804 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -71.4 -51.59 23.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.583 -0.28 . . . . 10.0 111.725 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -62.24 -40.69 97.0 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.944 0.35 . . . . 10.0 111.944 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -64.46 -48.74 74.14 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.919 0.34 . . . . 10.0 111.919 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 11.8 p -63.18 -36.48 83.76 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 111.949 0.352 . . . . 10.0 111.949 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -63.8 -28.55 69.94 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.453 -0.34 . . . . 10.0 111.092 179.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -95.15 -15.49 23.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.428 -0.351 . . . . 10.0 111.504 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 60.9 mt -80.19 -25.07 39.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.293 -0.412 . . . . 10.0 111.381 179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.793 -0.623 . . . . 10.0 109.759 179.989 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 16.7 ptp . . . . . 0 C--O 1.233 0.234 0 N-CA-C 110.283 -0.266 . . . . 10.0 110.283 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.92 138.32 50.49 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.027 0.441 . . . . 10.0 111.317 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -115.32 130.61 56.95 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.047 -0.723 . . . . 10.0 109.047 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -122.26 136.38 54.89 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.851 0.357 . . . . 10.0 110.91 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt -107.52 114.37 28.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.372 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 14.2 mt -109.47 132.1 54.45 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.389 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 67.2 t -121.44 125.92 74.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.965 0.412 . . . . 10.0 110.916 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 3.6 t -93.19 113.14 27.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 20.9 m -96.72 168.43 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.993 0.425 . . . . 10.0 111.801 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 131.65 161.0 9.99 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 110.873 -0.891 . . . . 10.0 110.873 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.12 -140.55 0.07 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.891 0.376 . . . . 10.0 110.89 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -101.69 159.51 18.33 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.69 -0.767 . . . . 10.0 111.684 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.97 -24.54 15.13 Favored Glycine 0 CA--C 1.519 0.311 0 C-N-CA 121.048 -0.596 . . . . 10.0 113.004 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 3.3 m -60.65 -50.74 79.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 112.317 0.488 . . . . 10.0 112.317 -179.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 105.23 35.84 3.04 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.783 -0.722 . . . . 10.0 113.351 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -59.49 -54.06 50.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.166 0.508 . . . . 10.0 111.255 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.62 -37.65 76.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.593 -0.731 . . . . 10.0 111.863 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.72 -44.79 92.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.339 -0.392 . . . . 10.0 110.997 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 99.1 mt -66.98 -33.26 75.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.055 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.1 m -71.15 -49.55 42.81 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.991 -0.549 . . . . 10.0 111.357 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 85.2 mt -63.31 -29.97 48.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.184 0.516 . . . . 10.0 110.43 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -66.75 -16.78 64.49 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.623 -0.717 . . . . 10.0 111.107 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 18.7 tp -106.5 -31.45 8.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.07 0.462 . . . . 10.0 110.901 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 51.1 mm -76.04 -49.6 25.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.704 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -115.35 -8.97 12.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.764 0.316 . . . . 10.0 111.201 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 20.8 m120 65.83 41.53 3.8 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.317 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -133.75 142.79 48.09 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.018 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -99.97 137.23 38.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.491 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 19.1 m -89.87 159.55 2.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.906 0.384 . . . . 10.0 111.558 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -121.73 -19.92 6.63 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.351 0.596 . . . . 10.0 110.256 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -93.47 156.9 16.49 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.271 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -86.28 104.83 16.18 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 110.111 -0.329 . . . . 10.0 110.111 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -77.54 115.77 52.43 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.757 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -78.31 62.59 8.16 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 123.24 2.626 . . . . 10.0 110.47 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.01 130.97 49.08 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.291 -0.868 . . . . 10.0 112.118 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 74.3 mt -121.42 -53.12 3.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.106 -0.952 . . . . 10.0 108.566 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.28 104.79 3.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.514 -0.767 . . . . 10.0 109.345 179.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -159.0 137.5 10.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.423 -0.353 . . . . 10.0 111.269 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 15.4 m -135.76 149.63 49.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.812 0.339 . . . . 10.0 111.137 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -126.07 142.31 51.57 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 30.2 ttp180 -129.06 133.05 47.54 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 111.838 0.31 . . . . 10.0 111.838 -178.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 30.1 mtpt -143.56 175.0 10.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.872 -0.604 . . . . 10.0 110.417 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -115.11 120.27 39.23 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 39.2 t -131.01 132.93 63.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.67 0.272 . . . . 10.0 110.651 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 38.9 t -78.61 111.66 15.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 108.635 -0.876 . . . . 10.0 108.635 178.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 38.3 mt -114.28 117.7 56.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 120.883 0.373 . . . . 10.0 111.17 -178.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 35.9 m-20 59.85 32.08 21.08 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.476 -0.783 . . . . 10.0 111.076 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.07 -29.93 7.13 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.69 -0.687 . . . . 10.0 113.004 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -84.8 146.59 27.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.906 0.384 . . . . 10.0 111.286 -179.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 14.8 t -102.86 139.19 38.75 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.899 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 3.0 p -154.12 158.45 40.44 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.316 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 96.6 mt -93.67 120.56 34.1 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.235 -0.654 . . . . 10.0 109.235 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 63.7 mt -105.86 124.19 49.18 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.533 0.568 . . . . 10.0 112.533 -178.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -107.77 110.49 22.32 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 107.591 -1.262 . . . . 10.0 107.591 177.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 22.8 mt -99.94 114.92 39.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 120.836 0.35 . . . . 10.0 111.489 -178.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 26.4 tp -94.49 112.13 23.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.931 -0.577 . . . . 10.0 111.147 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -93.67 94.83 8.81 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 178.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 37.6 p -67.51 161.74 24.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.174 -0.921 . . . . 10.0 113.157 -177.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.61 165.24 12.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.578 -0.737 . . . . 10.0 111.112 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -84.28 -80.72 1.05 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.832 -0.699 . . . . 10.0 111.957 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -92.35 114.42 26.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.841 0.353 . . . . 20.0 110.718 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -150.05 160.93 43.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.493 -0.321 . . . . 10.0 110.22 -179.546 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 55.7 mm-40 -106.45 -170.61 1.75 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.009 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -80.12 76.75 6.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.201 0.524 . . . . 10.0 111.195 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.39 147.72 23.91 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.821 179.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.29 -35.63 77.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.9 0.381 . . . . 10.0 110.997 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 27.7 ttt -62.42 -37.02 84.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.794 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 55.8 ttt85 -60.95 -51.8 67.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.815 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.05 -35.35 78.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.776 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -61.17 -41.14 96.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.595 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 2.5 p90 -84.09 -24.71 30.23 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 112.837 0.68 . . . . 10.0 112.837 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 53.1 mmm -76.36 -24.56 54.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.069 0.461 . . . . 10.0 111.242 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -79.73 -0.3 33.61 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.675 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.58 2.05 44.31 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.735 0.643 . . . . 10.0 112.735 -179.2 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -107.06 152.57 16.89 Favored Glycine 0 N--CA 1.454 -0.154 0 C-N-CA 120.248 -0.977 . . . . 10.0 113.108 -179.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -99.86 -60.6 1.5 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.964 0.411 . . . . 10.0 110.19 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -99.79 139.59 14.5 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.654 -0.703 . . . . 10.0 111.993 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -125.26 131.08 53.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.925 0.393 . . . . 10.0 111.082 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 77.6 mt -99.88 122.46 42.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.977 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 32.5 m -95.37 86.24 4.46 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.816 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 22.0 t -87.29 122.82 39.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.243 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -130.04 169.3 15.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.41 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -104.94 123.16 47.28 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.504 179.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 2.3 pp -68.29 -10.97 13.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 112.01 0.374 . . . . 10.0 112.01 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -102.95 10.96 37.97 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.373 -0.376 . . . . 10.0 111.46 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -136.83 104.29 5.45 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.93 -38.21 75.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.791 -0.64 . . . . 10.0 112.008 -178.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -63.0 -39.48 94.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.702 0.287 . . . . 10.0 110.992 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 24.0 t -60.19 -37.56 80.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.969 -0.559 . . . . 10.0 110.644 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -71.21 -39.28 71.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.395 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -66.86 -33.38 75.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.003 0.43 . . . . 10.0 111.145 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.24 -8.23 53.66 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.283 0.475 . . . . 10.0 112.283 -178.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 25.8 mm -60.84 -35.83 67.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.109 0.48 . . . . 10.0 110.04 178.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 6.6 t-80 -68.63 -29.95 68.55 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -68.86 -44.12 74.01 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.091 -0.707 . . . . 10.0 109.091 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -64.41 -43.87 93.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.6 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -54.87 -51.78 64.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.268 -0.878 . . . . 10.0 111.181 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -66.93 -37.39 84.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.354 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -60.35 -46.94 88.13 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.484 -0.325 . . . . 10.0 110.213 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 52.6 mt -66.69 -43.34 90.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.815 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 33.7 mtpt -59.0 -35.98 74.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.856 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 45.9 ttp85 -77.05 -46.38 23.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.872 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 21.1 m -63.39 -28.17 44.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -95.03 -11.53 28.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.53 -0.305 . . . . 10.0 111.004 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 16.9 t70 60.73 21.06 11.09 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.383 0.611 . . . . 10.0 111.099 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 14.0 m -144.74 140.38 28.49 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.268 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 -84.95 -20.0 31.29 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.317 0.58 . . . . 10.0 109.849 179.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -89.16 78.01 7.44 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.233 -0.894 . . . . 10.0 110.322 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 89.5 t -127.07 130.63 23.73 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.529 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -64.74 112.36 1.96 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.967 2.445 . . . . 10.0 111.607 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 54.1 mtt -130.21 158.27 40.19 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.598 -0.519 . . . . 10.0 109.598 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 84.3 t -137.31 129.72 42.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 15.2 tp -82.44 117.74 22.7 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.808 -0.812 . . . . 10.0 108.808 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 38.7 t -109.75 111.49 36.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 120.94 0.4 . . . . 10.0 111.984 -178.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -91.86 88.08 1.33 Allowed Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 110.375 -1.09 . . . . 10.0 110.375 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -87.46 162.9 17.01 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 -178.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 28.3 mttm 67.72 32.84 5.2 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.242 -0.89 . . . . 10.0 111.731 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 28.0 p -85.8 6.71 26.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.288 0.566 . . . . 10.0 110.32 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.69 -21.73 26.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.987 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 82.3 mt -77.61 142.17 65.91 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.429 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.35 -19.91 55.43 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.945 2.43 . . . . 10.0 112.151 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 1.7 m -83.04 105.19 13.82 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 179.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -127.72 109.91 12.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.968 0.413 . . . . 10.0 111.657 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.05 -42.08 9.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.053 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 30.2 t -87.36 115.44 27.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.685 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -80.16 154.29 28.09 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.289 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.9 m -60.23 -33.92 72.95 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.694 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -61.88 -37.72 85.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.061 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -68.18 -41.63 81.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.179 0.514 . . . . 10.0 110.084 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.99 -48.11 69.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.286 -0.87 . . . . 10.0 111.482 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -61.81 -38.03 86.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.956 0.408 . . . . 10.0 110.53 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -62.06 -51.5 67.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.744 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 55.6 tp -64.59 -41.77 96.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.003 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.76 -41.21 95.01 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.686 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -63.39 -40.23 96.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.41 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 12.9 m -66.03 -37.76 86.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.646 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 7.3 m-30 -73.87 -29.63 62.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.701 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 88.71 28.39 21.7 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 110.643 -0.983 . . . . 10.0 110.643 -178.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 46.0 pt -126.41 154.55 74.95 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.439 -0.38 . . . . 10.0 110.461 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.21 157.05 29.85 Favored 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.448 2.098 . . . . 10.0 111.756 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -119.57 126.89 52.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.606 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 36.6 mm -124.41 128.24 73.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.361 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -87.87 125.94 34.76 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.37 -0.974 . . . . 10.0 108.37 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 40.6 p -123.3 138.13 54.69 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 113.323 0.86 . . . . 10.0 113.323 -177.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 7.7 t -107.47 125.17 50.92 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.094 -1.076 . . . . 10.0 108.094 178.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.24 -26.44 52.6 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.233 0.54 . . . . 10.0 110.41 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 46.5 tttp -77.26 -48.29 17.89 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.504 -0.771 . . . . 10.0 112.787 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 72.3 p -98.2 -10.99 23.21 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.629 0.603 . . . . 10.0 112.629 -178.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 15.2 mtp-105 70.95 13.87 6.95 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 122.823 0.449 . . . . 10.0 111.329 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -62.93 123.52 18.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.306 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 81.06 -13.78 30.29 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.938 -0.574 . . . . 10.0 113.97 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 86.9 t -61.71 -42.84 95.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.436 0.532 . . . . 10.0 112.436 -178.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -66.75 -48.26 69.67 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.852 0.316 . . . . 10.0 111.852 -179.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -66.77 -26.34 66.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.433 -0.349 . . . . 10.0 111.606 -179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.8 -47.69 85.19 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.966 0.413 . . . . 10.0 110.034 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -66.57 -40.14 88.82 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.958 178.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 19.3 m-30 -63.45 -45.39 91.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.065 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 69.8 m -57.79 -41.92 83.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.81 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 41.5 tp -57.66 -47.59 81.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.448 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.31 -36.42 76.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.232 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 77.7 mtt180 -66.8 -38.0 85.64 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.509 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -65.05 -40.85 95.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.834 178.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 70.7 mt -61.25 -40.99 87.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.98 179.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.93 -40.0 95.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.038 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 28.5 mtmt -61.34 -33.62 73.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.097 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 24.3 t-80 -65.0 -39.11 92.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.066 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -69.01 -45.61 70.08 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.963 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -65.86 -47.03 76.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.963 -0.562 . . . . 10.0 111.938 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 54.5 tttm -56.66 -45.16 81.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.671 0.272 . . . . 10.0 111.533 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -65.85 -26.18 67.54 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 111.899 0.333 . . . . 10.0 111.899 -179.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 14.7 m -82.83 -23.44 33.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.808 0.337 . . . . 10.0 111.794 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp -114.24 14.08 18.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.691 -178.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.05 1.98 14.06 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 83.88 58.38 2.25 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.917 -0.659 . . . . 10.0 112.862 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 17.4 mttp -86.21 -30.79 22.14 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.914 0.388 . . . . 10.0 111.345 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -76.61 -8.5 57.36 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.185 0.517 . . . . 10.0 110.901 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -106.03 7.85 32.08 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.029 179.268 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 39.0 mtpt 55.51 56.44 6.27 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.146 -0.934 . . . . 10.0 112.486 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 1.6 ttpm? -91.11 87.11 6.43 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.081 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 30.0 tttm 75.74 85.36 0.09 Allowed 'General case' 0 N--CA 1.469 0.487 0 O-C-N 124.095 0.872 . . . . 10.0 112.396 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 4.0 m -119.2 -56.29 2.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.898 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt 64.54 166.94 0.16 Allowed 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.735 0.643 . . . . 10.0 112.735 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.28 -5.18 56.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.112 -0.495 . . . . 10.0 111.213 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -160.76 132.46 5.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.582 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 71.7 m . . . . . 0 C--N 1.325 -0.469 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.789 179.492 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.44 0 N-CA-C 111.955 -0.458 . . . . 10.0 111.955 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 6.7 p -123.59 135.47 53.99 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.709 0.29 . . . . 10.0 110.972 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 6.8 t -118.5 133.85 64.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 110.206 -0.294 . . . . 10.0 110.206 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 14.9 mtmt -87.69 112.92 22.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.485 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 39.1 t -91.52 124.78 44.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 109.736 -0.468 . . . . 10.0 109.736 179.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -88.97 115.01 26.22 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.765 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 83.0 mt -88.86 143.01 30.94 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.272 -179.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -68.44 -9.26 25.45 Favored 'Trans proline' 0 N--CA 1.476 0.451 0 C-N-CA 123.213 2.609 . . . . 10.0 112.666 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -88.39 18.59 4.37 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.735 -0.468 . . . . 10.0 109.735 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 817' ' ' LYS . . . . . 0.402 ' NZ ' ' O1P' ' A' ' 6' ' ' PCW . 26.4 mttt 61.87 47.29 6.14 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.547 0.689 . . . . 10.0 110.838 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -146.1 -177.19 5.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.758 -1.11 . . . . 10.0 108.639 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.92 165.23 37.35 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.952 -0.299 . . . . 10.0 111.351 -179.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 9.7 t -151.21 152.29 33.07 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.584 179.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 90.1 t -112.82 120.34 62.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 120.971 0.415 . . . . 10.0 110.934 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 31.3 m -113.13 157.51 13.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.612 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.21 133.09 35.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.621 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 13.1 t -86.98 109.29 18.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.556 -0.293 . . . . 10.0 110.328 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 -127.47 150.38 49.68 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -79.76 164.19 23.88 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 120.886 0.374 . . . . 10.0 110.696 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 89.25 -56.73 3.95 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 121.041 -0.599 . . . . 10.0 112.591 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 16.4 ptm -65.36 139.92 58.61 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.11 0.481 . . . . 10.0 111.268 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.3 172.99 8.04 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.611 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 90.5 t -60.83 -35.52 65.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.119 -0.697 . . . . 10.0 109.119 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -58.68 -38.37 78.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.514 -0.766 . . . . 10.0 110.255 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -67.04 -58.49 4.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.958 -0.564 . . . . 10.0 111.444 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 1.3 m -61.27 -42.62 98.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.705 -0.68 . . . . 10.0 112.747 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.68 -24.14 59.92 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.96 0.356 . . . . 10.0 111.96 -179.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -59.45 -49.67 76.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.978 0.418 . . . . 10.0 110.605 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -60.69 -32.96 72.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.532 -0.758 . . . . 10.0 111.523 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -78.89 -33.4 45.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.774 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 90.1 mt -81.82 -43.79 17.8 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -179.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 5.3 mmtp -61.79 -36.71 81.88 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 -179.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 3.4 p -72.49 -14.19 16.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.063 0.459 . . . . 10.0 111.459 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 -105.02 -6.58 19.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.215 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 83.9 26.59 40.86 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.803 -0.713 . . . . 10.0 112.478 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 8.1 mp -117.5 158.5 24.42 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.101 -0.333 . . . . 10.0 110.101 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -123.99 164.27 19.69 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -79.32 50.07 1.05 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.897 0.38 . . . . 10.0 110.562 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -102.8 -74.57 0.63 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.462 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 75.3 m -87.03 -16.96 34.09 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.793 -0.639 . . . . 10.0 111.237 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 29.3 m -66.85 134.31 51.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.207 -0.452 . . . . 10.0 111.355 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 7.0 p -130.81 140.42 48.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.452 -0.573 . . . . 10.0 109.452 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 15.4 t -109.67 131.82 59.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.098 0.475 . . . . 10.0 111.584 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -117.48 157.21 26.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.356 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -110.35 153.79 24.44 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.021 -0.733 . . . . 10.0 109.021 178.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 27.3 mt -105.04 51.86 0.75 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.853 0.359 . . . . 10.0 111.856 -178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 18.1 mt -72.29 86.95 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.398 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt 67.29 41.16 2.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.963 -1.017 . . . . 10.0 112.377 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 86.42 -33.17 3.71 Favored Glycine 0 C--N 1.332 0.312 0 CA-C-N 115.914 -0.584 . . . . 10.0 113.852 178.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 23.1 mmt-85 -70.58 114.34 8.58 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.783 0.325 . . . . 10.0 111.376 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.94 100.14 0.7 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.804 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 1.4 m -97.38 112.73 24.43 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.105 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 2.0 t -58.17 150.88 4.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.989 -0.551 . . . . 10.0 110.799 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 4.3 t -137.53 166.72 23.22 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.34 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -106.67 160.25 15.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.681 0.277 . . . . 10.0 110.701 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 73.3 m95 -76.86 -27.65 55.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.014 0.435 . . . . 10.0 110.688 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.33 -36.44 82.19 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.385 -0.825 . . . . 10.0 111.688 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.52 142.16 40.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.928 -0.578 . . . . 10.0 111.53 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -78.16 162.12 26.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.831 -0.433 . . . . 10.0 109.831 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 8.3 tp -87.7 1.66 6.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.118 0.485 . . . . 10.0 111.242 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -60.17 -53.21 67.21 Favored Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 113.688 0.995 . . . . 10.0 113.688 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.68 18.29 1.0 Allowed 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.222 1.948 . . . . 10.0 112.974 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -106.99 20.57 18.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.386 0.612 . . . . 10.0 110.585 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -67.0 107.68 2.34 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.902 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 89.96 15.13 58.29 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.877 -0.677 . . . . 10.0 112.214 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -102.11 148.91 24.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.511 0.196 . . . . 10.0 110.544 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -105.88 109.38 21.31 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 62.3 mt -87.26 118.21 26.53 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.286 0.476 . . . . 10.0 112.286 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 32.3 mt -103.18 114.59 43.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.499 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 18.6 t -102.83 126.31 57.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.978 -0.379 . . . . 10.0 109.978 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -123.66 164.86 18.24 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.162 179.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 48.5 t -112.13 108.63 26.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.856 0.36 . . . . 10.0 110.182 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 68.3 mt . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.266 -0.873 . . . . 10.0 109.798 179.288 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PCW . . . . . 0.409 ' N ' ' N1 ' ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PCW . . . . . 0.402 ' O1P' ' NZ ' ' D' ' 817' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' 17F . . . . . 0.409 ' N1 ' ' N ' ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 201' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 74.1 mt . . . . . 0 CA--C 1.521 -0.143 0 CA-C-O 120.919 0.39 . . . . 10.0 110.103 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -74.64 -17.47 60.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.287 0.565 . . . . 10.0 109.632 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 90.7 mt -69.26 -25.77 64.44 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.535 -0.757 . . . . 10.0 109.56 178.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 74.7 mt -69.77 -40.93 75.78 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.784 -0.643 . . . . 10.0 109.624 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.47 -36.07 82.79 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 178.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 41.0 t-20 -65.22 -52.7 52.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.273 -0.876 . . . . 10.0 109.094 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 4.2 m0 -58.61 -38.98 79.17 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.984 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -60.96 -39.63 90.26 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.128 0.49 . . . . 10.0 110.241 178.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 17.8 m -68.78 -22.25 64.29 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.572 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 90.5 t -85.13 -42.41 16.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.747 -0.66 . . . . 10.0 110.081 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.6 -33.43 75.88 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 121.066 -0.254 . . . . 10.0 110.868 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 13.6 p -71.81 -37.54 70.35 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.794 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.49 -37.12 71.31 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.977 -0.379 . . . . 10.0 109.977 179.049 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -64.53 -39.67 94.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.864 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 1.7 p -70.24 -42.76 71.78 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.486 -0.561 . . . . 10.0 109.486 178.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 20.2 mmtp -62.14 -32.54 73.14 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.553 178.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 14.7 mt -72.29 -49.16 36.86 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.426 -0.807 . . . . 10.0 109.98 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 8.2 ttm180 -60.3 -43.19 96.53 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.665 -0.243 . . . . 10.0 111.337 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -62.06 -21.26 64.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.251 -0.432 . . . . 10.0 111.283 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -99.66 -30.08 12.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.086 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 38.9 mt -64.09 -34.55 78.29 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.392 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -55.44 -68.44 1.69 Allowed Glycine 0 N--CA 1.451 -0.348 0 N-CA-C 110.287 -1.125 . . . . 10.0 110.287 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -55.07 -38.71 93.32 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.429 2.086 . . . . 10.0 111.353 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 5.7 t -58.31 -48.69 84.24 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 120.37 0.129 . . . . 10.0 111.118 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 9.3 p -66.78 -36.53 82.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.841 0.353 . . . . 10.0 110.504 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -65.8 -51.06 62.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.134 -0.485 . . . . 10.0 109.785 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -61.24 -44.06 97.87 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.124 179.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -63.25 -47.45 82.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.042 179.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 2.4 m95 -63.06 -42.2 99.63 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.714 -0.221 . . . . 10.0 110.807 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -69.05 -41.46 77.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.803 0.335 . . . . 10.0 110.475 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -61.98 -45.08 95.19 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.352 -0.981 . . . . 10.0 108.352 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 65.4 mt -67.94 -32.76 73.43 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.382 -0.826 . . . . 10.0 110.118 178.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -60.52 -45.68 92.94 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 109.598 -0.519 . . . . 10.0 109.598 178.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 31.0 mttt -60.73 -42.57 97.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.33 178.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -66.14 -47.38 74.25 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.415 -0.811 . . . . 10.0 110.495 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 22.7 p -63.85 -38.19 90.18 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 116.873 -0.149 . . . . 10.0 111.317 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -63.66 -47.88 79.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.995 0.426 . . . . 10.0 109.908 179.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -61.58 -47.04 92.88 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 109.573 -1.411 . . . . 10.0 109.573 178.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 28.6 mt -59.98 -35.16 74.4 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 115.435 -0.383 . . . . 10.0 110.96 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 59.5 mtt180 -66.96 -42.14 85.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.934 0.397 . . . . 10.0 110.141 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -67.47 -43.25 81.45 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.108 -0.701 . . . . 10.0 109.108 178.374 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -64.42 -44.95 89.62 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 115.441 -0.799 . . . . 10.0 109.965 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 27.6 mmm -61.7 -30.48 70.78 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.337 179.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 70.7 m -63.91 -48.66 75.74 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 108.272 -1.01 . . . . 10.0 108.272 178.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -66.09 -44.55 84.07 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.07 -60.17 3.69 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 115.398 -0.819 . . . . 10.0 110.076 179.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 82.7 mt -61.64 -50.54 72.13 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.077 -0.51 . . . . 10.0 112.193 -179.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -57.28 -52.23 66.17 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.038 0.385 . . . . 10.0 112.038 -178.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -67.11 -42.19 84.94 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.63 0.233 . . . . 10.0 111.63 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 24.5 t -65.37 -43.03 94.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.365 0 C-N-CA 121.156 -0.218 . . . . 10.0 111.215 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -66.6 -48.53 69.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.772 0.32 . . . . 10.0 110.806 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -60.28 -42.9 96.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.647 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -75.63 -29.06 59.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.41 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -57.82 -31.85 41.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.593 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -60.75 -66.45 1.53 Allowed Pre-proline 0 N--CA 1.448 -0.525 0 CA-C-O 119.036 -0.506 . . . . 10.0 111.132 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.05 -31.95 83.79 Favored 'Trans proline' 0 C--N 1.357 0.998 0 C-N-CA 121.637 1.558 . . . . 10.0 112.053 178.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 5.5 m-30 -61.16 -50.3 73.74 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 120.741 0.305 . . . . 10.0 110.421 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 97.5 mt -80.63 -33.66 35.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.482 . . . . 10.0 111.179 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -64.31 -49.43 71.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.58 -0.282 . . . . 10.0 111.104 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -66.85 -39.19 87.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.06 0.457 . . . . 10.0 109.864 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.35 -31.33 72.49 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.066 -0.716 . . . . 10.0 109.066 178.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -69.0 -40.81 78.48 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.006 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -56.09 -48.05 76.87 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.093 -1.077 . . . . 10.0 108.093 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -63.86 -47.78 79.36 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.564 -1.198 . . . . 10.0 110.157 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -37.22 75.53 Favored 'General case' 0 N--CA 1.464 0.239 0 O-C-N 123.314 0.384 . . . . 10.0 111.204 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -62.99 -49.64 73.87 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.995 -0.743 . . . . 10.0 108.995 178.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -63.47 -38.35 90.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 10.0 109.667 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -60.47 -52.93 63.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.522 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 81.0 mmm -66.18 -42.69 88.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.473 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -65.15 -48.73 72.5 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.549 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 45.5 mt -64.59 -35.85 82.31 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -62.13 -49.93 73.9 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 54.8 mtt85 -65.34 -41.21 94.14 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.709 0.29 . . . . 10.0 110.415 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.39 -31.67 67.89 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.488 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -90.5 -42.25 10.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.021 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 5.6 t -53.53 -44.73 57.5 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.404 0 N-CA-C 112.255 0.465 . . . . 10.0 112.255 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -53.66 -62.0 4.34 Favored Pre-proline 0 CA--C 1.542 0.646 0 N-CA-C 112.556 0.576 . . . . 10.0 112.556 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -65.56 -36.84 31.93 Favored 'Trans proline' 0 C--N 1.353 0.816 0 C-N-CA 121.906 1.737 . . . . 10.0 112.287 178.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 58.1 mt -65.14 -34.22 77.87 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.098 0.475 . . . . 10.0 109.969 179.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 26.2 ttt180 -70.21 -35.13 73.69 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 108.065 -1.087 . . . . 10.0 108.065 178.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.75 -40.77 95.85 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.189 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -62.96 -43.04 99.89 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.704 -0.85 . . . . 10.0 108.704 178.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 63.9 mt -63.36 -37.62 87.99 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.429 -0.805 . . . . 10.0 109.918 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -68.3 -50.69 51.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.442 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -60.98 -43.53 98.67 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.37 -44.63 96.56 Favored Glycine 0 N--CA 1.438 -1.176 0 N-CA-C 110.486 -1.046 . . . . 10.0 110.486 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.82 -37.98 86.43 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 110.545 -0.169 . . . . 10.0 110.545 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -60.66 -42.26 96.66 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.765 -0.457 . . . . 10.0 109.765 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 11.1 tm0? -70.89 -49.82 41.72 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.751 -0.658 . . . . 10.0 109.713 178.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 46.8 mttt -56.68 -41.24 76.98 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.836 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 17.6 mt -70.52 -39.28 74.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.399 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.07 -41.23 99.4 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.4 -34.44 75.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.664 178.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 86.5 mt -75.51 -42.15 53.5 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.441 -0.799 . . . . 10.0 109.55 178.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -62.12 -39.19 91.7 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.393 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -77.5 14.98 0.86 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.745 178.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 23.8 mttp -133.07 -42.14 0.89 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.49 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 93.3 mt -58.05 -32.67 68.23 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.361 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 3.1 m -82.57 -62.32 0.31 Allowed Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.46 -49.92 8.02 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 121.832 1.688 . . . . 10.0 112.597 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 98.2 mt -75.8 -13.12 60.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.006 0.431 . . . . 10.0 110.271 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -83.63 -47.92 5.46 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 109.815 -1.314 . . . . 10.0 109.815 178.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 57.5 mt-10 -61.1 -44.94 96.59 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -64.4 -39.15 93.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.366 179.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 16.2 tpt -64.28 -39.3 93.65 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.228 -0.656 . . . . 10.0 109.228 178.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -70.29 -39.83 74.62 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.284 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -65.07 -43.71 91.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.958 0.408 . . . . 10.0 110.432 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . 0.703 ' CD ' ' CD2' ' C' ' 469' ' ' LEU . 11.7 mtp180 -69.92 -28.67 65.79 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.255 -0.646 . . . . 10.0 109.255 178.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -71.81 -29.82 64.84 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 77.9 mtt180 -62.58 -52.96 61.35 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.437 -0.949 . . . . 10.0 108.437 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -64.18 -35.36 80.53 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -57.08 -56.77 17.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.452 -0.794 . . . . 10.0 110.243 179.01 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 47.6 t -75.65 -39.69 39.76 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 CA-C-N 115.731 -0.668 . . . . 10.0 112.15 -179.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.96 -51.0 71.56 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 122.419 -0.176 . . . . 10.0 111.111 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -64.23 -26.43 68.5 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.351 -0.611 . . . . 10.0 109.351 178.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 5.2 mt -71.79 -37.75 70.38 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 178.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -63.27 -49.94 72.12 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.32 -11.83 45.74 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.779 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -98.34 -41.58 7.77 Favored 'General case' 0 C--O 1.223 -0.331 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 178.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 86.4 mt -65.6 -34.24 77.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.973 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -55.31 -61.66 5.67 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.498 -0.319 . . . . 10.0 111.587 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -66.86 -30.06 40.85 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.597 1.531 . . . . 10.0 111.541 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -63.79 -50.35 69.33 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 110.023 -0.362 . . . . 10.0 110.023 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 18.7 p -70.64 -34.54 72.17 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 110.181 -0.304 . . . . 10.0 110.181 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -59.05 -53.84 53.82 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -70.09 -29.41 66.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.69 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 9.3 mt -63.2 -39.13 93.74 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.422 -0.585 . . . . 10.0 109.422 178.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 38.3 mtt180 -64.56 -35.26 80.4 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 109.492 -0.559 . . . . 10.0 109.492 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -69.84 -45.63 67.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.832 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -63.5 -44.54 94.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.785 -0.643 . . . . 10.0 109.879 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 60.2 mt -65.31 -36.93 85.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.046 178.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -64.43 -44.84 89.91 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.22 -0.659 . . . . 10.0 109.22 178.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -60.45 -44.42 95.84 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.944 178.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -63.33 -52.14 63.09 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-N 115.773 -0.648 . . . . 10.0 110.335 179.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 79.5 mt -60.25 -36.73 78.43 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.853 0.358 . . . . 10.0 111.054 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -67.39 -44.39 78.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.243 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.51 -46.66 72.22 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 82.8 mt -63.99 -19.54 65.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.16 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 12.9 ttmt -67.56 -48.15 67.77 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.671 -0.863 . . . . 10.0 108.671 178.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -77.87 -41.99 34.94 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -56.93 -48.97 77.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.804 -1.089 . . . . 10.0 109.629 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -76.77 -35.79 39.04 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.496 -0.775 . . . . 10.0 111.693 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.25 -47.94 88.6 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.761 -0.733 . . . . 10.0 111.329 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -66.97 -38.78 86.71 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 -61.43 -41.71 97.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.116 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 75.6 mt -63.4 -40.9 98.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.905 -0.589 . . . . 10.0 109.725 179.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -65.47 -41.08 93.72 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -60.48 -53.28 59.4 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.575 -0.739 . . . . 10.0 109.537 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -63.92 -28.92 70.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.444 -0.798 . . . . 10.0 111.636 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.91 -50.42 29.29 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.112 -0.329 . . . . 10.0 110.112 179.05 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.99 98.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.957 0.408 . . . . 10.0 110.09 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 8.1 mtmm -70.13 -23.55 63.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.066 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -70.09 -39.69 75.4 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -38.3 90.58 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.04 -0.726 . . . . 10.0 109.04 178.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -66.87 -38.0 85.5 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.18 -0.674 . . . . 10.0 109.18 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -62.68 -49.49 74.93 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 115.623 -0.717 . . . . 10.0 109.494 178.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 84.5 mt -61.13 -39.65 90.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.343 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 50.3 m -63.46 -52.87 59.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.534 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 3.2 p -67.15 -26.0 66.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.206 0.527 . . . . 10.0 110.751 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 20.6 tp -74.11 -37.63 64.07 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 72.6 m -64.63 -29.88 70.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.11 0.481 . . . . 10.0 109.982 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -70.05 -7.54 42.02 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.122 178.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 34.0 mttp -115.92 -32.87 5.29 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.709 -0.678 . . . . 10.0 109.356 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.38 -24.78 63.01 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.664 -0.698 . . . . 10.0 111.105 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -106.79 -71.72 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 112.134 0.42 . . . . 10.0 112.134 179.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -59.11 -53.87 3.22 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 122.194 1.93 . . . . 10.0 113.028 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -62.77 -48.16 80.36 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.824 0.305 . . . . 10.0 111.824 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 9.9 mt -62.04 -37.29 84.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.804 0.335 . . . . 10.0 110.731 179.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -65.35 -44.62 87.11 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.51 -37.61 88.15 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 42.0 mt -63.32 -43.6 97.34 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 57.7 mtt180 -64.93 -38.21 90.22 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 108.359 -0.978 . . . . 10.0 108.359 178.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -65.61 -21.57 66.59 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.205 -0.907 . . . . 20.0 112.157 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -93.15 -37.35 5.69 Favored Glycine 0 CA--C 1.523 0.594 0 N-CA-C 108.75 -1.74 . . . . 10.0 108.75 178.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 49.1 mt -59.45 -37.8 79.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.811 -0.195 . . . . 10.0 111.433 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 75.8 mt -56.09 -62.43 4.75 Favored Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 112.038 0.384 . . . . 10.0 112.038 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -64.1 -34.81 56.44 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 121.983 1.789 . . . . 10.0 112.037 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 25.3 t -63.66 -54.57 30.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.517 0.199 . . . . 10.0 110.811 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 36.3 mt -63.35 -35.84 81.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.637 0.256 . . . . 10.0 110.921 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -64.5 -51.01 65.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.554 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 12.6 p -65.28 -36.95 85.68 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.768 0.318 . . . . 10.0 110.879 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -68.31 -36.24 79.02 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.69 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 49.6 mttt -65.8 -37.2 85.63 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.682 -0.488 . . . . 10.0 109.682 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 87.2 t -63.49 -44.24 98.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.084 178.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.35 -37.91 71.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.086 -0.507 . . . . 10.0 110.907 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -67.68 -45.9 73.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.516 -0.311 . . . . 10.0 111.139 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 34.6 mt -59.97 -45.38 92.88 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.998 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 77.4 p -70.76 -28.86 65.0 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.715 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -69.2 -38.45 78.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.087 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 95.8 mt -57.51 -40.98 79.92 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.478 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -60.63 -46.02 91.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.667 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -41.51 97.67 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.341 -0.845 . . . . 10.0 111.666 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -60.85 -44.29 97.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.063 0.459 . . . . 10.0 109.788 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 8.9 m -60.46 -39.3 87.08 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.487 -0.779 . . . . 10.0 111.45 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 87.2 mttt -60.88 -28.45 68.89 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.738 -179.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.18 -20.26 28.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.858 0.361 . . . . 10.0 111.618 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 76.7 mt -85.23 -50.07 7.68 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.127 -0.488 . . . . 10.0 109.949 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 30.6 p30 . . . . . 0 N--CA 1.466 0.339 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.215 179.729 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 41.0 tp . . . . . 0 C--O 1.231 0.128 0 CA-C-O 121.219 0.533 . . . . 10.0 109.563 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -74.64 -27.14 60.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.412 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 11.3 mt -61.23 -27.1 68.2 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.799 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 77.0 mt -62.61 -42.09 99.38 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -71.03 -31.75 68.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.962 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -64.88 -48.23 75.0 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.637 -0.875 . . . . 10.0 108.637 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 47.4 m0 -63.72 -37.01 85.75 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.522 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.18 -45.61 87.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.551 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 31.0 m -63.81 -36.63 84.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.738 -0.664 . . . . 10.0 109.997 178.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 89.3 t -67.46 -33.74 64.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 24.2 m -66.17 -40.17 90.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.736 -0.665 . . . . 10.0 109.215 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 7.4 m -66.78 -37.17 84.04 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.494 -0.928 . . . . 10.0 108.494 177.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 76.6 m -63.18 -44.32 95.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.158 -0.928 . . . . 10.0 109.671 178.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -61.26 -38.35 86.41 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.306 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 32.2 m -62.33 -41.84 98.89 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.802 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -66.11 -31.86 72.97 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.778 178.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.16 -40.23 78.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.059 -0.519 . . . . 10.0 109.688 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -66.55 -44.85 81.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.338 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -64.92 -25.61 67.95 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.956 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.22 -51.86 8.91 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.69 179.213 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 84.4 mt -52.69 -40.0 62.51 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.637 -0.711 . . . . 10.0 112.523 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -48.24 -79.3 0.07 OUTLIER Glycine 0 CA--C 1.523 0.543 0 O-C-N 123.6 0.563 . . . . 10.0 113.679 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -60.14 -35.87 90.8 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.621 2.214 . . . . 10.0 112.212 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 35.9 t -60.56 -49.49 84.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 N-CA-C 112.132 0.419 . . . . 10.0 112.132 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 51.5 p -70.39 -34.58 72.74 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 121.097 -0.241 . . . . 10.0 111.118 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -60.13 -50.6 73.03 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -74.09 -24.72 59.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.511 179.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -68.59 -46.14 70.16 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.276 -0.639 . . . . 10.0 109.276 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -37.35 87.09 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 108.72 -0.844 . . . . 10.0 108.72 178.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -64.5 -44.45 90.91 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.63 -0.878 . . . . 10.0 108.63 177.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.88 -37.06 86.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.495 178.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 44.7 mt -63.13 -41.06 99.25 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -68.18 -35.06 77.42 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.969 -0.559 . . . . 10.0 110.403 178.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 38.0 mttp -62.56 -36.65 83.32 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.861 -1.163 . . . . 10.0 107.861 177.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -69.66 -48.75 58.71 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 114.96 -1.018 . . . . 10.0 110.172 179.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -64.2 -36.01 82.67 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 116.792 -0.185 . . . . 10.0 110.736 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -63.93 -35.12 79.62 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.686 -0.487 . . . . 10.0 109.686 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -69.38 -45.39 60.75 Favored Glycine 0 N--CA 1.445 -0.748 0 N-CA-C 108.807 -1.717 . . . . 10.0 108.807 177.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 87.5 mt -64.32 -24.6 67.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.373 -0.413 . . . . 10.0 110.796 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 39.8 mtt180 -74.77 -3.49 31.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.24 0.543 . . . . 10.0 110.341 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -118.04 -38.37 3.23 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.112 -1.069 . . . . 10.0 108.112 177.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -72.22 -59.8 2.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.092 -0.958 . . . . 10.0 110.73 179.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 93.3 mmm -66.43 -31.35 72.05 Favored 'General case' 0 C--O 1.225 -0.236 0 N-CA-C 112.908 0.706 . . . . 10.0 112.908 -178.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.3 p -62.66 -52.08 64.73 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 179.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -66.73 -40.23 88.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.996 -0.742 . . . . 10.0 108.996 178.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -55.07 -53.83 50.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.705 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 96.6 mt -63.88 -47.09 82.01 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.552 0.575 . . . . 10.0 112.552 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -65.31 -38.46 90.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.903 0.382 . . . . 10.0 110.999 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.79 -42.56 63.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.447 179.295 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 2.3 p -65.55 -35.59 75.62 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.189 0 CA-C-N 116.656 -0.247 . . . . 10.0 110.981 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -66.0 -37.76 86.74 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.779 -0.823 . . . . 10.0 108.779 178.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -72.98 -11.46 60.58 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.322 -0.854 . . . . 10.0 110.033 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 35.9 mmtm -94.66 -40.16 9.96 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 59.5 t -59.62 -42.25 87.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.727 -0.67 . . . . 10.0 111.654 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -54.32 -61.54 5.35 Favored Pre-proline 0 CA--C 1.537 0.468 0 O-C-N 122.97 0.169 . . . . 10.0 111.403 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.78 -28.99 42.99 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 122.171 1.914 . . . . 10.0 111.605 178.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -64.49 -52.02 60.01 Favored 'General case' 0 C--O 1.222 -0.367 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 43.3 mt -65.64 -43.52 89.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.358 179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -58.72 -51.45 69.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.99 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -71.97 -32.17 67.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.766 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -67.7 -48.03 67.7 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 178.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -68.04 -29.58 68.6 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 5.0 ttmt -65.23 -46.69 79.6 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.539 -0.911 . . . . 10.0 108.539 177.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 19.2 mttm -69.37 -38.75 78.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.432 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -31.8 72.82 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 178.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -69.77 -45.59 67.69 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -55.66 -43.55 76.39 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -73.47 -34.1 65.19 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 115.275 -0.875 . . . . 10.0 110.884 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.45 -42.32 99.38 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.553 -0.906 . . . . 10.0 108.553 178.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -66.1 -47.21 74.97 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 107.894 -1.15 . . . . 10.0 107.894 177.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . 0.703 ' CD2' ' CD ' ' A' ' 308' ' ' ARG . 96.2 mt -55.82 -44.62 78.05 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 115.217 -0.901 . . . . 20.0 111.489 178.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -62.6 -41.44 98.97 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 116.361 -0.381 . . . . 10.0 110.135 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 27.0 mtm180 -69.84 -36.93 75.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.964 0.412 . . . . 10.0 110.528 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -79.97 2.76 22.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.092 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 29.3 mttm -120.51 -57.71 1.89 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.367 -0.378 . . . . 10.0 110.55 178.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 84.0 t -62.47 -42.77 97.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 112.752 0.649 . . . . 10.0 112.752 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -61.28 -58.19 20.57 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 112.378 0.51 . . . . 10.0 112.378 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -60.48 -33.86 93.48 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 121.663 1.575 . . . . 10.0 110.51 178.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 12.2 mt -66.61 -44.11 82.96 Favored 'General case' 0 C--O 1.213 -0.828 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 65.4 mtt180 -54.89 -41.39 70.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.886 0.374 . . . . 10.0 110.177 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -67.48 -56.78 8.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.523 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.64 -34.61 77.32 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.148 0.796 . . . . 10.0 113.148 -179.211 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 30.5 mt -68.6 -35.26 77.09 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -69.95 -36.84 75.59 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -67.8 -41.26 83.41 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.609 -0.886 . . . . 10.0 108.609 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -67.58 -35.04 85.62 Favored Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 110.061 -1.215 . . . . 10.0 110.061 177.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -70.32 -38.41 74.92 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 45.8 mtt180 -64.57 -39.4 93.68 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 108.484 -0.932 . . . . 10.0 108.484 177.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -63.81 -48.65 75.98 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.801 -0.815 . . . . 10.0 108.801 177.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -64.8 -35.83 82.37 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.583 179.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 17.4 mt -68.37 -43.27 77.73 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 178.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -62.04 -40.82 97.05 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 107.496 -1.298 . . . . 10.0 107.496 178.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -60.59 -59.63 5.09 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.448 -0.945 . . . . 10.0 108.448 177.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 80.8 mt -52.04 -50.95 60.45 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 115.52 -0.764 . . . . 10.0 112.468 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -61.57 -41.77 97.87 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.689 0.255 . . . . 10.0 111.689 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -75.05 -12.98 60.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.674 0.273 . . . . 10.0 111.429 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 13.5 mttm -97.09 -44.09 7.12 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 178.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 95.1 mt -71.11 -29.66 65.54 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.937 0.717 . . . . 10.0 112.937 -179.096 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 49.3 m -61.21 -60.4 10.69 Favored Pre-proline 0 CA--C 1.537 0.462 0 C-N-CA 120.422 -0.511 . . . . 10.0 111.327 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -65.0 -35.38 43.32 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 121.717 1.611 . . . . 10.0 111.074 178.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 16.2 mt -67.91 -35.35 78.31 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 116.334 -0.393 . . . . 10.0 110.461 179.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -65.43 -45.3 90.95 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.212 -1.155 . . . . 10.0 110.212 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -64.41 -42.88 95.82 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -62.31 -43.83 97.91 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.586 178.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 65.8 mmm -62.29 -38.04 87.84 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.135 -0.484 . . . . 10.0 109.826 178.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 89.9 mtt180 -63.99 -42.46 97.19 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.45 -41.64 88.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.711 -0.677 . . . . 10.0 109.763 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 46.5 mtt180 -62.23 -43.49 98.71 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 108.586 -0.894 . . . . 10.0 108.586 178.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -61.53 -44.22 97.45 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.236 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 50.6 mtt180 -63.65 -42.02 98.17 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -75.9 10.91 1.59 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.192 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -128.97 -55.68 1.2 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.718 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 79.9 t -69.17 -46.41 77.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.826 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -66.81 -35.64 80.52 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.81 -39.2 90.67 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.052 -1.092 . . . . 10.0 108.052 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 32.3 mt -68.67 -23.2 64.37 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.314 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 68.2 mtt180 -64.68 -39.82 94.33 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.641 -0.874 . . . . 10.0 108.641 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -93.19 7.9 42.39 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.474 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 32.3 m170 -113.74 -53.07 2.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.037 -0.528 . . . . 10.0 111.011 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 95.8 mt -77.42 -34.56 54.66 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.7 0.63 . . . . 10.0 112.7 -178.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -57.27 -57.18 26.66 Favored Pre-proline 0 CA--C 1.532 0.26 0 C-N-CA 120.52 -0.472 . . . . 10.0 110.945 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -67.48 -28.84 38.22 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 121.403 1.402 . . . . 10.0 110.628 178.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -63.76 -48.38 77.22 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.004 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 9.1 p -71.01 -29.97 66.07 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.625 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -68.08 -44.0 77.26 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.958 -0.756 . . . . 10.0 108.958 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -66.15 -44.13 85.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.089 177.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 37.7 mt -61.64 -38.36 87.42 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 115.852 -0.613 . . . . 10.0 109.836 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -61.81 -38.99 90.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.141 -0.481 . . . . 10.0 109.911 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -67.81 -39.66 83.93 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 178.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 62.6 mtt180 -68.6 -37.2 79.6 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 178.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 75.0 mt -69.49 -34.98 75.12 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.124 -0.695 . . . . 10.0 109.124 178.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -64.04 -45.5 88.58 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 178.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.33 -40.88 98.54 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 178.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 8.2 ttm180 -60.97 -40.67 94.28 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.273 -0.876 . . . . 10.0 108.884 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 74.7 mt -68.53 -36.15 78.45 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.114 178.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -59.38 -44.02 92.82 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 178.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -68.25 -46.56 70.13 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.356 -0.838 . . . . 10.0 109.445 178.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 58.6 mt -58.57 -30.05 66.87 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.393 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -74.89 -49.85 18.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.66 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -67.02 -49.57 64.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.861 0.362 . . . . 10.0 110.943 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -66.0 -36.6 83.74 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -67.52 -41.8 89.69 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 110.853 -0.899 . . . . 10.0 110.853 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -63.94 -37.65 94.93 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 110.215 -1.154 . . . . 10.0 110.215 178.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -67.89 -44.9 75.93 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.614 -0.884 . . . . 10.0 108.614 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 34.3 mtt180 -56.77 -39.98 75.01 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 115.522 -0.763 . . . . 10.0 110.542 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 81.7 mt -62.61 -41.29 98.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.408 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -69.47 -45.08 69.86 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.457 -0.571 . . . . 10.0 109.457 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -59.84 -49.33 78.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.097 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -64.0 -39.21 93.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.985 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -65.68 -42.96 90.66 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.172 0.511 . . . . 10.0 110.314 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -64.52 -51.82 60.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.616 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -33.77 74.57 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.373 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.41 -45.94 88.69 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.392 -0.595 . . . . 10.0 109.392 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 4.4 m -66.49 -38.1 86.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.726 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -68.96 -25.97 64.81 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.605 -0.725 . . . . 10.0 110.649 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -87.5 -34.24 18.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.766 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 49.0 mt -63.6 -32.45 73.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.856 0.36 . . . . 10.0 110.413 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 1.1 p -76.4 -41.32 48.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.117 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 2.1 p -73.88 -12.75 60.76 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.336 0.588 . . . . 10.0 110.853 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 28.8 mt -91.31 -39.61 11.95 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.056 -0.72 . . . . 10.0 109.056 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.5 p -69.46 -24.88 63.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.784 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -64.11 -19.97 65.64 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.337 0.589 . . . . 10.0 109.967 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -114.53 -29.77 6.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.222 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -73.8 -5.7 42.45 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.143 0.423 . . . . 10.0 112.143 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -119.87 -70.11 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.583 0 CA-C-O 119.446 -0.312 . . . . 10.0 111.323 178.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.6 -51.72 3.83 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.08 1.853 . . . . 10.0 112.242 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -63.6 -40.73 97.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.463 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 6.9 mt -63.96 -41.79 97.47 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 110.063 -0.347 . . . . 10.0 110.063 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -63.56 -38.55 91.54 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 178.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.31 -38.77 81.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.153 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 36.4 mt -62.55 -41.01 98.63 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -68.84 -30.92 69.56 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.468 -0.567 . . . . 10.0 109.468 178.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -70.63 -14.42 62.47 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.337 -0.847 . . . . 20.0 110.47 178.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -98.6 -37.6 4.19 Favored Glycine 0 CA--C 1.523 0.568 0 N-CA-C 108.659 -1.776 . . . . 10.0 108.659 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 73.5 mt -56.34 -45.03 80.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.529 -0.335 . . . . 10.0 111.602 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 86.8 mt -56.97 -62.0 5.96 Favored Pre-proline 0 CA--C 1.537 0.448 0 N-CA-C 112.508 0.559 . . . . 10.0 112.508 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -61.22 -36.97 77.52 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 121.964 1.776 . . . . 10.0 111.948 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 9.6 t -64.38 -45.34 96.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.637 0.256 . . . . 10.0 110.372 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 29.8 mt -62.75 -38.0 88.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.777 0.322 . . . . 10.0 110.145 179.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 62.4 mt-10 -65.72 -48.55 71.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.176 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 26.9 m -63.41 -39.91 95.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.152 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -65.91 -38.31 88.37 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 178.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 64.6 mttt -61.73 -39.49 91.72 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.858 -0.61 . . . . 10.0 109.744 178.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 69.6 t -59.8 -48.83 86.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 108.82 -0.808 . . . . 10.0 108.82 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 12.0 m -61.47 -41.98 98.07 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.386 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -63.47 -47.37 82.08 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.082 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 80.1 mt -57.9 -46.28 85.17 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.306 -0.407 . . . . 10.0 110.406 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 14.7 m -65.33 -44.53 87.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.216 179.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -58.03 -50.5 73.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.285 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.5 mt -56.63 -44.65 81.44 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 116.185 -0.462 . . . . 10.0 110.816 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -63.61 -52.55 60.39 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.065 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -58.78 -39.33 80.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.897 -0.592 . . . . 10.0 112.234 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -73.26 -44.13 59.87 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.001 0.371 . . . . 10.0 112.001 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 14.2 p -64.75 -27.98 69.27 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.507 0.558 . . . . 10.0 112.507 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 45.0 mtmt -65.61 -33.18 75.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.894 0.378 . . . . 10.0 110.924 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 24.0 mttt -85.48 -34.85 21.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.348 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 91.3 mt -85.77 49.46 1.77 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.456 0.646 . . . . 10.0 109.604 178.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.246 0.915 0 CA-C-N 115.487 -0.778 . . . . 10.0 110.123 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 32.9 tpp . . . . . 0 C--O 1.234 0.247 0 CA-C-O 120.801 0.334 . . . . 10.0 110.284 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.69 155.19 39.23 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.165 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -115.96 125.25 52.28 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 179.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -119.05 101.01 7.71 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.027 0.441 . . . . 10.0 111.165 -179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 5.5 mtpp -81.95 102.71 11.1 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.305 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 21.2 mt -100.92 138.41 38.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.553 -178.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 46.0 t -112.55 126.73 69.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.794 0.33 . . . . 10.0 110.742 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 57.1 t -95.87 118.3 41.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.724 -0.473 . . . . 10.0 109.724 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 35.9 m -112.33 163.21 9.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.773 0.32 . . . . 10.0 110.802 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 148.99 167.49 13.91 Favored Glycine 0 N--CA 1.447 -0.632 0 N-CA-C 111.378 -0.689 . . . . 10.0 111.378 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.59 158.32 35.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.924 0.392 . . . . 10.0 111.724 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.65 92.4 1.0 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 121.019 -0.61 . . . . 10.0 111.867 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 151.12 -10.98 0.77 Allowed Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 111.645 -0.582 . . . . 10.0 111.645 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 17.5 m -73.42 -18.91 17.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.857 0.36 . . . . 10.0 111.666 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 89.59 44.7 4.83 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.82 -0.705 . . . . 10.0 112.927 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -62.26 -49.73 74.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.544 0.211 . . . . 10.0 111.226 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.0 p -62.43 -31.23 71.91 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.686 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.38 98.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.286 -0.415 . . . . 10.0 110.312 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 94.2 mt -68.37 -35.75 78.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.98 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.87 -47.42 53.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.84 0.352 . . . . 10.0 110.953 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 97.5 mt -63.93 -35.75 74.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.766 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -69.58 -14.83 63.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.081 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 15.0 tp -102.23 -34.81 9.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.869 0.366 . . . . 10.0 110.659 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 49.3 mm -79.73 -64.21 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.905 -179.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -93.21 -13.56 28.2 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.724 -178.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 64.48 40.66 6.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.654 -179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -130.65 136.2 48.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.047 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -88.21 137.61 32.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.779 0.323 . . . . 10.0 110.774 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 1.7 m -99.69 151.96 4.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.361 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -121.17 -21.94 6.24 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.183 0.516 . . . . 10.0 111.363 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -77.0 157.22 31.33 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.358 0.599 . . . . 10.0 111.243 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.51 68.23 5.68 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.035 179.252 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.3 134.62 70.21 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.747 -0.66 . . . . 10.0 110.753 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -80.11 -164.72 0.29 Allowed 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.857 2.371 . . . . 10.0 111.783 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -173.33 141.47 0.92 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.279 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 63.8 mt -121.92 -66.56 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 108.217 -1.031 . . . . 10.0 108.217 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -148.11 93.43 2.17 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.702 -0.851 . . . . 10.0 108.702 179.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -114.61 160.56 19.16 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.551 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.1 p -147.28 142.83 27.59 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.715 0.293 . . . . 10.0 111.608 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . 0.44 ' C ' HE22 ' D' ' 818' ' ' GLN . 40.7 m-85 -131.56 141.06 49.62 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.245 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -120.34 131.04 54.68 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 58.1 tttp -139.93 144.15 36.95 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.23 -0.441 . . . . 10.0 109.962 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -113.44 118.23 33.94 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.971 -0.381 . . . . 10.0 109.971 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -143.65 169.09 11.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.012 0.434 . . . . 10.0 111.271 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 19.1 t -107.09 112.85 41.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 179.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 50.3 mt -109.92 112.37 40.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.824 -179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 61.27 34.52 18.59 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.304 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.88 -8.73 78.91 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.927 -0.654 . . . . 10.0 112.791 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -100.52 113.43 26.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.833 0.349 . . . . 10.0 111.267 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 5.3 t -78.83 121.28 24.61 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.489 -0.93 . . . . 10.0 108.489 178.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -140.39 166.68 24.05 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.286 0.565 . . . . 10.0 112.47 -178.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 25.5 tp -107.02 122.1 45.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.256 -0.884 . . . . 10.0 109.112 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 77.7 mt -99.98 117.35 34.08 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.284 -0.416 . . . . 10.0 111.561 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -104.53 89.55 3.25 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.354 -1.35 . . . . 10.0 107.354 178.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 14.8 mt -82.69 136.58 22.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.641 -0.709 . . . . 10.0 112.306 -177.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 47.3 tp -110.3 120.89 43.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.606 -0.725 . . . . 10.0 111.124 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -99.36 96.76 7.94 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.072 -0.714 . . . . 10.0 109.072 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 32.0 p -81.02 162.41 23.82 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.373 -0.83 . . . . 10.0 112.342 -178.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.51 156.47 32.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.905 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -84.31 -67.49 1.43 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.436 -0.888 . . . . 10.0 111.767 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -83.15 102.43 11.86 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.328 0.585 . . . . 20.0 111.257 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -142.59 163.83 31.76 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.374 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -118.67 -161.46 0.84 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.698 -0.683 . . . . 10.0 109.312 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -80.44 110.27 15.74 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.982 0.42 . . . . 10.0 110.173 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 44.2 t -135.56 137.4 41.97 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.028 -0.533 . . . . 10.0 109.933 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.85 -38.46 78.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.055 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 90.4 mmm -60.81 -40.74 93.87 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.407 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -66.58 -48.43 69.61 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.482 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.88 -32.6 70.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.582 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -61.35 -56.3 21.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.98 -0.554 . . . . 10.0 111.523 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -72.55 -27.83 62.46 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.436 0.902 . . . . 10.0 113.436 -178.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 59.7 mtp -68.57 -21.27 64.54 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.939 0.348 . . . . 10.0 111.939 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 66.9 mtt-85 -95.6 11.74 32.11 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.859 0.318 . . . . 10.0 111.859 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.3 m -113.01 18.16 18.29 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.408 0.623 . . . . 10.0 110.749 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -115.94 144.26 18.37 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.521 -0.847 . . . . 10.0 112.693 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -84.99 -67.9 0.76 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.214 -0.291 . . . . 10.0 110.214 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -105.19 152.4 17.27 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 111.149 -0.78 . . . . 10.0 111.149 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -124.75 127.46 47.26 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.116 0.484 . . . . 10.0 111.677 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 55.5 mt -95.33 113.43 25.1 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.883 -0.598 . . . . 10.0 110.03 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 3.2 m -87.37 86.31 7.23 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.934 -0.395 . . . . 10.0 109.934 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 28.6 t -88.31 126.3 41.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.138 0.494 . . . . 10.0 111.837 -178.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 29.4 p90 -133.14 157.9 44.17 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.114 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -94.16 121.71 35.94 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 12.6 pt -68.46 -11.23 14.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 112.129 0.418 . . . . 10.0 112.129 -179.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -100.97 12.06 38.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.911 0.386 . . . . 10.0 110.963 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -137.6 113.13 9.45 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.0 0.428 . . . . 10.0 110.861 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.39 -37.71 88.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.908 -0.587 . . . . 10.0 112.321 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 17.3 tptp -63.79 -30.68 71.75 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.987 0.422 . . . . 10.0 110.878 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 15.2 t -66.42 -40.37 89.5 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.791 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -65.62 -35.67 81.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.356 0.598 . . . . 10.0 110.195 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -80.93 -1.72 44.75 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.679 -0.692 . . . . 10.0 111.574 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.19 -12.1 33.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.146 0.498 . . . . 10.0 110.024 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 43.8 mm -60.26 -42.74 91.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.398 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -64.4 -37.79 88.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.26 -0.427 . . . . 10.0 109.871 179.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -59.03 -43.83 91.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.414 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -77.6 -34.92 53.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.95 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -55.17 -50.58 68.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.406 -0.361 . . . . 10.0 111.335 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -69.46 -35.79 75.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.081 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -63.9 -48.33 77.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.658 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 65.2 mt -66.92 -38.05 80.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.273 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.84 -37.34 78.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.097 0.475 . . . . 10.0 110.422 179.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 64.3 ttp85 -71.43 -42.9 67.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.664 -0.698 . . . . 10.0 111.918 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 28.3 m -72.83 -30.0 31.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 N-CA-C 112.288 0.477 . . . . 10.0 112.288 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 19.8 mmmt -88.0 -22.29 24.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.549 0.214 . . . . 10.0 111.169 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 26.0 t0 57.84 30.32 18.87 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.725 0.774 . . . . 10.0 110.782 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 3.0 m -127.44 143.28 51.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.381 -0.827 . . . . 10.0 109.756 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -75.06 -41.64 58.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.199 0.523 . . . . 10.0 110.487 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -106.24 109.03 20.84 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.573 0.701 . . . . 10.0 110.775 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 78.5 t -118.92 131.67 24.24 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.256 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -59.63 101.76 0.15 Allowed 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.718 2.279 . . . . 10.0 111.381 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 65.8 mtt -127.16 149.67 49.86 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.154 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 98.0 t -132.36 122.57 48.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 12.9 tp -76.87 115.68 16.87 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.274 -0.639 . . . . 10.0 109.274 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 49.3 t -110.58 112.41 40.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.04 0.448 . . . . 10.0 111.425 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -95.56 95.51 1.85 Allowed Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.319 -1.112 . . . . 10.0 110.319 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -85.18 163.48 18.69 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -178.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 92.5 mttt 72.13 33.19 1.62 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 115.38 -0.827 . . . . 10.0 112.208 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 20.4 p -67.31 -17.0 64.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.761 0.315 . . . . 10.0 111.723 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -84.07 -8.93 58.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.464 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 34.2 mt -84.7 124.65 72.77 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 120.762 0.315 . . . . 10.0 111.429 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -75.77 42.67 0.97 Allowed 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.111 2.541 . . . . 10.0 112.248 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 26.7 m -134.75 30.49 3.42 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.899 -0.778 . . . . 10.0 108.899 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 40.8 ttm-85 -57.63 108.93 0.62 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.379 -0.828 . . . . 10.0 111.989 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 2.5 m -98.87 -27.6 13.84 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.635 -0.711 . . . . 10.0 109.151 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 40.4 t -106.96 114.24 45.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.187 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -76.98 154.36 33.62 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.34 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 3.8 m -55.7 -41.06 73.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.921 -0.581 . . . . 10.0 111.517 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 11.0 ttpp -62.21 -45.11 94.81 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.803 0.335 . . . . 10.0 110.973 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -56.91 -46.8 81.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.583 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.77 -40.42 84.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.477 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -63.9 -40.44 96.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.524 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -60.7 -42.31 96.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.094 0.474 . . . . 10.0 110.44 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 42.0 tp -68.39 -44.68 74.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.415 179.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.58 -45.35 92.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.218 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -61.8 -36.01 79.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.255 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 22.9 m -67.66 -25.57 65.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.47 -179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -95.29 -6.01 42.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.453 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 72.59 31.49 62.86 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.865 -0.684 . . . . 10.0 111.75 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 49.5 pt -126.25 153.05 74.48 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 110.295 -0.261 . . . . 10.0 110.295 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -81.14 158.05 20.26 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.586 2.191 . . . . 10.0 112.389 179.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 45.0 t80 -122.8 129.51 51.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.535 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 32.3 mm -128.03 124.42 62.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.418 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -85.15 124.76 32.19 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.669 -0.863 . . . . 10.0 108.669 178.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 82.6 p -128.55 171.5 12.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.792 0.805 . . . . 10.0 112.974 -177.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 7.9 t -154.06 121.12 5.67 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.659 -1.155 . . . . 10.0 108.043 178.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.97 -17.79 62.64 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.864 0.364 . . . . 10.0 111.01 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 29.8 ttmt -81.55 -48.28 12.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.16 -0.473 . . . . 10.0 111.526 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 24.4 p -90.42 -12.8 36.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.802 0.334 . . . . 10.0 111.532 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 40.2 ttt-85 70.04 20.22 6.56 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.694 -0.684 . . . . 10.0 111.531 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -75.7 131.93 40.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.604 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.9 -13.0 5.74 Favored Glycine 0 C--O 1.225 -0.436 0 N-CA-C 114.934 0.734 . . . . 10.0 114.934 177.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 59.7 t -53.55 -56.88 6.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -178.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -45.69 93.03 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.926 -179.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -66.62 -32.67 74.15 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.918 0.71 . . . . 10.0 112.918 -178.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.8 -46.52 84.52 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.074 0.464 . . . . 10.0 110.481 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -68.53 -37.41 79.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.713 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 21.4 m-30 -61.86 -45.3 94.36 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.315 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 12.2 m -61.71 -38.17 86.89 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.901 -0.591 . . . . 10.0 111.004 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 21.5 tp -61.53 -43.58 98.61 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 67.0 t -65.7 -39.06 83.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.115 -0.493 . . . . 10.0 109.809 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 41.5 mtm-85 -61.6 -41.38 97.36 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.938 -0.574 . . . . 10.0 109.987 178.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -63.0 -40.5 97.97 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.202 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 93.1 mt -62.78 -42.07 94.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.444 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 59.1 mtt180 -57.17 -52.23 66.16 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.783 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt -61.07 -39.38 89.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.666 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 -65.07 -36.92 85.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.009 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 7.8 mttt -73.63 -35.1 65.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.933 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 67.2 tt0 -69.15 -33.84 74.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.306 0.574 . . . . 10.0 109.574 179.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 16.2 tttp -64.59 -33.35 75.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.506 -0.77 . . . . 10.0 110.49 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 23.2 ttp -62.48 -25.42 67.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.704 -0.68 . . . . 10.0 112.067 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 39.0 m -79.95 -12.63 59.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.018 0.437 . . . . 10.0 111.299 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -110.26 -53.36 2.69 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.281 0.562 . . . . 10.0 109.98 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -99.76 76.4 1.97 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.635 -0.711 . . . . 10.0 109.662 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . -63.13 -72.04 0.73 Allowed Glycine 0 N--CA 1.447 -0.602 0 CA-C-N 115.295 -0.866 . . . . 10.0 112.196 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -172.37 117.67 0.36 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.915 0.388 . . . . 10.0 110.775 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -111.5 112.03 23.48 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.674 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . 0.46 ' NZ ' ' N1 ' ' A' ' 40' ' ' 17F . 9.8 ptmm? -111.4 -179.67 3.78 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.925 -0.579 . . . . 10.0 109.915 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -63.54 128.18 34.67 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.643 -0.503 . . . . 10.0 109.643 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 15.0 ptpt -153.53 174.16 14.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.679 -0.237 . . . . 10.0 111.195 -179.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . 0.407 ' NZ ' ' O2P' ' A' ' 21' ' ' PCW . 3.6 tmtm? 74.67 -49.0 0.66 Allowed 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.927 0.767 . . . . 10.0 112.805 179.029 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 62.9 m -118.62 126.53 52.15 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 110.029 -0.36 . . . . 10.0 110.029 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm -91.11 -29.48 17.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.416 -179.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 1.3 m 61.35 60.0 1.8 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.034 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 10.7 mmtp 57.8 72.69 0.5 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.484 -0.78 . . . . 10.0 111.472 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 2.1 p . . . . . 0 C--N 1.324 -0.526 0 CA-C-N 115.541 -0.754 . . . . 10.0 111.729 -179.419 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.595 0 N-CA-C 112.084 -0.406 . . . . 10.0 112.084 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.2 134.2 36.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.686 0.279 . . . . 10.0 111.024 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 75.3 t -106.14 133.4 50.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.122 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 26.0 ttmt -87.27 110.31 20.11 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.419 -0.586 . . . . 10.0 109.419 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 57.5 t -99.2 125.4 52.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 120.894 0.378 . . . . 10.0 110.418 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -96.24 142.4 28.44 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.808 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 56.1 mt -107.96 150.09 39.91 Favored Pre-proline 0 C--N 1.318 -0.8 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.07 -179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -61.78 -16.87 51.72 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 123.178 2.585 . . . . 10.0 112.273 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -85.84 34.94 0.61 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.984 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? 52.43 38.25 24.83 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.124 -0.944 . . . . 10.0 112.161 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 818' ' ' GLN . . . . . 0.44 HE22 ' C ' ' B' ' 40' ' ' TYR . 72.0 mt-30 -135.73 -170.5 2.63 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 112.838 0.681 . . . . 10.0 112.838 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.36 168.4 26.75 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.336 0.589 . . . . 10.0 112.148 -178.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 14.1 t -152.38 139.15 18.87 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 107.301 -1.37 . . . . 10.0 107.301 178.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 2.9 t -108.05 114.53 46.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 C-N-CA 120.147 -0.621 . . . . 10.0 112.02 -178.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 3.7 t -110.29 148.33 13.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.939 -178.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.89 146.94 37.33 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.78 0.324 . . . . 10.0 111.564 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 47.7 t -84.68 96.39 4.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.069 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 15.3 mtp85 -99.65 103.46 15.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.52 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -59.3 123.62 17.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.952 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 128.03 -41.67 1.55 Allowed Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 115.665 -0.698 . . . . 10.0 112.041 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 12.7 ptm -81.86 154.89 25.63 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.916 0.389 . . . . 10.0 110.854 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 2.1 m -96.72 168.9 10.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.203 -0.453 . . . . 10.0 111.334 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 69.7 t -54.86 -42.53 63.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.714 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -55.89 -33.07 64.29 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.365 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -73.73 -59.35 2.76 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.367 0.506 . . . . 10.0 112.367 -178.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.99 -39.17 93.51 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 -179.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -75.47 -14.9 60.46 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.429 0.529 . . . . 10.0 112.429 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -60.15 -49.52 77.31 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 179.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 7.6 mmmm -63.65 -32.5 74.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.449 -0.796 . . . . 10.0 111.046 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -70.02 -28.49 65.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.139 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 91.6 mt -87.83 -39.33 14.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.549 179.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 30.9 mmtp -64.99 -31.88 73.33 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.404 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 840' ' ' VAL . . . . . 0.43 ' CG2' ' CE2' ' B' ' 40' ' ' TYR . 2.0 p -58.33 -24.95 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-O 121.426 0.632 . . . . 10.0 111.441 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 841' ' ' ARG . . . . . 0.401 ' NH1' ' O1P' ' A' ' 15' ' ' PCW . 3.7 mmp_? -100.78 -37.89 8.51 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.314 -0.857 . . . . 10.0 110.154 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 117.01 20.29 4.92 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 111.085 -0.806 . . . . 10.0 111.085 -178.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 59.1 mt -105.32 179.74 4.18 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.775 0.322 . . . . 10.0 110.346 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -140.7 164.47 30.11 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.651 -0.5 . . . . 10.0 109.651 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 22.4 mp0 -72.86 64.87 0.7 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.087 0.47 . . . . 10.0 111.2 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -123.0 -78.13 0.6 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.614 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -92.47 14.27 17.2 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.324 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 14.8 m -111.13 143.74 41.37 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.29 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 7.1 p -138.14 143.56 32.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.383 -0.371 . . . . 10.0 110.489 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 18.8 t -97.13 124.31 49.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.967 0.413 . . . . 10.0 111.618 -179.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 4.4 m-30 -101.96 130.61 48.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.111 179.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 20.0 mtm180 -96.79 146.54 24.81 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.719 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 13.4 mt -90.26 89.33 7.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.103 -0.499 . . . . 10.0 111.876 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 73.5 mt -105.47 106.25 20.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 178.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt 63.35 21.56 12.86 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.161 0.505 . . . . 10.0 110.706 -178.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 93.61 -22.03 37.78 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.571 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 44.2 ttt-85 -81.25 122.45 27.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.718 0.294 . . . . 10.0 111.057 -179.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -65.22 118.65 9.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.07 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 7.2 m -119.76 134.78 55.11 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.433 -0.349 . . . . 10.0 111.26 -179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 17.4 t -71.03 137.17 24.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.833 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 3.0 t -127.1 164.71 20.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.091 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -90.84 159.13 16.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.756 0.312 . . . . 10.0 110.913 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 96.5 m95 -79.53 -23.31 42.98 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.053 0.454 . . . . 10.0 110.801 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -79.75 -13.72 59.24 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.61 -179.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 3.8 m -63.49 139.92 58.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.488 -0.324 . . . . 10.0 110.851 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -74.94 147.42 40.91 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.293 -0.262 . . . . 10.0 110.293 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 5.2 tp -83.75 4.87 2.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.912 0.387 . . . . 10.0 111.599 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -56.0 -58.01 18.7 Favored Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 113.595 0.961 . . . . 10.0 113.595 -179.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -86.56 33.95 0.45 Allowed 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.115 1.877 . . . . 10.0 112.597 -179.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -105.07 -5.4 20.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.943 0.401 . . . . 10.0 111.724 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -70.48 131.97 44.84 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.762 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 103.51 -0.5 46.26 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.527 -0.844 . . . . 10.0 113.542 179.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -136.83 173.75 11.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.449 0.625 . . . . 10.0 111.733 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 69.6 mt-10 -109.9 162.18 14.75 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.066 -0.516 . . . . 10.0 109.973 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 96.7 mt -131.13 119.5 22.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.43 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 3.0 mp -106.65 124.61 62.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 39.0 t -93.02 120.04 41.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 120.895 0.378 . . . . 10.0 110.828 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -106.48 153.73 21.87 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 94.7 t -118.37 118.68 58.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.834 -0.432 . . . . 10.0 109.834 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 37.9 mt . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.406 -0.806 . . . . 10.0 110.246 -179.488 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PCW . . . . . 0.416 ' N ' ' O2P' ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PCW . . . . . 0.416 ' O2P' ' N ' ' A' ' 2' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PCW . . . . . 0.401 ' O1P' ' NH1' ' D' ' 841' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PCW . . . . . 0.407 ' O2P' ' NZ ' ' B' ' 180' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' 17F . . . . . 0.46 ' N1 ' ' NZ ' ' B' ' 177' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 201' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 73.7 mt . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.994 0.426 . . . . 10.0 110.566 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 55.2 mmtt -59.64 -42.12 92.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.67 -0.695 . . . . 10.0 110.984 -179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 96.9 mt -64.35 -33.38 75.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.625 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 39.8 mt -66.6 -46.26 76.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.1 0.476 . . . . 10.0 110.033 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -67.93 -39.61 83.45 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.414 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -65.46 -39.21 91.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.729 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 15.7 m95 -73.92 -21.49 60.03 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.357 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -60.85 -44.02 97.56 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -66.54 -38.06 86.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.297 -0.865 . . . . 10.0 110.179 179.477 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 60.2 t -67.68 -46.72 82.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.291 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 24.4 m -59.29 -48.14 82.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.702 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.4 p -60.09 -40.78 90.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.841 0.353 . . . . 10.0 110.725 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 22.9 m -66.32 -41.43 89.7 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 178.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.4 -40.96 98.19 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 65.0 m -63.18 -41.04 99.15 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.804 -0.635 . . . . 10.0 109.825 178.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -67.27 -35.0 78.6 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.32 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 80.6 mt -63.19 -44.36 95.58 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -68.0 -36.99 80.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.608 179.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -61.86 -38.45 88.32 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.863 178.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -80.46 -28.86 37.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.347 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 16.7 mt -58.55 -34.14 70.69 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 116.565 -0.288 . . . . 10.0 111.106 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -54.93 -69.49 1.25 Allowed Glycine 0 C--N 1.332 0.308 0 N-CA-C 110.992 -0.843 . . . . 10.0 110.992 178.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -57.68 -42.08 63.86 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.52 2.147 . . . . 10.0 111.275 177.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 14.0 t -53.31 -52.12 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 O-C-N 123.015 0.197 . . . . 10.0 111.296 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 18.8 p -64.71 -39.86 94.37 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.812 -0.355 . . . . 10.0 110.719 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -62.11 -50.05 73.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.724 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -64.42 -35.95 82.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.022 -0.536 . . . . 10.0 109.955 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 2.5 m-30 -66.73 -46.43 75.48 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.44 -0.578 . . . . 10.0 109.44 178.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 6.5 m95 -63.74 -40.67 97.3 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -55.12 -50.41 69.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.109 0.481 . . . . 10.0 109.705 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 58.5 m-80 -68.71 -40.59 79.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.668 -0.697 . . . . 10.0 110.891 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 49.5 mt -63.92 -36.57 84.37 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.298 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -65.74 -43.62 88.45 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 109.977 -0.379 . . . . 10.0 109.977 178.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 38.8 mtmt -66.97 -33.09 74.81 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.546 -0.909 . . . . 10.0 108.546 178.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.61 -52.7 50.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.091 -0.959 . . . . 10.0 109.64 178.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 3.1 p -65.67 -34.01 77.21 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.637 -0.256 . . . . 10.0 110.784 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -61.85 -49.64 75.46 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.775 -0.824 . . . . 10.0 108.775 178.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -66.69 -45.81 81.09 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 110.679 -0.968 . . . . 10.0 110.679 178.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 26.0 mt -56.94 -44.51 82.59 Favored 'General case' 0 C--O 1.22 -0.491 0 C-N-CA 122.411 0.284 . . . . 10.0 111.723 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 45.4 mtt85 -72.43 -38.45 68.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.545 0.212 . . . . 10.0 111.364 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -65.12 -24.05 67.31 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.151 -0.685 . . . . 10.0 109.151 178.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -89.83 -43.49 10.6 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.043 -0.98 . . . . 10.0 110.053 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 75.4 mmm -59.38 -30.58 68.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.834 0.35 . . . . 10.0 111.114 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.4 p -66.05 -32.83 74.53 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 42.1 mmtt -81.82 -43.69 17.94 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 108.695 -0.854 . . . . 10.0 108.695 178.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -52.47 -59.09 4.85 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.464 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 71.8 mt -65.19 -33.23 75.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.617 -0.719 . . . . 10.0 111.42 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -60.57 -54.78 41.27 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.924 -0.399 . . . . 10.0 109.924 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -67.46 -37.82 83.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.511 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 25.2 t -65.2 -46.41 90.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.618 -0.265 . . . . 10.0 111.246 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -71.67 -42.25 67.71 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.708 0.262 . . . . 10.0 111.708 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -65.19 -35.25 80.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.845 0.355 . . . . 10.0 110.658 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -88.33 -21.95 24.11 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.678 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.33 -27.83 40.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.743 0.306 . . . . 10.0 110.765 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -64.62 -63.9 3.25 Favored Pre-proline 0 N--CA 1.452 -0.337 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.587 178.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.29 -32.38 72.98 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 121.821 1.681 . . . . 10.0 111.841 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 5.8 m-30 -63.87 -51.12 66.05 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.769 0.319 . . . . 10.0 110.445 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 59.2 mt -73.87 -34.66 64.55 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.032 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -64.06 -48.07 77.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.805 0.336 . . . . 10.0 110.737 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -60.72 -44.45 96.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.069 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -69.09 -34.8 75.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.649 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -63.57 -45.74 89.07 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 21.6 mttt -63.87 -42.66 97.45 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.044 -0.725 . . . . 10.0 109.044 178.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.28 -48.7 80.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.438 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 1.6 m95 -60.75 -37.72 82.78 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.434 179.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -63.19 -50.41 70.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.86 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -62.25 -43.22 99.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -60.74 -48.81 80.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.111 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 67.1 mmm -68.12 -40.48 82.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.499 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -62.69 -49.44 75.09 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.175 -0.305 . . . . 10.0 110.175 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 71.4 mt -64.73 -34.51 78.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.393 -0.595 . . . . 10.0 109.393 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -64.5 -50.86 65.75 Favored 'General case' 0 C--O 1.217 -0.649 0 CA-C-N 115.495 -0.775 . . . . 10.0 109.753 178.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 58.0 mtt180 -62.57 -42.35 99.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.926 0.393 . . . . 10.0 110.492 179.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -59.76 -25.44 64.89 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.956 -179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 73.0 mttt -100.83 -36.45 9.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.435 179.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 3.0 t -51.92 -44.86 38.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 122.394 0.278 . . . . 10.0 111.17 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -60.37 -61.97 6.88 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 112.519 0.563 . . . . 10.0 112.519 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -59.53 -38.63 81.66 Favored 'Trans proline' 0 C--N 1.356 0.973 0 C-N-CA 121.886 1.724 . . . . 10.0 111.954 178.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 44.0 mt -65.66 -32.15 73.56 Favored 'General case' 0 N--CA 1.46 0.07 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -72.07 -33.92 68.3 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 177.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.22 -39.51 89.64 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 178.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 83.4 mt-10 -65.0 -45.88 83.75 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 108.78 -0.822 . . . . 10.0 108.78 178.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 47.8 mt -63.5 -37.82 88.76 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 115.364 -0.835 . . . . 10.0 109.946 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -66.41 -56.46 10.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.48 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -59.03 -46.21 88.79 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.737 -0.468 . . . . 10.0 109.737 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -59.72 -49.94 73.12 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 111.336 -0.706 . . . . 10.0 111.336 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.12 -40.51 94.05 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 110.596 -0.15 . . . . 10.0 110.596 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -61.36 -42.18 98.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.57 -0.286 . . . . 10.0 110.233 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -64.9 -51.14 63.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.31 0.576 . . . . 10.0 109.656 178.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 50.9 mttt -60.2 -46.41 89.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.195 -0.912 . . . . 10.0 110.957 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 19.9 mt -67.05 -39.81 86.99 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.954 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -58.12 -46.55 85.4 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.3 -45.67 83.44 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.86 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 88.8 mt -64.5 -42.64 95.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.43 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -63.47 -42.5 98.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.7 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -77.8 -6.72 55.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.025 0.44 . . . . 10.0 110.932 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 14.1 tptt -94.28 -37.04 11.71 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.19 -1.041 . . . . 10.0 108.19 177.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 79.8 mt -62.93 -24.49 67.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.381 -0.827 . . . . 10.0 111.48 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.79 -65.12 1.4 Allowed Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 121.193 -0.203 . . . . 10.0 111.444 179.232 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -64.56 -42.86 14.95 Favored 'Trans proline' 0 C--N 1.358 1.047 0 C-N-CA 122.13 1.887 . . . . 10.0 111.894 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 45.0 mt -66.5 -29.98 70.21 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 179.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -72.73 -39.58 55.11 Favored Glycine 0 N--CA 1.445 -0.73 0 N-CA-C 110.265 -1.134 . . . . 10.0 110.265 178.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -61.27 -41.57 97.15 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.525 -0.917 . . . . 10.0 108.525 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -62.15 -49.38 76.06 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.27 -0.877 . . . . 10.0 108.905 178.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -59.22 -41.12 87.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.052 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 -62.62 -48.75 78.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.768 0.318 . . . . 10.0 110.332 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.35 -39.82 89.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.003 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . 0.772 ' CG ' ' CD1' ' C' ' 469' ' ' LEU . 2.4 mmt85 -66.9 -37.91 85.27 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.773 -0.455 . . . . 10.0 109.773 178.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -67.89 -36.78 80.84 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.376 -0.972 . . . . 10.0 108.376 177.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 36.0 ttm180 -61.67 -50.49 72.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.352 -0.84 . . . . 10.0 108.896 178.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.08 -41.12 95.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.146 0.498 . . . . 10.0 109.684 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -57.65 -56.21 24.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.487 179.314 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 83.6 t -69.68 -42.24 80.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.475 -0.784 . . . . 10.0 112.306 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.26 -43.2 95.58 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.518 -0.473 . . . . 10.0 111.493 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -65.06 -32.37 74.05 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.491 -0.929 . . . . 10.0 108.491 178.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 12.8 mt -70.5 -32.52 70.05 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.3 -0.864 . . . . 10.0 109.566 178.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -64.69 -52.07 59.14 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 178.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.74 -11.31 58.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.829 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -96.69 -47.47 5.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.975 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 81.4 mt -67.71 -31.57 71.6 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.242 -0.436 . . . . 10.0 112.055 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -55.86 -60.16 9.51 Favored Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 121.29 -0.164 . . . . 10.0 111.293 179.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -70.06 -30.86 20.23 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 121.492 1.461 . . . . 10.0 110.69 178.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -63.19 -43.03 99.37 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 116.544 -0.298 . . . . 10.0 111.379 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 13.6 p -69.88 -30.83 68.38 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.087 -0.708 . . . . 10.0 109.087 178.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -68.5 -39.27 81.34 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.642 -0.873 . . . . 10.0 108.642 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 74.4 mt-10 -67.17 -36.29 81.48 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 107.859 -1.163 . . . . 10.0 107.859 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 70.0 mt -61.82 -38.08 86.82 Favored 'General case' 0 C--O 1.222 -0.361 0 N-CA-C 108.681 -0.859 . . . . 10.0 108.681 178.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 48.6 mtt180 -67.63 -33.28 74.65 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -67.17 -53.67 28.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.763 -0.653 . . . . 10.0 109.455 178.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -63.98 -39.46 94.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.915 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 19.0 mt -61.6 -43.55 98.65 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 178.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.82 -47.47 84.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.674 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.58 -47.37 85.84 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.348 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 8.1 mmt180 -61.69 -44.67 96.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.336 179.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 63.5 mt -65.57 -44.05 87.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.775 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -61.5 -37.04 82.22 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.044 0.45 . . . . 10.0 110.354 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -74.53 -43.31 56.41 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.445 -0.576 . . . . 10.0 109.445 178.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 7.9 mt -63.8 -27.61 69.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.637 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -76.24 -40.35 52.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.893 0.378 . . . . 10.0 110.139 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -71.47 -53.96 12.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.064 -0.516 . . . . 10.0 109.633 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -65.89 -31.21 72.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.629 -0.714 . . . . 10.0 109.724 179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -70.6 -42.61 62.71 Favored Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.141 -0.783 . . . . 10.0 111.141 178.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.18 -40.96 99.66 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 109.637 -1.385 . . . . 10.0 109.637 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -67.84 -43.01 80.5 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.157 -0.683 . . . . 10.0 109.157 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 20.9 mtt180 -54.55 -50.7 67.31 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.406 178.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 87.7 mt -58.98 -42.89 91.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.498 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -64.15 -45.79 86.9 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -60.36 -50.61 72.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.128 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -59.05 -43.72 91.72 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.062 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -68.74 -44.64 73.34 Favored 'General case' 0 C--N 1.33 -0.252 0 O-C-N 123.11 0.257 . . . . 10.0 111.434 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.57 -33.3 73.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.234 0.54 . . . . 10.0 110.688 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 4.9 mtmm -86.75 -20.71 27.25 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.246 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -72.49 -38.74 68.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.086 -0.506 . . . . 10.0 109.764 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -40.63 94.79 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 178.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -69.16 -27.56 65.64 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.671 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -71.33 -47.77 54.52 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 108.159 -1.052 . . . . 10.0 108.159 177.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 84.9 mt -62.26 -43.2 99.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.124 -0.944 . . . . 10.0 111.984 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 10.0 p -60.43 -50.41 73.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.731 0.3 . . . . 10.0 111.095 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 7.5 p -66.38 -35.96 81.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.942 179.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 34.1 mt -67.27 -31.6 72.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.429 -0.35 . . . . 10.0 110.185 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 50.7 m -67.81 -29.34 68.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.147 0.499 . . . . 10.0 109.929 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -76.3 -5.18 45.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.526 0.679 . . . . 10.0 109.73 178.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 39.6 mttm -109.13 -38.92 5.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.83 -0.804 . . . . 10.0 108.83 178.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -71.07 -21.12 62.28 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.502 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -105.62 -74.48 0.02 OUTLIER Pre-proline 0 CA--C 1.537 0.448 0 N-CA-C 112.457 0.54 . . . . 10.0 112.457 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.63 -47.74 15.27 Favored 'Trans proline' 0 C--N 1.357 1.005 0 C-N-CA 122.27 1.98 . . . . 10.0 113.278 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -66.93 -43.19 83.9 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.912 -0.315 . . . . 10.0 111.327 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 1.1 mt -65.92 -39.05 90.18 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 121.03 -0.268 . . . . 10.0 110.901 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -64.43 -38.55 91.42 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.036 -0.728 . . . . 10.0 109.036 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -63.37 -41.44 98.82 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 79.3 mt -62.82 -45.0 94.66 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.362 -0.836 . . . . 10.0 110.006 178.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 72.0 mtt180 -64.95 -40.11 94.52 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.583 -0.525 . . . . 10.0 109.583 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -63.54 -30.97 72.01 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.56 -0.745 . . . . 20.0 112.051 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -85.75 -34.85 12.43 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 109.481 -1.448 . . . . 10.0 109.481 178.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 13.9 mt -57.11 -41.88 79.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.652 -0.274 . . . . 10.0 111.51 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 72.8 mt -54.34 -62.98 3.14 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 112.491 0.552 . . . . 10.0 112.491 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -63.39 -37.52 48.87 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 121.836 1.691 . . . . 10.0 111.657 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 18.3 t -61.66 -49.39 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 O-C-N 122.986 0.179 . . . . 10.0 110.677 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 59.4 mt -61.38 -39.45 90.72 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.503 -0.554 . . . . 10.0 109.503 178.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -63.24 -49.28 74.75 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.678 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 5.1 p -63.02 -38.92 93.11 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 120.928 0.394 . . . . 10.0 110.541 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -65.42 -43.43 90.52 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.737 178.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -61.81 -40.25 94.59 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.357 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 73.2 t -60.43 -44.99 97.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 13.5 m -63.73 -42.66 97.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.706 178.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -64.38 -41.13 96.84 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.941 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 83.6 mt -60.1 -37.95 81.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.37 0.605 . . . . 10.0 110.372 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 13.1 m -77.27 -41.11 42.22 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.681 -0.69 . . . . 10.0 110.002 179.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -62.83 -43.52 98.58 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.692 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 77.6 mt -65.54 -32.46 74.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.852 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -66.14 -49.04 68.84 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 179.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.49 -29.05 70.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.742 -0.663 . . . . 10.0 109.891 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -67.86 -20.87 65.18 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.48 0.712 . . . . 10.0 111.078 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.89 12.07 31.08 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 121.091 0.472 . . . . 10.0 110.705 -179.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . 0.582 ' O ' ' CB ' ' A' ' 396' ' ' LYS . 46.3 mtmt -129.48 154.03 47.39 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.09 0.471 . . . . 10.0 111.265 179.101 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . 0.582 ' CB ' ' O ' ' A' ' 395' ' ' LYS . 99.4 mttt 90.08 -54.63 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.891 0 N-CA-C 112.914 0.709 . . . . 10.0 112.914 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 96.0 mt -59.91 -44.23 94.41 Favored 'General case' 0 C--N 1.353 0.734 0 N-CA-C 112.673 0.62 . . . . 10.0 112.673 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 . . . . . 0 CA--C 1.512 -0.506 0 N-CA-C 108.199 -1.037 . . . . 10.0 108.199 178.382 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 89.8 mt . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 108.574 -0.898 . . . . 10.0 108.574 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt 79.19 -56.02 0.43 Allowed 'General case' 0 C--O 1.236 0.391 0 CA-C-N 113.64 -1.618 . . . . 10.0 110.99 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.89 -32.41 71.86 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 120.783 0.325 . . . . 10.0 111.518 179.068 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 12.9 mt -78.08 -31.61 50.27 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.874 -0.417 . . . . 10.0 109.874 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -71.81 -47.87 50.29 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.009 -0.996 . . . . 10.0 111.51 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -62.91 -42.58 99.84 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 114.956 -1.02 . . . . 10.0 110.567 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -37.43 75.98 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 123.337 0.398 . . . . 10.0 110.563 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -62.18 -44.15 97.24 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.326 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 3.1 m -64.89 -36.11 83.3 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.331 0.586 . . . . 10.0 109.582 178.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 62.4 t -67.47 -46.95 82.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.06 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 52.6 m -60.83 -43.58 98.07 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.441 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 28.7 m -62.71 -40.41 97.05 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 120.846 0.355 . . . . 10.0 110.633 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 10.9 p -76.65 -11.23 59.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 10.0 111.057 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 45.8 t80 -85.6 -38.59 18.27 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 108.667 -0.864 . . . . 10.0 108.667 177.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 24.9 m -62.25 -39.91 94.42 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.616 -0.883 . . . . 10.0 108.616 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -66.49 -19.81 65.88 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.284 -0.871 . . . . 10.0 110.451 178.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 30.1 mt -76.37 -32.97 58.91 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 108.529 -0.915 . . . . 10.0 108.529 177.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 -74.16 -42.59 59.68 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 178.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -68.17 -14.09 62.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.624 -0.717 . . . . 10.0 109.852 178.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -94.67 -53.72 3.77 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.171 -0.922 . . . . 10.0 108.989 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 43.5 mt -60.32 -28.92 68.52 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.711 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -54.19 -73.03 0.45 Allowed Glycine 0 CA--C 1.518 0.256 0 N-CA-C 111.37 -0.692 . . . . 10.0 111.37 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.32 -34.9 98.67 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.391 2.061 . . . . 10.0 111.177 178.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 12.6 t -58.87 -50.0 81.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.273 -0.422 . . . . 10.0 111.08 179.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 18.4 p -70.22 -38.2 75.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.66 0.267 . . . . 10.0 110.805 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -60.52 -48.32 82.27 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.816 -0.439 . . . . 10.0 109.816 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -67.39 -37.75 83.61 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.077 -0.511 . . . . 10.0 109.624 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -63.19 -36.91 85.2 Favored 'General case' 0 C--O 1.225 -0.188 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 28.4 m95 -66.27 -42.9 87.79 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 178.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -65.17 -37.31 86.98 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.972 -0.751 . . . . 10.0 108.972 178.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -65.28 -44.79 86.9 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.702 -0.851 . . . . 10.0 108.702 177.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 46.9 mt -62.38 -32.43 73.24 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.469 -0.787 . . . . 10.0 109.371 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -66.37 -41.6 89.23 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 178.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 53.0 mttp -64.72 -45.27 87.22 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 108.423 -0.954 . . . . 10.0 108.423 178.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -61.2 -48.42 81.63 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.051 -0.977 . . . . 10.0 110.734 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 10.7 p -66.17 -38.6 88.44 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.826 -0.17 . . . . 10.0 111.195 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -61.59 -47.59 84.76 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.843 -0.799 . . . . 10.0 108.843 178.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -63.87 -46.5 91.49 Favored Glycine 0 N--CA 1.443 -0.889 0 N-CA-C 110.048 -1.221 . . . . 10.0 110.048 177.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 34.6 mt -58.61 -33.26 69.81 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-O 120.517 0.199 . . . . 10.0 110.925 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -70.32 -38.29 74.9 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 178.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -71.39 -30.54 66.24 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.017 -0.735 . . . . 10.0 109.017 178.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -75.29 -57.56 3.82 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.253 -0.885 . . . . 10.0 109.782 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 95.7 mmm -61.71 -29.21 69.95 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 113.743 1.016 . . . . 10.0 113.743 -178.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 5.5 p -63.15 -51.87 64.72 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -71.62 -36.23 70.71 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.587 -0.733 . . . . 10.0 109.531 178.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -57.29 -57.72 11.39 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.503 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 24.9 mt -64.18 -37.13 86.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.568 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -62.67 -49.94 73.16 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 178.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -66.14 -34.02 77.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.661 -0.7 . . . . 10.0 109.662 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 2.6 t -60.96 -46.93 95.63 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.232 0 N-CA-C 109.367 -0.605 . . . . 10.0 109.367 178.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 83.9 mttt -67.21 -38.38 85.21 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 178.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -70.35 -11.69 61.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.318 178.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 43.3 mttm -98.76 -50.1 4.35 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 63.0 t -58.22 -41.71 81.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.688 -0.687 . . . . 10.0 111.998 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -53.95 -63.52 2.57 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 112.213 0.449 . . . . 10.0 112.213 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -70.98 -20.9 28.5 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 121.643 1.562 . . . . 10.0 111.789 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -70.0 -50.85 37.4 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 17.5 mt -69.47 -36.31 76.45 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.061 -0.518 . . . . 10.0 109.915 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -62.13 -40.45 95.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.286 0.565 . . . . 10.0 110.558 179.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -79.33 -42.67 25.16 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.621 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -63.31 -40.89 98.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.662 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -62.44 -36.61 82.97 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.446 179.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 17.9 mttp -67.35 -40.6 85.84 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.054 -0.721 . . . . 10.0 109.054 178.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 15.5 mtmm -65.7 -43.74 88.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.324 178.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 23.6 m0 -66.39 -34.4 77.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.15 178.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -67.0 -53.03 35.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.281 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . 0.517 ' O ' ' CG ' ' C' ' 469' ' ' LEU . 4.1 pt-20 -63.3 -31.61 72.8 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.076 0.465 . . . . 10.0 110.295 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -73.83 -37.82 64.72 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.188 -0.671 . . . . 10.0 109.188 178.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -45.73 88.9 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.743 -0.836 . . . . 10.0 108.743 178.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -62.42 -40.45 96.58 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.498 -0.927 . . . . 10.0 108.498 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . 0.772 ' CD1' ' CG ' ' A' ' 308' ' ' ARG . 96.4 mt -61.92 -40.16 94.53 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 115.169 -0.923 . . . . 20.0 110.0 178.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 13.8 m-30 -67.23 -41.26 86.0 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.501 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -60.82 -48.57 81.21 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.34 28.12 0.47 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.595 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.99 -62.78 0.71 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.383 -0.826 . . . . 10.0 109.028 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 61.8 t -65.66 -39.11 83.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.26 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -62.42 -58.62 16.18 Favored Pre-proline 0 CA--C 1.535 0.394 0 N-CA-C 112.061 0.393 . . . . 10.0 112.061 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -63.52 -37.88 45.39 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 121.649 1.566 . . . . 10.0 111.389 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 29.2 mt -66.98 -31.38 71.91 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.49 179.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -63.56 -36.19 82.98 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -70.89 -43.31 68.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.492 178.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.95 -43.61 95.29 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 59.1 mt -68.95 -30.48 68.94 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.551 -0.75 . . . . 10.0 110.195 178.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -66.97 -47.54 71.27 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -69.26 -34.27 74.51 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -68.21 -40.94 87.56 Favored Glycine 0 N--CA 1.445 -0.724 0 N-CA-C 109.873 -1.291 . . . . 10.0 109.873 177.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.41 76.72 Favored 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 44.8 mtt180 -61.73 -41.56 97.8 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.69 -44.22 94.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.363 178.007 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -67.14 -40.4 86.74 Favored 'General case' 0 C--N 1.33 -0.249 0 O-C-N 123.276 0.36 . . . . 10.0 110.355 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 45.6 mt -64.76 -44.51 89.83 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.349 -0.611 . . . . 10.0 109.349 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.04 -39.19 91.48 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 108.795 -0.817 . . . . 10.0 108.795 178.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -61.71 -49.97 74.31 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 108.133 -1.062 . . . . 10.0 108.133 177.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 90.3 mt -58.89 -37.34 76.36 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.872 -0.603 . . . . 10.0 110.674 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -63.69 -37.05 85.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.91 0.386 . . . . 10.0 110.151 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -88.93 -0.88 57.78 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.626 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 12.3 mttm -113.37 -55.75 2.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.817 0.341 . . . . 10.0 110.998 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 90.8 mt -64.96 -31.52 72.8 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.913 0.709 . . . . 10.0 112.913 -178.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 12.8 m -68.14 -59.09 6.69 Favored Pre-proline 0 CA--C 1.537 0.459 0 C-N-CA 120.722 -0.391 . . . . 10.0 112.005 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -62.63 -36.63 62.8 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.745 1.63 . . . . 10.0 110.866 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 34.5 mt -71.04 -34.96 71.77 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.095 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -65.7 -49.56 58.96 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 110.725 -0.95 . . . . 10.0 110.725 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.11 -41.63 97.03 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 178.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -64.84 -47.61 77.34 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.493 -0.776 . . . . 10.0 109.819 179.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 62.9 mmm -59.44 -38.05 79.7 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.752 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 20.5 mtt85 -64.98 -40.47 95.03 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 178.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.63 -36.1 73.27 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 178.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 44.3 mtt180 -62.87 -45.86 90.57 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 107.442 -1.318 . . . . 10.0 107.442 177.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -62.21 -38.73 90.29 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 114.857 -1.065 . . . . 10.0 109.361 178.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 78.7 mtt180 -58.3 -53.57 56.81 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -60.08 -36.14 76.73 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.485 -0.78 . . . . 10.0 111.144 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 16.2 m-70 -74.47 -49.64 21.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.577 0.227 . . . . 10.0 111.549 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 79.2 t -65.74 -41.67 90.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 120.715 0.293 . . . . 10.0 110.509 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -63.97 -37.41 87.32 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.48 -44.78 86.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.344 -0.984 . . . . 10.0 108.344 177.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 89.2 mt -58.99 -32.67 69.89 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.372 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 66.4 mtt180 -65.04 -34.7 79.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.326 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.3 5.19 46.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.684 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 44.2 m170 -117.22 -43.97 2.81 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.848 0.314 . . . . 10.0 111.848 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 92.1 mt -90.07 -47.83 7.57 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.409 0.522 . . . . 10.0 112.409 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -50.54 -55.37 26.68 Favored Pre-proline 0 N--CA 1.468 0.472 0 N-CA-C 112.904 0.705 . . . . 10.0 112.904 -179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -64.91 -31.8 56.0 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 121.692 1.595 . . . . 10.0 110.701 178.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -64.11 -43.85 94.06 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.725 -0.67 . . . . 10.0 109.786 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.85 -31.24 71.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.001 0.429 . . . . 10.0 109.968 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -70.02 -39.14 75.97 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.425 -0.583 . . . . 10.0 109.425 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -72.38 -33.23 67.05 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 177.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 25.3 mt -66.89 -29.13 68.94 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.541 -0.754 . . . . 10.0 109.23 177.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -60.91 -38.62 86.37 Favored 'General case' 0 C--O 1.224 -0.249 0 N-CA-C 109.681 -0.489 . . . . 10.0 109.681 178.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -66.95 -44.47 80.5 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.831 -0.803 . . . . 10.0 108.831 178.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 77.6 mtt180 -63.85 -41.77 97.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 114.849 -1.069 . . . . 10.0 110.662 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 62.1 mt -68.09 -43.18 79.08 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.256 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.87 -43.51 98.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.922 179.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.3 -45.1 77.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.361 -0.381 . . . . 10.0 110.153 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 1.1 ttm180 -61.9 -40.58 95.96 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 18.9 mt -64.29 -36.6 84.64 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.021 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -66.37 -40.92 90.02 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.839 -0.43 . . . . 10.0 109.839 178.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.26 -45.8 86.49 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 178.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 91.6 mt -69.94 -19.05 63.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.539 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 64.7 tttt -82.23 -44.37 16.42 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.662 -0.496 . . . . 10.0 109.662 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -68.6 -50.23 53.17 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -67.97 -37.58 81.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.727 -0.669 . . . . 10.0 109.388 179.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -65.75 -43.04 94.84 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.251 -0.74 . . . . 10.0 111.251 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -63.18 -42.54 99.39 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 110.399 -1.08 . . . . 10.0 110.399 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -64.3 -42.69 96.24 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 44.4 mtt85 -60.14 -39.54 86.71 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.367 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 79.8 mt -58.62 -42.23 87.76 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.92 -45.33 74.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.754 -0.657 . . . . 10.0 109.437 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -60.0 -48.49 81.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.318 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -59.72 -39.84 86.03 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.261 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 40.5 m170 -65.98 -43.26 88.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.449 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.48 -44.8 85.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.091 -0.504 . . . . 10.0 109.876 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.85 -27.33 66.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.256 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.62 -44.7 73.66 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.163 -0.68 . . . . 10.0 109.163 178.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.94 -38.19 85.71 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.702 -0.481 . . . . 10.0 109.702 178.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -63.86 -36.71 84.83 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -72.05 -45.65 59.97 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.105 178.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 63.1 mt -61.68 -38.74 88.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.099 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 33.9 m -64.4 -46.35 83.68 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.5 -0.318 . . . . 10.0 110.38 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 1.1 p -69.47 -26.94 64.81 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.103 0.477 . . . . 10.0 110.694 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 54.2 mt -77.91 -25.84 48.68 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.391 178.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 56.7 m -64.59 -41.24 96.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.042 0.449 . . . . 10.0 111.112 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -72.96 -11.47 60.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.176 0.512 . . . . 10.0 111.005 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -104.51 -28.13 11.48 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.792 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -83.96 -18.49 37.09 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.433 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -112.29 -74.9 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.348 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -52.92 -49.19 18.45 Favored 'Trans proline' 0 C--N 1.359 1.081 0 C-N-CA 122.171 1.914 . . . . 10.0 112.517 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.18 95.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.698 0.285 . . . . 10.0 110.923 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 49.5 tp -66.78 -38.87 87.41 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.579 -0.282 . . . . 10.0 110.46 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . 0.524 ' O ' ' CG ' ' C' ' 571' ' ' GLN . 4.0 mm-40 -59.06 -45.56 90.46 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.671 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -68.91 -41.59 77.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.449 178.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 43.6 mt -58.98 -44.93 91.66 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.837 0.351 . . . . 10.0 110.123 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -68.85 -35.54 77.07 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.576 -0.528 . . . . 10.0 109.576 178.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . 0.524 ' CG ' ' O ' ' C' ' 567' ' ' GLU . 98.6 mt-30 -66.28 -30.68 71.16 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.447 -0.797 . . . . 20.0 111.346 179.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -84.02 -35.76 14.73 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 109.429 -1.468 . . . . 10.0 109.429 178.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 17.8 mt -62.28 -34.47 76.63 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 122.044 0.138 . . . . 10.0 111.302 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 91.4 mt -55.63 -63.25 3.34 Favored Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 112.003 0.372 . . . . 10.0 112.003 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -67.38 -29.25 38.34 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.877 1.718 . . . . 10.0 111.708 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 4.7 t -64.9 -45.21 95.49 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 N-CA-C 109.343 -0.614 . . . . 10.0 109.343 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 26.7 mt -64.5 -39.51 93.93 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.614 -0.513 . . . . 10.0 109.614 178.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -63.17 -51.19 67.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.056 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 4.7 p -62.19 -41.33 98.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.779 0.323 . . . . 10.0 110.343 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -61.7 -48.27 81.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.072 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -58.75 -46.77 86.7 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.406 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.95 -48.49 83.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.887 0.375 . . . . 10.0 110.286 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 16.2 m -61.62 -44.06 97.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.109 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -66.97 -41.18 87.3 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.521 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 73.2 mt -59.28 -51.28 70.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.875 0.369 . . . . 10.0 110.483 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 13.1 m -63.87 -35.23 79.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.652 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -67.8 -45.35 75.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.574 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 86.2 mt -65.11 -37.03 86.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.011 0.434 . . . . 10.0 110.311 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -66.6 -29.77 69.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.461 179.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -79.5 -44.66 20.81 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.046 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -63.59 -41.89 98.32 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.805 0.669 . . . . 10.0 112.805 -179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 2.1 p -60.69 -28.59 68.74 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.836 0.31 . . . . 10.0 111.836 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -69.19 -40.21 78.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.043 0.449 . . . . 10.0 110.499 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 5.1 mptt -76.68 -37.61 55.9 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.96 -0.564 . . . . 10.0 111.105 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 90.1 mt -85.36 34.53 0.57 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.649 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.515 -0.755 . . . . 10.0 110.007 -179.445 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 19.5 ttt . . . . . 0 C--O 1.23 0.07 0 CA-C-O 121.392 0.615 . . . . 10.0 110.0 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 14.6 t -98.61 168.26 10.28 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.106 -0.952 . . . . 10.0 110.601 -179.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -116.29 101.37 8.62 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.884 -0.413 . . . . 10.0 109.884 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -73.7 144.49 45.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.676 -178.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 4.0 mptt -100.37 113.91 27.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.493 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 34.3 mt -110.01 108.9 19.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.49 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 58.8 t -101.89 115.09 43.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-O 120.961 0.41 . . . . 10.0 110.918 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 21.3 t -91.73 117.74 35.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 26.8 m -112.88 165.45 7.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 120.995 0.426 . . . . 10.0 111.327 -179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 151.07 174.23 21.8 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.21 -0.756 . . . . 10.0 111.21 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.16 177.29 6.01 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.922 0.391 . . . . 10.0 111.271 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.84 125.64 8.48 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.873 -0.679 . . . . 10.0 111.775 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 115.24 -12.98 19.19 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.775 -0.726 . . . . 10.0 112.514 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 20.9 m -72.54 -31.73 38.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 112.003 0.371 . . . . 10.0 112.003 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 93.65 43.4 3.94 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.54 -0.838 . . . . 10.0 113.204 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 42.0 mtmt -62.13 -46.88 87.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.854 0.359 . . . . 10.0 111.64 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.5 p -63.26 -36.52 83.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.465 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.48 -47.15 82.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.653 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 45.1 mt -62.69 -44.27 96.67 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.918 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 12.7 m -64.88 -50.15 67.67 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.672 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 97.4 mt -65.43 -28.26 43.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-O 120.782 0.325 . . . . 10.0 110.999 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -68.29 -22.62 64.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.153 0.501 . . . . 10.0 110.8 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.7 tp -96.93 -41.48 8.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.306 0.574 . . . . 10.0 110.481 179.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 51.1 mm -73.88 -49.16 35.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.691 -0.686 . . . . 10.0 112.506 -178.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -107.83 -18.92 13.69 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.092 0.404 . . . . 10.0 112.092 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 66.61 35.22 5.45 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.468 -0.938 . . . . 10.0 108.468 -177.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -124.53 130.99 53.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 114.183 -1.371 . . . . 10.0 109.628 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -93.51 134.76 35.45 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.456 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 16.7 m -100.43 138.41 24.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.996 0.427 . . . . 10.0 111.031 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -103.46 -26.57 12.82 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.508 0.671 . . . . 10.0 109.838 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -78.38 148.31 33.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.384 -0.826 . . . . 10.0 110.726 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -91.47 77.64 5.74 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.651 -0.5 . . . . 10.0 109.651 178.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.85 134.91 68.06 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.094 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.49 177.17 3.48 Favored 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 123.081 2.521 . . . . 10.0 112.849 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -166.72 135.37 2.82 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.199 0.523 . . . . 10.0 112.163 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 4.3 mt -119.98 -67.01 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 108.551 -0.907 . . . . 10.0 108.551 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -146.08 92.39 2.19 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.372 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 -111.79 160.84 16.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.379 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.7 p -148.1 139.89 23.88 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.643 -0.253 . . . . 10.0 111.594 -179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . 0.417 ' CE2' ' CG2' ' D' ' 840' ' ' VAL . 24.3 m-85 -125.53 145.28 50.18 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -178.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -126.81 127.98 45.85 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.754 0.311 . . . . 10.0 111.561 -178.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 37.9 tttp -151.24 150.69 30.87 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.589 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -114.07 125.2 53.71 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 110.326 -0.249 . . . . 10.0 110.326 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 10.3 m -136.19 158.83 38.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.965 0.412 . . . . 10.0 110.848 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 47.2 t -99.77 107.11 20.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.414 -0.587 . . . . 10.0 109.414 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 72.7 mt -106.19 120.01 56.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.82 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.88 16.1 7.71 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.808 0.67 . . . . 10.0 112.808 178.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.21 -9.03 45.64 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.755 -0.736 . . . . 10.0 112.666 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -106.97 124.33 49.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.037 0.446 . . . . 10.0 110.665 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 9.5 t -85.75 128.1 34.71 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.101 -0.499 . . . . 10.0 109.742 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 1.6 p -144.71 163.05 35.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.866 0.365 . . . . 10.0 111.42 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 15.1 tp -97.5 135.75 38.91 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.09 -0.708 . . . . 10.0 109.09 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 90.6 mt -113.6 122.72 48.06 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 111.986 0.365 . . . . 10.0 111.986 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -103.53 102.33 12.23 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.103 -1.073 . . . . 10.0 108.103 177.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 44.8 mt -93.58 129.52 43.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.447 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 53.4 tp -105.94 116.0 31.2 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.943 -0.572 . . . . 10.0 111.206 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -92.97 93.2 8.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.236 179.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 48.7 p -72.61 162.71 29.13 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.203 -0.908 . . . . 10.0 112.155 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.6 159.07 32.68 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.232 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -80.05 -32.07 37.03 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.747 -0.739 . . . . 10.0 111.918 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -139.24 128.45 23.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.618 0.247 . . . . 20.0 110.541 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -169.92 142.88 2.46 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.591 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -100.98 -141.33 0.34 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.252 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -68.22 122.43 18.3 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 13.5 t -144.99 125.08 13.61 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.172 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.27 -31.79 72.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.111 0.482 . . . . 10.0 109.909 179.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 40.7 mmm -70.86 -44.52 66.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.691 -0.686 . . . . 10.0 109.599 179.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 47.9 ttt85 -63.27 -44.86 93.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.71 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.25 -20.84 57.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.677 -0.692 . . . . 10.0 111.593 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.93 -47.92 6.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.114 179.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . 0.253 0.5 OUTLIER -66.01 -28.52 68.94 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 113.121 0.786 . . . . 10.0 113.121 -178.968 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 2.7 mtp -91.82 4.07 53.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.185 0.517 . . . . 10.0 110.609 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 11.7 ttm180 -98.33 -28.35 13.7 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.135 0.493 . . . . 10.0 110.402 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.6 -5.7 53.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.615 -0.72 . . . . 10.0 112.119 -179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -83.15 144.16 22.46 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.552 -0.832 . . . . 10.0 112.701 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -96.68 -49.28 5.16 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.033 0.444 . . . . 10.0 110.005 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -112.19 139.61 15.73 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 111.203 -0.759 . . . . 10.0 111.203 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -121.25 123.58 42.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.166 0.507 . . . . 10.0 111.999 -179.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 45.0 mt -95.4 108.72 20.94 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.107 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 11.4 m -84.58 88.93 7.36 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.991 -0.374 . . . . 10.0 109.991 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 43.7 t -90.52 127.72 42.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.78 -178.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -132.78 159.38 39.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.108 178.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -96.04 119.86 35.29 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.993 -0.373 . . . . 10.0 109.993 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 13.1 pt -69.6 -5.45 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 112.231 0.456 . . . . 10.0 112.231 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -94.33 -1.8 53.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.984 0.421 . . . . 10.0 110.949 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -138.86 112.34 8.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.244 -0.434 . . . . 10.0 110.693 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.18 -33.73 72.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.024 -0.535 . . . . 10.0 111.939 -179.519 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 38.6 tptt -62.07 -34.56 76.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.108 0.48 . . . . 10.0 110.368 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 31.8 t -67.27 -30.21 70.03 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.091 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -80.72 -38.6 28.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.372 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -72.02 -23.26 61.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.833 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.43 -3.57 53.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.525 -0.307 . . . . 10.0 111.549 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 22.4 mm -61.48 -39.73 83.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.278 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 28.9 t60 -64.16 -33.57 76.1 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 5.1 t-160 -60.95 -39.91 91.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.443 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -74.66 -39.84 61.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.654 179.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -56.2 -44.57 79.58 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.185 -0.462 . . . . 10.0 110.359 179.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -66.34 -40.27 89.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.883 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -64.81 -47.9 76.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.482 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 58.6 mt -62.89 -44.71 99.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.883 0.373 . . . . 10.0 110.25 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 13.1 tttp -59.37 -37.84 78.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.302 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 65.4 ttp85 -67.5 -47.21 70.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.779 -0.646 . . . . 10.0 112.109 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 34.1 m -71.35 -25.85 25.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 112.672 0.619 . . . . 10.0 112.672 -178.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -95.14 -10.28 31.07 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 25.8 t0 58.79 22.88 10.59 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.486 0.66 . . . . 10.0 111.309 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 4.6 m -144.47 151.88 39.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.85 -0.613 . . . . 10.0 110.647 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -92.76 -38.49 11.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.147 0.498 . . . . 10.0 110.895 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -81.43 62.54 5.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.459 0.647 . . . . 10.0 112.382 -178.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 49.1 t -101.46 132.92 21.22 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.74 -0.664 . . . . 10.0 109.243 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -57.11 104.7 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.94 2.426 . . . . 10.0 112.382 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 43.2 mtt -130.88 143.63 50.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.881 -0.599 . . . . 10.0 109.695 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 92.4 t -128.29 127.67 67.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.612 -0.514 . . . . 10.0 109.612 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 18.9 tp -81.0 120.91 25.38 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 40.3 t -118.52 117.66 55.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.904 0.383 . . . . 10.0 111.426 -178.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.71 99.59 2.1 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 110.237 -1.145 . . . . 10.0 110.237 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -88.9 163.71 15.49 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.889 0.329 . . . . 10.0 111.889 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 30.4 mtpt 70.83 38.87 1.12 Allowed 'General case' 0 C--O 1.231 0.096 0 CA-C-N 115.257 -0.883 . . . . 10.0 112.258 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 28.2 p -76.21 2.0 14.37 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.077 -0.511 . . . . 10.0 111.441 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -95.18 -4.58 45.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.458 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 46.7 mt -80.89 139.21 49.87 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.846 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -68.72 -27.81 31.39 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.757 2.305 . . . . 10.0 112.583 -179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 2.1 m -85.07 59.01 5.36 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.388 0.514 . . . . 10.0 112.388 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 36.7 ttm-85 -72.11 100.62 2.57 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.217 -0.66 . . . . 10.0 109.217 178.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.7 m -88.75 -31.54 18.36 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.618 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 25.0 t -102.08 117.59 47.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.051 179.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -79.35 151.34 31.06 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.366 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 6.7 m -56.84 -37.12 70.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.416 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -64.29 -42.24 96.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.86 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -62.04 -47.75 83.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.202 0.525 . . . . 10.0 110.305 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -62.98 -44.49 95.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.653 -0.703 . . . . 10.0 111.269 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -68.15 -33.1 73.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.539 -0.3 . . . . 10.0 111.427 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.94 -43.0 99.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.392 0.615 . . . . 10.0 109.852 178.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 14.5 tp -67.21 -46.76 72.89 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.476 -0.784 . . . . 10.0 110.014 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.51 -43.06 99.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.833 -0.621 . . . . 10.0 110.844 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -60.59 -34.14 73.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.947 -0.569 . . . . 10.0 110.8 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 20.7 m -73.14 -27.13 61.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.47 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -90.41 -14.52 32.76 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.131 0.491 . . . . 10.0 110.957 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 79.97 32.33 36.49 Favored Glycine 0 N--CA 1.446 -0.661 0 N-CA-C 111.351 -0.699 . . . . 10.0 111.351 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 45.8 pt -127.38 153.98 77.2 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 110.164 -0.31 . . . . 10.0 110.164 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -79.49 157.26 25.33 Favored 'Trans proline' 0 CA--C 1.531 0.351 0 C-N-CA 122.593 2.195 . . . . 10.0 112.408 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -127.27 126.72 43.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.373 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 34.4 mm -121.19 124.69 72.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.317 -0.402 . . . . 10.0 110.164 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -86.63 125.44 33.84 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 107.525 -1.287 . . . . 10.0 107.525 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 71.5 p -134.96 173.82 11.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.51 0.93 . . . . 10.0 113.51 -176.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 13.3 t -155.97 108.39 2.62 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.347 -1.297 . . . . 10.0 108.054 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -61.85 -27.07 68.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.275 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -68.69 -41.69 78.82 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.457 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 27.3 p -98.57 -4.83 33.24 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.869 0.322 . . . . 10.0 111.869 -178.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 26.5 ttt-85 66.33 14.37 9.65 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.904 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.11 116.72 16.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.563 -178.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 82.53 5.29 89.64 Favored Glycine 0 N--CA 1.452 -0.299 0 N-CA-C 114.517 0.567 . . . . 10.0 114.517 177.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 67.8 t -58.83 -50.71 78.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 117.187 0.494 . . . . 10.0 111.713 -179.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -69.71 -42.33 74.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.789 0.328 . . . . 10.0 110.362 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.52 -45.48 69.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.726 -0.67 . . . . 10.0 112.235 -178.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.84 -50.58 73.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.833 0.349 . . . . 10.0 111.652 -179.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -67.48 -42.49 82.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.264 -0.426 . . . . 10.0 111.609 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -61.99 -40.25 94.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.845 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 46.9 m -66.61 -36.39 82.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.615 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 32.8 tp -60.46 -48.56 81.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.353 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 46.6 t -62.55 -35.83 72.03 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.153 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 22.7 ttm-85 -63.77 -45.32 90.33 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.609 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -63.09 -39.33 94.4 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.997 0.427 . . . . 10.0 110.343 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 85.9 mt -61.21 -49.32 85.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.172 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -62.51 -46.67 87.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.895 -0.593 . . . . 10.0 111.957 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -59.12 -43.58 91.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.976 0.417 . . . . 10.0 110.937 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 48.5 t-80 -63.92 -40.92 97.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.704 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -66.14 -43.36 87.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.372 -0.376 . . . . 10.0 111.031 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -62.48 -37.3 85.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.034 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 41.4 tttp -65.73 -35.11 79.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.055 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 80.1 mtp -64.81 -23.82 67.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.183 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 1.9 m -75.53 -15.1 60.42 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.376 0.608 . . . . 10.0 109.88 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 29.1 ttpp -106.92 -54.74 2.42 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.02 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -115.17 109.72 18.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.914 -0.584 . . . . 10.0 109.431 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . -126.84 -112.32 1.77 Allowed Glycine 0 N--CA 1.446 -0.68 0 N-CA-C 111.401 -0.68 . . . . 10.0 111.401 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 27.0 tptt -78.14 111.46 14.09 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -140.37 132.6 28.16 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.458 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -144.49 -176.98 5.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.062 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -60.58 133.08 55.75 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.586 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . 0.431 ' NZ ' ' N1 ' ' A' ' 34' ' ' 17F . 18.2 ptpt -158.1 177.28 11.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.669 -0.696 . . . . 10.0 109.816 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 51.0 tttm 70.78 -73.29 0.1 Allowed 'General case' 0 N--CA 1.467 0.408 0 O-C-N 123.738 0.649 . . . . 10.0 112.232 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 1.5 m -79.39 92.77 5.24 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.966 0.412 . . . . 10.0 110.399 -179.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . 0.407 ' NZ ' ' O2P' ' A' ' 3' ' ' PCW . 19.7 mttm -66.57 -52.17 48.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.516 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 57.29 39.34 28.61 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.186 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 28.7 mmtp 55.94 80.5 0.14 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.293 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 45.2 m . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.948 -179.465 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.506 0 N-CA-C 112.291 -0.323 . . . . 10.0 112.291 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 1.5 p -132.91 164.82 26.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.461 0.172 . . . . 10.0 110.593 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 91.5 t -118.64 123.23 71.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 120.756 0.312 . . . . 10.0 110.488 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -87.95 107.88 18.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.278 -0.419 . . . . 10.0 109.883 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 43.5 t -94.9 129.33 45.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.477 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -96.3 136.24 37.04 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.61 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 58.4 mt -107.32 153.23 41.3 Favored Pre-proline 0 C--N 1.319 -0.73 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.155 -178.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.82 56.64 4.2 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.929 2.419 . . . . 10.0 111.111 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -157.2 32.6 0.29 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.227 -0.897 . . . . 10.0 109.998 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 9.8 ttpt 58.29 28.31 16.49 Favored 'General case' 0 CA--C 1.529 0.163 0 O-C-N 123.788 0.68 . . . . 10.0 110.311 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -138.44 -177.58 4.91 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 114.421 1.267 . . . . 10.0 114.421 -177.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.88 171.11 18.28 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.01 -0.996 . . . . 10.0 112.01 -177.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 14.6 t -152.22 138.81 18.69 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 107.449 -1.315 . . . . 10.0 107.449 178.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 4.0 t -104.53 114.2 43.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 120.059 -0.656 . . . . 10.0 111.553 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 35.2 m -103.31 162.38 4.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.761 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 5.2 m -96.23 140.4 30.97 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.532 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 6.4 t -68.17 121.65 17.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 110.132 -0.322 . . . . 10.0 110.132 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -126.34 113.01 16.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.451 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -67.27 145.55 55.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.285 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 90.29 -38.99 3.14 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.827 -0.701 . . . . 10.0 112.08 -179.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 57.6 ttm -68.39 144.82 54.6 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.651 0.262 . . . . 10.0 110.702 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.77 162.8 12.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.556 -0.293 . . . . 10.0 111.279 -179.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 86.0 t -55.17 -41.51 60.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.186 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -56.35 -32.99 65.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.941 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -75.87 -57.49 3.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.502 -0.317 . . . . 10.0 111.634 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.44 -42.72 99.66 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.688 -179.106 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -74.24 -17.78 60.83 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 113.089 0.774 . . . . 10.0 113.089 -179.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -61.71 -50.12 73.73 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.641 -0.424 . . . . 10.0 109.973 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 35.4 tttt -68.46 -26.96 65.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.648 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -77.22 -22.27 52.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.07 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 37.3 mt -94.52 -43.85 8.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.044 0.449 . . . . 10.0 110.452 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -63.91 -18.39 64.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.857 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 840' ' ' VAL . . . . . 0.417 ' CG2' ' CE2' ' B' ' 40' ' ' TYR . 3.2 p -52.69 -22.96 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 O-C-N 123.801 0.688 . . . . 10.0 112.321 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 15.9 ptp180 -139.15 17.09 2.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.01 0.433 . . . . 10.0 111.809 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 82.05 35.89 19.95 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.955 -0.641 . . . . 10.0 114.592 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 98.7 mt -99.78 149.64 23.15 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 117.427 0.614 . . . . 10.0 110.326 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -119.53 148.55 43.16 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.04 0.448 . . . . 10.0 111.661 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -67.29 -9.1 37.43 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.454 -0.794 . . . . 10.0 112.835 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -94.87 -2.55 50.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.026 0.441 . . . . 10.0 111.901 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 91.3 m -129.17 5.16 5.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.237 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 67.5 m -142.84 147.83 36.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.697 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 12.8 p -130.01 151.05 35.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 17.4 t -108.07 134.06 51.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.059 0.456 . . . . 10.0 111.764 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -109.22 141.97 40.72 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.816 -0.629 . . . . 10.0 109.721 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 31.7 mtm-85 -98.67 135.12 40.63 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.968 -0.752 . . . . 10.0 108.968 178.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 1.7 mt -82.25 81.39 8.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.92 0.39 . . . . 10.0 111.702 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 37.7 mt -88.08 87.78 2.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.549 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 23.0 mmtt 50.83 55.89 8.84 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.438 0.903 . . . . 10.0 113.438 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 86.53 -0.77 87.05 Favored Glycine 0 CA--C 1.518 0.255 0 C-N-CA 120.84 -0.695 . . . . 10.0 114.116 178.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -115.11 135.76 53.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 117.406 0.603 . . . . 10.0 111.011 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 858' ' ' LYS . . . . . 0.403 ' NZ ' ' N1 ' ' A' ' 33' ' ' 17F . 94.5 mttt -92.92 99.69 12.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.528 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 4.5 m -98.34 134.0 41.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.702 -0.226 . . . . 10.0 110.744 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 43.0 t -66.19 130.5 31.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.643 0.258 . . . . 10.0 110.845 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 1.8 t -108.12 153.05 23.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.857 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -88.53 149.84 23.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.155 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 99.8 m95 -73.5 -30.06 62.89 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.655 0.613 . . . . 10.0 112.655 -179.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -80.3 -10.65 59.76 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.821 0.675 . . . . 10.0 112.821 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 5.3 m -67.89 143.79 55.55 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.15 -0.315 . . . . 10.0 110.15 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -74.93 149.56 39.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.74 0.305 . . . . 10.0 110.684 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 7.9 tp -88.16 2.62 5.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.615 0.721 . . . . 10.0 110.498 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -63.53 -51.54 66.18 Favored Pre-proline 0 CA--C 1.539 0.543 0 N-CA-C 113.162 0.801 . . . . 10.0 113.162 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -76.53 14.44 1.21 Allowed 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.162 1.908 . . . . 10.0 112.961 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -98.18 33.0 2.28 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.368 0.604 . . . . 10.0 110.761 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -72.41 116.55 13.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.809 -0.632 . . . . 10.0 111.2 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 73.52 32.0 60.18 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 121.039 -0.6 . . . . 10.0 112.5 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -119.89 152.85 36.72 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.19 -0.3 . . . . 10.0 110.19 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -108.69 135.18 50.36 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.007 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 77.3 mt -113.55 127.47 56.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.55 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 6.3 mt -118.4 117.63 55.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.107 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 12.9 t -87.89 137.69 20.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 109.96 -0.385 . . . . 10.0 109.96 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -135.0 154.98 51.54 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.371 -0.603 . . . . 10.0 109.371 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 10.3 m -80.56 153.58 4.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 116.537 -0.302 . . . . 10.0 110.291 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 50.8 mt . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.365 -0.826 . . . . 10.0 110.863 -179.85 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PCW . . . . . 0.407 ' O2P' ' NZ ' ' B' ' 182' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' 17F . . . . . 0.403 ' N1 ' ' NZ ' ' D' ' 858' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' 17F . . . . . 0.431 ' N1 ' ' NZ ' ' B' ' 179' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 201' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 96.2 mt . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.823 0.344 . . . . 10.0 110.649 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.03 -29.55 69.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.461 0.648 . . . . 10.0 110.13 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 96.6 mt -75.97 -30.45 58.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.47 -0.786 . . . . 10.0 110.115 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 86.1 mt -66.59 -47.66 72.01 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.078 -0.51 . . . . 10.0 109.835 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.98 -44.55 92.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.068 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -63.0 -40.2 97.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.66 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 1.6 m95 -67.01 -29.12 68.86 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.846 -0.342 . . . . 10.0 110.716 179.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.78 -44.61 85.27 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 108.787 -0.819 . . . . 10.0 108.787 178.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.67 -35.39 77.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.835 178.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 82.5 t -69.13 -39.87 79.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 109.341 -0.615 . . . . 10.0 109.341 178.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 45.5 m -62.64 -46.8 86.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.082 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 2.0 p -64.73 -29.81 70.81 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.301 0.572 . . . . 10.0 109.909 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 92.1 m -69.8 -45.16 68.54 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -62.21 -42.17 99.05 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 109.61 -0.515 . . . . 10.0 109.61 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 58.2 m -59.97 -47.8 84.32 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.735 -0.666 . . . . 10.0 109.872 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 5.5 tptt -64.71 -36.67 85.03 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.43 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 40.7 mt -62.84 -46.47 87.75 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 109.485 -0.561 . . . . 10.0 109.485 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -62.9 -42.49 99.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.086 0.469 . . . . 10.0 110.209 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -63.78 -38.05 89.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.492 -0.776 . . . . 10.0 111.23 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.22 -35.49 48.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.724 178.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 25.6 mt -64.09 -27.48 69.12 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.175 -0.466 . . . . 10.0 111.086 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -54.71 -69.04 1.37 Allowed Glycine 0 C--N 1.33 0.238 0 N-CA-C 110.997 -0.841 . . . . 10.0 110.997 178.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -58.27 -33.6 97.79 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.587 2.191 . . . . 10.0 110.91 177.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 6.0 t -59.37 -45.37 93.46 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.257 0 CA-C-O 120.656 0.265 . . . . 10.0 110.293 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 24.0 m -64.54 -37.95 89.34 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.626 -0.509 . . . . 10.0 109.626 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -66.84 -48.53 68.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.019 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 79.7 mt-10 -65.33 -42.14 93.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.232 179.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.54 -49.28 77.32 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.763 -0.458 . . . . 10.0 109.763 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -64.47 -38.78 92.2 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.569 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -59.78 -50.64 73.02 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.598 -0.519 . . . . 10.0 109.598 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 58.6 m-80 -66.01 -40.36 91.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.795 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 65.4 mt -66.91 -36.62 82.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.513 -0.312 . . . . 10.0 111.235 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -67.14 -43.6 81.93 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -65.92 -37.51 86.26 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.046 -0.724 . . . . 10.0 109.046 178.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -63.51 -53.43 52.08 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.404 -0.816 . . . . 10.0 109.33 178.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 14.6 p -66.04 -25.83 67.23 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.521 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -64.92 -49.28 71.02 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 107.996 -1.113 . . . . 10.0 107.996 177.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -65.41 -46.84 84.14 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 109.319 -1.513 . . . . 10.0 109.319 177.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 85.5 mt -56.53 -36.03 68.76 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.648 -0.276 . . . . 10.0 111.172 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 29.8 mtm180 -70.65 -42.0 71.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.995 0.426 . . . . 10.0 110.818 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -71.04 -32.93 69.8 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.459 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -80.64 -41.98 22.93 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.712 -0.677 . . . . 10.0 111.011 179.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 1.6 mmm -63.24 -33.49 75.61 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.62 0.248 . . . . 10.0 111.176 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.8 p -65.36 -41.53 93.75 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.106 -0.701 . . . . 10.0 109.106 178.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -71.44 -43.96 65.72 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.7 -0.852 . . . . 10.0 108.7 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.77 -57.69 9.95 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.419 -0.81 . . . . 10.0 109.564 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 47.1 mt -60.33 -44.74 95.21 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.738 -0.665 . . . . 10.0 111.459 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -59.78 -52.32 65.97 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.475 0.178 . . . . 10.0 111.319 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -63.1 -45.66 91.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.365 -0.38 . . . . 10.0 110.389 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 36.1 t -61.92 -44.33 98.73 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.399 0 CA-C-N 116.447 -0.342 . . . . 10.0 111.455 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -70.54 -48.02 57.52 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.811 0.3 . . . . 10.0 111.811 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -60.52 -40.61 92.06 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.913 0.387 . . . . 10.0 110.829 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt -82.55 -22.33 34.99 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.156 -0.474 . . . . 10.0 111.719 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.91 -26.08 39.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 C-N-CA 121.152 -0.219 . . . . 10.0 110.842 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 20.5 mt-30 -63.08 -61.62 7.06 Favored Pre-proline 0 CA--C 1.531 0.225 0 CA-C-N 116.257 -0.429 . . . . 10.0 109.865 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -62.32 -30.56 81.15 Favored 'Trans proline' 0 C--N 1.359 1.092 0 C-N-CA 121.778 1.652 . . . . 10.0 110.96 177.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -61.74 -54.21 45.62 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.225 0.536 . . . . 10.0 109.7 178.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 79.6 mt -67.95 -46.32 71.75 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 115.397 -0.82 . . . . 10.0 111.207 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -60.18 -39.77 87.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.822 0.344 . . . . 10.0 111.766 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -62.07 -50.63 71.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.112 0.482 . . . . 10.0 110.021 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -69.71 -30.38 68.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.819 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -66.15 -48.08 71.95 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.582 179.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 11.4 mtmt -59.21 -43.08 92.28 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.206 -0.665 . . . . 10.0 109.206 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -65.64 -46.39 79.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.234 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -34.61 74.66 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.535 -0.302 . . . . 10.0 110.404 179.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -65.17 -49.3 70.35 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.058 -0.719 . . . . 10.0 109.058 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -61.7 -41.77 98.03 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -61.68 -46.63 88.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.767 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 5.6 mmt -65.05 -43.87 90.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.652 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 79.8 mt-10 -62.01 -48.6 79.59 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.738 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 66.3 mt -66.61 -35.1 79.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.667 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -63.43 -52.34 61.9 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 46.6 mtt180 -63.12 -39.52 94.94 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 179.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -56.55 -32.93 65.64 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.472 -0.786 . . . . 10.0 110.096 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -90.0 -35.23 15.64 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.478 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 7.6 t -54.45 -40.5 49.49 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.168 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -57.58 -63.29 3.95 Favored Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 111.966 0.358 . . . . 10.0 111.966 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -63.42 -37.23 50.46 Favored 'Trans proline' 0 C--N 1.357 1.018 0 C-N-CA 121.956 1.77 . . . . 10.0 111.798 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 29.4 mt -65.69 -36.55 83.97 Favored 'General case' 0 C--N 1.334 -0.088 0 C-N-CA 121.052 -0.259 . . . . 10.0 110.676 179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -71.53 -34.67 70.26 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.124 -1.065 . . . . 10.0 108.124 178.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -63.83 -41.91 97.75 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.38 -0.97 . . . . 10.0 108.38 177.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -61.22 -46.19 91.45 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.064 -0.717 . . . . 10.0 109.064 177.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 97.0 mt -60.9 -43.62 98.26 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.163 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -63.03 -53.49 52.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.172 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -57.95 -51.12 70.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.287 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -60.53 -46.4 94.47 Favored Glycine 0 N--CA 1.443 -0.837 0 CA-C-N 115.604 -0.726 . . . . 10.0 112.248 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.96 -38.76 89.73 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.644 0.222 . . . . 10.0 110.573 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -59.25 -42.97 92.35 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -71.87 -55.6 7.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.614 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 34.4 mttt -54.87 -46.6 74.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.922 -0.581 . . . . 10.0 111.957 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 78.4 mt -70.8 -32.37 69.43 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 121.259 -0.176 . . . . 10.0 111.023 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.25 -41.51 94.23 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -64.44 -35.15 79.99 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.852 -0.796 . . . . 10.0 108.852 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 79.2 mt -68.43 -38.54 81.3 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.585 -0.734 . . . . 10.0 109.923 178.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -63.18 -37.75 88.47 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.217 -0.661 . . . . 10.0 109.217 178.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -72.23 5.65 2.7 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.094 -0.957 . . . . 10.0 111.117 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -125.02 -36.55 2.53 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.254 178.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 76.8 mt -60.53 -41.81 95.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.399 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 19.5 m -81.38 -64.38 0.28 Allowed Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -55.7 -58.35 1.15 Allowed 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 122.306 2.004 . . . . 10.0 112.853 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 81.3 mt -67.36 -31.16 71.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.699 0.285 . . . . 10.0 110.673 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -65.95 -44.7 91.21 Favored Glycine 0 N--CA 1.449 -0.479 0 N-CA-C 111.334 -0.706 . . . . 10.0 111.334 178.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -60.63 -37.79 82.63 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -64.25 -44.9 90.35 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 178.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 5.6 tpt -62.96 -42.97 99.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.222 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -64.56 -38.13 89.94 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 109.122 -0.696 . . . . 10.0 109.122 178.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -66.56 -43.66 84.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.196 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 11.3 mmt180 -68.76 -26.75 65.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.736 -0.665 . . . . 10.0 109.361 178.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -69.97 -32.0 70.0 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 15.6 mtp180 -62.89 -46.4 88.0 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 107.906 -1.146 . . . . 10.0 107.906 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -66.85 -41.11 87.91 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.434 -0.803 . . . . 10.0 109.633 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -56.14 -49.1 74.9 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.123 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 97.2 t -73.91 -39.76 52.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 115.762 -0.653 . . . . 10.0 111.419 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.87 -42.88 98.76 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.249 0.547 . . . . 10.0 110.232 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -65.1 -33.39 75.91 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.212 178.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 40.5 mt -71.15 -37.66 72.23 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.712 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 81.1 mtt180 -61.02 -53.41 57.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.138 0.494 . . . . 10.0 110.207 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.98 2.69 6.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.337 -0.847 . . . . 10.0 112.245 -179.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.42 -51.64 2.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.65 0.262 . . . . 10.0 110.771 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 91.5 mt -65.04 -35.82 82.4 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.374 -0.375 . . . . 10.0 111.547 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -57.19 -60.4 9.78 Favored Pre-proline 0 CA--C 1.536 0.432 0 C-N-CA 121.138 -0.225 . . . . 10.0 111.316 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -65.0 -33.36 51.51 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 121.603 1.535 . . . . 10.0 111.214 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -62.25 -50.58 71.17 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-N 116.594 -0.276 . . . . 10.0 110.866 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 21.1 p -68.8 -34.25 75.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.356 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -66.03 -41.01 91.5 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -68.87 -36.0 77.58 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.315 -0.995 . . . . 10.0 108.315 177.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 29.3 mt -60.72 -35.05 75.36 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 109.302 -0.629 . . . . 10.0 109.302 178.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 -63.56 -40.81 97.95 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.941 -0.763 . . . . 10.0 108.941 178.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -70.22 -41.98 72.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.027 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 13.6 mtp180 -63.89 -45.75 87.95 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.8 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 64.6 mt -65.85 -37.56 86.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.1 179.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.9 -46.73 88.09 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -60.83 -44.98 96.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.956 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 20.5 mtt180 -62.86 -47.73 82.1 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.144 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 68.1 mt -64.39 -33.82 76.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 10.0 111.432 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -69.81 -44.05 70.81 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.913 -0.403 . . . . 10.0 109.913 178.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.73 -44.33 77.86 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 71.0 mt -66.09 -20.89 66.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.765 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -75.58 -49.06 19.71 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -67.59 -39.06 84.83 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 36.3 t-20 -67.22 -42.61 83.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.285 -0.87 . . . . 10.0 108.921 178.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -62.16 -42.94 99.73 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.564 -0.744 . . . . 10.0 111.566 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.93 -40.75 97.28 Favored Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 110.445 -1.062 . . . . 10.0 110.445 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -67.78 -42.85 81.02 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 178.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 23.5 mtt180 -62.86 -43.54 98.54 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.736 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 13.5 mt -65.02 -46.64 80.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.504 -0.317 . . . . 10.0 110.861 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.02 -43.99 97.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.036 0.446 . . . . 10.0 110.105 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -67.09 -47.48 71.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.142 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -62.05 -33.48 74.46 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 121.115 -0.234 . . . . 10.0 110.445 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.22 -40.84 86.46 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.818 -0.808 . . . . 10.0 108.818 178.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -66.13 -46.16 78.49 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.426 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 19.4 mttm -63.3 -29.51 70.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.761 -0.654 . . . . 10.0 109.946 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.95 -46.37 74.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.988 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.8 -37.17 85.65 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 121.015 0.436 . . . . 10.0 109.891 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -67.74 -41.54 83.25 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -60.63 -48.29 82.45 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 108.841 -0.8 . . . . 10.0 108.841 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 84.3 mt -59.62 -37.81 79.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.986 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 53.9 m -61.87 -56.78 15.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.231 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 17.8 m -63.17 -35.35 79.99 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.41 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 19.7 mt -65.89 -36.4 83.31 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.453 -0.34 . . . . 10.0 110.24 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 70.2 m -65.76 -31.53 72.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.095 0.474 . . . . 10.0 110.524 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -73.93 -8.16 55.05 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 121.377 0.608 . . . . 10.0 109.928 179.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 44.7 mttm -107.93 -38.31 5.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.104 178.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.74 -26.01 63.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.564 -0.743 . . . . 10.0 111.897 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -106.46 -74.29 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 112.794 0.664 . . . . 10.0 112.794 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -56.91 -53.17 5.36 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 122.115 1.876 . . . . 10.0 113.175 -178.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -61.56 -43.77 98.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.674 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 6.5 mt -65.57 -36.26 83.26 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.979 -0.288 . . . . 10.0 110.791 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -63.36 -41.4 98.84 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.88 -39.84 94.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.352 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 84.9 mt -65.63 -40.73 92.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.406 178.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -67.28 -40.78 86.17 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -66.2 -26.73 67.53 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.22 -0.9 . . . . 20.0 111.222 178.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -81.67 -40.3 11.03 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 109.261 -1.536 . . . . 10.0 109.261 178.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 14.2 mt -61.55 -31.65 71.69 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.963 0.357 . . . . 10.0 111.963 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 38.3 mt -54.55 -64.62 1.81 Allowed Pre-proline 0 CA--C 1.537 0.479 0 O-C-N 122.969 0.168 . . . . 10.0 111.027 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -69.26 -32.45 20.64 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.866 1.711 . . . . 10.0 111.364 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 3.9 t -59.38 -49.11 84.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.721 -0.218 . . . . 10.0 110.453 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 37.1 mt -63.92 -31.82 73.13 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.179 -0.464 . . . . 10.0 109.92 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -67.41 -50.91 57.46 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 178.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 1.2 p -59.99 -34.86 73.9 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 120.952 0.406 . . . . 10.0 110.06 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 5.9 m-30 -69.71 -44.7 69.84 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 115.892 -0.594 . . . . 10.0 110.043 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -61.81 -42.46 99.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.491 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 74.7 t -59.58 -43.31 90.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.745 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.4 p -75.04 -37.87 61.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.582 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 14.3 m-30 -66.42 -44.21 83.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.691 0.282 . . . . 10.0 110.489 179.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 51.5 mt -59.17 -43.07 92.12 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.549 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 1.8 p -71.33 -46.63 60.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.229 -0.442 . . . . 10.0 110.769 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -56.66 -41.15 76.74 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.143 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 58.4 mt -59.33 -41.53 89.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.016 0.436 . . . . 10.0 110.378 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -71.78 -37.91 70.38 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.78 -46.16 78.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.442 178.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -65.59 -44.37 86.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.112 0.482 . . . . 10.0 110.432 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 55.8 m -60.17 -45.14 94.11 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.641 -0.709 . . . . 10.0 111.81 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 30.1 mtmt -69.06 -7.12 32.74 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.678 0.622 . . . . 10.0 112.678 -178.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 42.7 mttp -106.03 -38.74 6.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.793 0.33 . . . . 10.0 111.441 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 83.5 mt -76.6 -22.48 54.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.439 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 45.5 t30 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.688 -179.839 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 96.5 mt . . . . . 0 C--O 1.233 0.227 0 CA-C-O 121.57 0.7 . . . . 10.0 109.325 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -87.88 -16.98 32.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.303 -0.862 . . . . 10.0 109.984 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 15.6 tp -55.8 -29.85 60.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.479 -0.782 . . . . 10.0 111.802 -179.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 92.2 mt -61.32 -44.18 97.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.995 0.426 . . . . 10.0 110.078 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -74.87 -38.51 61.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.748 179.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -58.01 -47.0 84.35 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.959 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 13.0 m95 -59.59 -36.26 75.92 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.478 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -64.42 -46.9 81.21 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 109.483 -0.562 . . . . 10.0 109.483 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.16 -40.65 90.65 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.862 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.05 -37.93 81.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.74 178.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 63.0 m -64.44 -49.5 71.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.238 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 7.3 m -63.74 -25.39 68.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.911 0.386 . . . . 10.0 111.799 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 18.0 p -92.74 -5.36 51.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.829 0.347 . . . . 10.0 111.029 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -98.37 -37.72 9.51 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.92 -0.77 . . . . 10.0 108.92 178.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 2.5 p -62.58 -47.32 84.35 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 109.151 -0.685 . . . . 10.0 109.151 178.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 23.3 mttm -63.18 -29.25 70.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.551 -0.749 . . . . 10.0 110.33 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 9.0 mt -66.5 -43.3 85.71 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -69.14 -40.67 78.1 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.628 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -58.81 -42.8 90.0 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -43.23 74.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.459 -0.791 . . . . 10.0 109.953 178.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 37.7 mt -57.5 -33.14 67.73 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.893 -0.594 . . . . 10.0 112.062 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -53.09 -78.52 0.11 Allowed Glycine 0 CA--C 1.521 0.455 0 C-N-CA 121.34 -0.457 . . . . 10.0 112.079 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -53.42 -38.14 82.5 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 122.941 2.427 . . . . 10.0 111.829 178.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 16.0 t -58.96 -46.86 91.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-N 116.548 -0.297 . . . . 10.0 111.342 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 27.9 p -72.49 -33.5 66.99 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 120.84 -0.344 . . . . 10.0 110.459 179.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -56.51 -54.38 46.5 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.033 0.444 . . . . 10.0 109.825 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -71.47 -31.31 67.0 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.43 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -62.6 -39.1 92.66 Favored 'General case' 0 N--CA 1.461 0.114 0 N-CA-C 109.433 -0.58 . . . . 10.0 109.433 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 23.2 m95 -67.95 -35.48 78.46 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.021 -0.733 . . . . 10.0 109.021 178.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -67.85 -35.4 78.5 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.454 -0.943 . . . . 10.0 108.454 177.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -66.5 -39.96 88.97 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.312 -0.996 . . . . 10.0 108.312 177.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.68 -33.47 75.71 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.689 -0.856 . . . . 10.0 108.689 177.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -70.01 -41.01 74.89 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.193 -0.669 . . . . 10.0 109.193 177.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 18.0 mttt -61.68 -40.25 94.31 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.325 -0.991 . . . . 10.0 108.325 177.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -68.51 -48.8 63.45 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.94 -1.027 . . . . 10.0 111.022 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 3.3 p -64.01 -47.5 80.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.787 -0.188 . . . . 10.0 111.118 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -61.23 -41.26 96.57 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 110.448 -0.204 . . . . 10.0 110.448 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -66.3 -47.88 68.13 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.481 -1.048 . . . . 10.0 110.481 178.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 20.2 mt -63.89 -28.66 69.99 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 115.734 -0.233 . . . . 10.0 110.603 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 37.4 mtt180 -67.98 -33.42 74.6 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -72.9 -42.79 63.19 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 108.382 -0.97 . . . . 10.0 108.382 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.48 -55.35 16.02 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.159 -0.928 . . . . 10.0 110.957 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 69.5 mmm -58.18 -41.5 84.04 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 113.57 0.952 . . . . 10.0 113.57 -178.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 10.9 p -61.14 -52.54 64.45 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.513 -0.475 . . . . 10.0 109.934 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.99 -41.44 99.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.594 -0.73 . . . . 10.0 109.869 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -60.08 -50.81 72.23 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.393 -0.821 . . . . 10.0 110.29 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 43.5 mt -64.55 -46.29 83.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.941 -0.572 . . . . 10.0 112.153 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -59.5 -47.97 83.44 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.94 -0.304 . . . . 10.0 111.004 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 73.1 mt-10 -74.9 -17.33 60.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.921 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -86.06 -37.6 11.88 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 C-N-CA 120.899 -0.321 . . . . 10.0 110.715 178.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -68.65 -38.35 80.37 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.079 -0.711 . . . . 10.0 109.079 178.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -77.1 -0.87 26.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.526 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.0 -35.15 6.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.372 -0.831 . . . . 10.0 109.451 179.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 41.8 t -67.31 -37.08 78.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.069 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -56.09 -60.19 9.59 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.788 178.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -68.52 -20.6 41.16 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.572 1.514 . . . . 10.0 111.323 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -50.75 38.02 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.983 -0.747 . . . . 10.0 108.983 178.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 57.1 mt -66.45 -39.13 88.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.415 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -62.28 -49.13 76.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.247 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -67.06 -41.41 86.49 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.681 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.89 -47.64 82.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 10.0 109.939 179.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.36 -26.04 65.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.326 -0.397 . . . . 10.0 111.177 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 20.1 ttmt -67.92 -46.32 71.89 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.121 -1.066 . . . . 10.0 108.121 178.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 20.8 mtmm -71.59 -36.64 70.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.108 -0.951 . . . . 10.0 109.781 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 1.1 m0 -63.48 -44.0 95.65 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.575 -0.738 . . . . 10.0 109.927 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -65.7 -40.28 92.13 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 178.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . 0.761 ' O ' ' CG ' ' C' ' 469' ' ' LEU . 31.9 tt0 -58.19 -48.37 80.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.489 -0.778 . . . . 10.0 109.697 178.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -72.51 -36.49 68.37 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.388 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 3.8 mmt -61.66 -51.77 67.08 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 110.285 -0.265 . . . . 10.0 110.285 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.76 -39.08 93.39 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.618 -0.882 . . . . 10.0 108.618 178.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . 0.761 ' CG ' ' O ' ' C' ' 465' ' ' GLU . 96.5 mt -57.7 -50.09 74.34 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.369 -0.832 . . . . 20.0 109.602 178.251 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 18.3 m-30 -60.71 -40.04 90.79 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.132 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -64.51 -31.95 73.38 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.541 -0.299 . . . . 10.0 111.211 179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -92.93 -2.03 56.18 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.988 0.366 . . . . 10.0 111.988 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 53.8 mttm -114.28 -45.66 3.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.898 0.38 . . . . 10.0 111.213 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 88.0 t -69.23 -32.44 53.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.519 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -59.44 -59.98 12.05 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 121.066 -0.254 . . . . 10.0 110.723 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.0 -31.95 84.18 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 121.589 1.526 . . . . 10.0 110.458 177.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 8.0 mt -65.7 -37.89 87.71 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -64.81 -41.57 95.67 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 108.577 -0.897 . . . . 10.0 108.577 178.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.57 89.87 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.846 -0.616 . . . . 10.0 109.616 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.18 -41.58 98.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.67 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 22.9 mt -69.26 -30.32 68.42 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.993 -0.548 . . . . 10.0 109.837 178.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 -69.64 -60.07 2.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.09 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -62.95 -35.24 79.49 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -66.61 -43.21 92.63 Favored Glycine 0 N--CA 1.446 -0.666 0 N-CA-C 110.949 -0.86 . . . . 10.0 110.949 178.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -70.82 -35.76 72.62 Favored 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 109.308 -0.627 . . . . 10.0 109.308 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 66.1 mtt180 -62.45 -41.48 98.77 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 109.453 -0.573 . . . . 10.0 109.453 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -66.44 -46.67 75.66 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.809 -0.812 . . . . 10.0 108.809 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -63.47 -37.63 88.02 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.654 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 37.2 mt -68.46 -43.96 75.9 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -62.93 -37.6 87.69 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.408 -0.96 . . . . 10.0 108.408 178.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -62.04 -50.24 72.8 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 107.711 -1.218 . . . . 10.0 107.711 176.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 48.2 mt -58.01 -33.14 68.62 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 115.424 -0.807 . . . . 10.0 111.152 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -65.06 -40.88 95.35 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.936 -0.764 . . . . 10.0 108.936 178.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.54 7.61 16.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.291 179.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 16.1 mttm -116.88 -48.74 2.65 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 95.4 mt -71.58 -37.26 71.03 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.65 0.611 . . . . 10.0 112.65 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 4.9 m -65.51 -58.86 10.7 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 112.17 0.433 . . . . 10.0 112.17 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -62.93 -45.65 12.52 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 122.113 1.875 . . . . 10.0 111.621 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 18.7 mt -67.49 -35.01 78.32 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 121.1 -0.24 . . . . 10.0 110.656 179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.67 -48.35 62.62 Favored Glycine 0 N--CA 1.451 -0.314 0 N-CA-C 110.317 -1.113 . . . . 10.0 110.317 178.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -61.26 -38.21 85.89 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -68.29 -45.57 72.71 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.387 -0.824 . . . . 10.0 109.674 178.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 78.3 mmm -60.17 -34.43 73.58 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.887 -0.412 . . . . 10.0 109.887 179.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -66.63 -39.9 88.5 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.56 -0.533 . . . . 10.0 109.56 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -69.01 -42.09 76.91 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.787 -0.82 . . . . 10.0 108.787 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 -61.84 -44.7 96.31 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.341 -0.845 . . . . 10.0 108.858 178.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.9 -44.77 94.07 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.063 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 46.3 mtt85 -62.08 -44.41 96.72 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -69.15 -19.62 64.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.711 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 8.9 m170 -94.23 -57.81 2.4 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.94 0.4 . . . . 10.0 111.225 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 25.8 t -66.37 -43.36 91.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.985 -0.552 . . . . 10.0 112.375 -178.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -66.17 -33.0 74.77 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 120.194 -0.602 . . . . 10.0 109.919 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.65 -37.5 84.93 Favored 'General case' 0 C--O 1.222 -0.344 0 N-CA-C 107.606 -1.257 . . . . 10.0 107.606 177.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 84.6 mt -67.73 -27.93 67.22 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.566 178.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -70.56 -33.53 71.22 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.564 -0.532 . . . . 10.0 109.564 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.32 3.78 54.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.817 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 62.7 m170 -119.61 -49.72 2.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.844 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 79.7 mt -77.48 -36.34 52.82 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.46 0.541 . . . . 10.0 112.46 -179.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -57.37 -57.17 26.89 Favored Pre-proline 0 C--N 1.331 -0.211 0 C-N-CA 120.747 -0.381 . . . . 10.0 110.973 179.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -62.96 -34.36 71.33 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.21 1.273 . . . . 10.0 110.166 177.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 35.2 t80 -61.55 -45.81 92.59 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.767 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 12.1 p -63.86 -34.75 78.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.969 0.414 . . . . 10.0 110.392 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -70.79 -40.22 72.68 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.455 -0.572 . . . . 10.0 109.455 178.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -64.26 -40.3 95.7 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 108.451 -0.944 . . . . 10.0 108.451 178.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 35.6 mt -62.89 -38.53 91.27 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 115.3 -0.864 . . . . 10.0 109.655 178.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -58.3 -40.2 81.38 Favored 'General case' 0 C--O 1.226 -0.174 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.322 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -64.94 -49.35 70.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.979 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 44.4 mtt180 -64.25 -39.95 95.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.109 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 60.0 mt -70.22 -30.34 67.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.055 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -61.89 -48.09 82.04 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.78 -40.69 92.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.422 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -59.44 -46.76 87.84 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.669 -0.696 . . . . 10.0 109.94 178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 65.1 mt -66.15 -39.77 90.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.813 -0.631 . . . . 10.0 110.125 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -62.57 -39.41 93.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 10.0 109.935 178.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.41 -42.72 92.26 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.669 -0.863 . . . . 10.0 108.669 177.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.5 -24.45 67.14 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.1 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -79.18 -45.63 19.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.843 178.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -63.22 -52.17 63.3 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 54.2 m-20 -68.34 -30.71 69.73 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.569 -0.741 . . . . 10.0 109.519 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -65.79 -51.91 42.61 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.21 -0.756 . . . . 10.0 111.21 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -60.48 -38.25 94.55 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 110.734 -0.947 . . . . 10.0 110.734 178.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -63.42 -54.28 39.04 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.845 -0.798 . . . . 10.0 108.845 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 50.0 mtt180 -55.14 -41.76 72.16 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.61 179.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 55.8 mt -56.57 -50.43 71.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.667 0.27 . . . . 10.0 110.808 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.85 -47.53 68.69 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.023 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -60.72 -44.52 96.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.879 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -69.85 -37.89 76.3 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.015 -0.365 . . . . 10.0 110.015 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.4 m170 -63.5 -46.64 85.15 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.864 -0.421 . . . . 10.0 109.864 179.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -63.1 -45.6 91.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.978 -0.556 . . . . 10.0 109.527 178.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.12 -35.57 80.71 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.772 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -67.57 -36.8 81.63 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.28 -0.637 . . . . 10.0 109.28 178.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 18.1 m -63.06 -48.19 79.71 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 108.174 -1.047 . . . . 10.0 108.174 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -59.47 -43.49 93.24 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.023 178.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 39.6 t-80 -63.87 -31.79 73.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.63 -0.714 . . . . 10.0 111.397 179.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 60.4 mt -73.72 -49.02 27.71 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.167 -0.308 . . . . 10.0 110.167 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 5.5 m -62.12 -33.73 75.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.033 0.444 . . . . 10.0 110.629 179.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 33.2 p -83.45 -9.7 58.83 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.107 0.479 . . . . 10.0 110.944 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.51 -47.75 8.98 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.459 -1.311 . . . . 10.0 107.459 177.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 1.7 p -67.83 -23.22 65.14 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.442 -0.947 . . . . 10.0 108.442 177.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -57.92 -25.69 61.22 Favored 'General case' 0 CA--C 1.524 -0.045 0 CA-C-N 114.907 -1.042 . . . . 10.0 109.505 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -112.4 -33.94 6.03 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.571 -0.741 . . . . 10.0 110.35 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -61.16 -11.47 9.12 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.948 0.404 . . . . 10.0 111.896 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -98.09 -67.07 0.06 OUTLIER Pre-proline 0 C--N 1.325 -0.496 0 C-N-CA 120.913 -0.315 . . . . 10.0 111.316 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.92 -40.92 4.53 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 121.887 1.725 . . . . 10.0 113.467 -179.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -68.07 -42.78 79.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.496 0.189 . . . . 10.0 110.702 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 8.0 mt -64.01 -39.44 94.11 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.723 -0.391 . . . . 10.0 109.958 178.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -68.96 -33.32 73.51 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.855 -0.424 . . . . 10.0 109.855 178.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.04 -44.93 91.0 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.341 -0.985 . . . . 10.0 108.341 178.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 83.2 mt -67.19 -38.17 84.89 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.131 -0.94 . . . . 10.0 110.356 178.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -64.25 -38.18 90.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.452 0.644 . . . . 10.0 109.605 178.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -81.69 -10.31 59.42 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.408 -0.815 . . . . 20.0 111.285 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -92.23 -47.96 3.18 Favored Glycine 0 CA--C 1.521 0.432 0 N-CA-C 108.993 -1.643 . . . . 10.0 108.993 178.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 75.0 mt -61.54 -25.03 67.03 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.572 -0.314 . . . . 10.0 111.45 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 4.7 mt -60.07 -66.34 1.55 Allowed Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 121.191 -0.204 . . . . 10.0 111.038 178.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.98 -28.73 57.76 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 121.711 1.607 . . . . 10.0 111.094 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 5.7 t -64.39 -47.07 91.05 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 178.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 34.0 mt -67.38 -34.93 78.3 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.919 -0.4 . . . . 10.0 109.919 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -62.9 -47.85 81.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.315 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 4.2 p -71.21 -36.57 71.92 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.917 -0.401 . . . . 10.0 109.917 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.7 -43.65 98.44 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 178.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -62.06 -44.99 95.49 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 178.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 50.8 t -59.29 -44.24 91.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.204 0.526 . . . . 10.0 109.624 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 15.2 m -65.98 -45.18 82.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.706 -0.679 . . . . 10.0 111.05 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -69.68 -40.91 76.09 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.375 0.509 . . . . 10.0 112.375 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 52.7 mt -61.29 -40.27 93.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.865 0.364 . . . . 10.0 110.049 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 19.1 m -73.47 -37.43 65.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.078 -0.712 . . . . 10.0 109.078 178.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -58.89 -50.52 73.71 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.674 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.9 mt -62.82 -37.61 87.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.29 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -62.64 -46.5 87.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.337 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -63.81 -40.99 97.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.78 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -64.54 -42.99 95.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.879 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 1.6 p -69.49 -21.93 63.65 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.562 0.579 . . . . 10.0 112.562 -179.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -84.94 -14.86 46.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.306 0.574 . . . . 10.0 110.586 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.19 -48.98 4.22 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.76 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 89.2 mt -94.2 48.94 1.27 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.143 0.497 . . . . 10.0 110.478 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 . . . . . 0 C--O 1.251 1.146 0 CA-C-O 118.652 -0.69 . . . . 10.0 110.825 -179.067 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 33.5 ttp . . . . . 0 C--O 1.233 0.221 0 CA-C-O 121.205 0.526 . . . . 10.0 110.586 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 22.2 m -153.74 -78.49 0.1 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.749 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.63 138.84 26.21 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.878 -0.786 . . . . 10.0 108.878 -179.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -140.16 127.28 20.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.061 0.457 . . . . 10.0 111.91 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.431 ' NZ ' ' N1 ' ' A' ' 40' ' ' 17F . 14.3 mptt -93.22 117.9 30.61 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.846 -0.798 . . . . 10.0 108.846 178.538 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 68.8 mt -110.69 118.24 35.64 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.206 0.527 . . . . 10.0 111.663 -178.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 39.6 t -95.71 112.05 27.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.437 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 38.6 t -94.32 116.0 34.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 109.596 -0.52 . . . . 10.0 109.596 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 21.2 m -105.33 167.54 2.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.425 -0.352 . . . . 10.0 111.336 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 150.56 165.69 12.92 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 111.458 -0.657 . . . . 10.0 111.458 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.26 169.06 14.15 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.726 0.298 . . . . 10.0 111.025 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -77.75 61.32 3.67 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.298 -0.477 . . . . 10.0 112.373 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -153.83 -32.06 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 111.027 -0.829 . . . . 10.0 111.027 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 21.4 m -77.2 166.68 2.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 110.205 -0.294 . . . . 10.0 110.205 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -83.77 54.96 5.0 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.756 -0.735 . . . . 10.0 113.498 -179.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 18.5 mtmt -60.62 -61.99 2.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.989 0.423 . . . . 10.0 111.204 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.8 p -63.99 -36.27 83.41 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.82 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.58 -50.0 75.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.113 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 63.8 mt -61.31 -42.68 99.07 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.831 0.348 . . . . 10.0 110.767 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 13.7 m -61.24 -49.21 78.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.953 -0.567 . . . . 10.0 111.002 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 67.4 mt -67.39 -32.49 57.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.79 0.328 . . . . 10.0 110.591 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -67.68 -18.61 65.0 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.121 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.8 tp -99.11 -37.88 9.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.208 0.528 . . . . 10.0 110.656 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 45.8 mm -76.04 -68.92 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.408 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -85.89 -21.55 27.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.061 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 66.97 34.53 5.17 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.971 -178.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -127.45 126.97 43.29 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.252 -0.886 . . . . 10.0 109.277 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -78.19 133.44 37.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.93 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 3.4 m -107.62 123.71 63.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.762 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -89.08 -29.32 19.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.589 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -68.31 135.01 51.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.463 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -87.33 94.42 9.67 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.979 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -98.11 130.68 28.0 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 109.486 -0.561 . . . . 10.0 109.486 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -64.14 178.08 1.69 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.97 2.447 . . . . 10.0 112.454 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.2 m -163.69 141.73 7.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.225 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 5.3 mt -118.7 -65.19 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 108.654 -0.869 . . . . 10.0 108.654 179.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -148.77 93.45 2.12 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.093 -0.706 . . . . 10.0 109.093 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -114.13 160.95 18.38 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.654 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 4.5 m -146.53 140.41 26.14 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.971 0.415 . . . . 10.0 112.021 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . 0.476 ' CE2' ' CG2' ' D' ' 840' ' ' VAL . 2.8 m-85 -129.67 152.43 49.19 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 109.336 -0.616 . . . . 10.0 109.336 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -141.47 137.25 31.99 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 122.076 -0.39 . . . . 10.0 110.826 -178.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -155.92 147.51 22.87 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -102.16 125.62 48.9 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.782 -0.451 . . . . 10.0 109.782 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 15.6 m -136.97 158.26 36.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.847 0.356 . . . . 10.0 111.074 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 24.7 t -95.63 101.71 12.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 109.179 -0.674 . . . . 10.0 109.179 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 54.5 mt -92.26 105.28 16.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.453 -178.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 57.25 36.63 27.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.5 -0.773 . . . . 10.0 111.728 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.1 -15.32 62.67 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.772 -0.728 . . . . 10.0 113.611 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -106.13 109.05 20.86 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.874 0.337 . . . . 10.0 111.07 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 11.1 t -76.04 143.52 41.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.561 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 1.4 p -165.0 162.41 20.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.378 -179.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 17.6 mt -95.06 129.49 42.13 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 89.6 mt -110.03 122.09 46.77 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.958 -0.297 . . . . 10.0 111.552 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.404 ' CG ' HE21 ' D' ' 818' ' ' GLN . 7.8 t70 -99.25 100.9 12.05 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.067 -1.086 . . . . 10.0 108.067 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 32.1 mt -88.86 126.02 41.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.346 -178.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 33.0 tp -101.1 116.31 32.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.778 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -92.48 98.94 11.78 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 40.1 p -77.92 164.92 24.7 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 113.004 0.742 . . . . 10.0 113.004 -178.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.63 163.59 23.41 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.219 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.63 -32.04 47.77 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.73 -0.747 . . . . 10.0 112.675 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -150.28 131.85 14.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.823 0.344 . . . . 20.0 111.218 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -133.46 158.35 43.32 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.527 -0.546 . . . . 10.0 109.527 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -92.68 -74.38 0.52 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.127 0.489 . . . . 10.0 109.722 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -162.99 61.01 0.19 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.364 -0.834 . . . . 10.0 109.096 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.49 126.82 31.58 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.415 -0.812 . . . . 10.0 111.486 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.07 -37.44 87.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.255 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 7.9 tmm? -63.11 -34.32 77.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.287 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 32.3 ttt85 -61.86 -46.7 88.31 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.396 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.61 -24.65 67.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.633 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -78.54 -44.4 24.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.767 -0.651 . . . . 10.0 111.115 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -70.95 -29.27 65.24 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 120.363 -0.535 . . . . 10.0 112.183 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 76.5 mtp -79.42 -15.22 58.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 10.0 109.996 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -74.01 -27.01 60.75 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.18 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 m -82.8 -33.2 27.32 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.689 0.625 . . . . 10.0 112.689 -178.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -57.29 148.28 33.7 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 114.445 0.538 . . . . 10.0 114.445 -178.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -111.21 -39.71 4.65 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-O 121.112 0.482 . . . . 10.0 109.8 178.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -118.51 138.11 13.47 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 110.998 -0.841 . . . . 10.0 110.998 179.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -129.58 143.08 50.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.051 0.453 . . . . 10.0 111.949 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 58.7 mt -99.85 122.21 42.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.144 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 6.7 m -88.87 78.88 7.49 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 21.5 t -82.91 118.66 30.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.547 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 18.8 p90 -134.75 158.93 42.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.855 -0.612 . . . . 10.0 109.712 178.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -97.29 130.69 44.45 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 27.7 pt -73.31 -5.25 6.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.015 0.436 . . . . 10.0 111.372 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.08 3.5 28.19 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.027 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -126.62 116.81 21.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.915 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.41 -32.36 71.29 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.283 0.475 . . . . 10.0 112.283 -178.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -60.97 -46.19 91.73 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 111.654 0.242 . . . . 10.0 111.654 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.73 -26.32 65.55 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.43 0.53 . . . . 10.0 112.43 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -70.54 -34.01 71.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.041 0.448 . . . . 10.0 110.138 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -85.71 -26.99 25.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.738 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.71 -17.07 64.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.439 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 43.6 mm -60.69 -45.82 96.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -67.71 -37.13 81.83 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 8.7 t-160 -61.42 -39.32 90.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.396 -0.82 . . . . 10.0 110.195 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -74.83 -46.72 34.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.526 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.97 -40.76 85.75 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.673 0.273 . . . . 10.0 111.27 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -65.32 -34.41 78.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.758 0.313 . . . . 10.0 111.144 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -69.25 -46.23 67.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.224 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 41.8 mt -68.29 -33.96 63.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.115 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 29.2 ttpt -60.43 -31.41 70.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.984 0.421 . . . . 10.0 110.642 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 44.9 ttp85 -78.21 -34.05 49.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.009 -0.542 . . . . 10.0 111.852 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 19.9 m -77.39 -32.11 18.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 112.405 0.52 . . . . 10.0 112.405 -179.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -95.92 -14.66 22.93 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.682 -0.407 . . . . 10.0 111.379 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 26.2 t0 58.85 48.15 11.6 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.496 0.665 . . . . 10.0 110.995 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 32.5 t -178.23 153.59 0.78 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.445 -0.798 . . . . 10.0 110.336 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 17.1 mp0 -91.82 -8.17 47.39 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 108.715 -0.846 . . . . 10.0 108.715 178.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -83.82 64.02 7.82 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 114.969 -1.014 . . . . 10.0 110.568 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 50.5 t -121.15 116.95 30.88 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.226 -0.897 . . . . 10.0 109.797 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.77 113.14 1.29 Allowed 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.927 2.418 . . . . 10.0 111.555 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 65.3 mtt -133.28 150.95 51.89 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.293 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 95.1 t -132.0 124.96 54.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 179.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 15.0 tp -75.6 121.09 21.91 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.8 -0.815 . . . . 10.0 108.8 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 60.8 t -114.8 111.5 36.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 112.026 0.38 . . . . 10.0 112.026 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -89.38 100.12 2.63 Favored Glycine 0 N--CA 1.449 -0.486 0 N-CA-C 109.746 -1.341 . . . . 10.0 109.746 178.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -86.67 153.13 21.99 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 112.544 0.572 . . . . 10.0 112.544 -177.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 77.4 mttt 70.38 46.39 0.58 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 114.919 -1.037 . . . . 10.0 113.442 178.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 15.5 p -78.78 -2.53 39.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.986 0.422 . . . . 10.0 111.404 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -92.67 0.56 57.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.967 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 17.7 mt -97.13 127.08 39.82 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.838 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.68 -26.59 68.7 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.999 2.466 . . . . 10.0 111.286 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.35 70.4 4.7 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.589 -0.732 . . . . 10.0 110.001 179.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 24.6 ttt180 -101.41 122.46 43.79 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.579 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.21 -49.43 4.48 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.361 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 62.1 t -78.67 116.51 22.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.665 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -73.3 153.48 40.54 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.028 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 2.3 m -60.15 -37.41 80.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.229 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 16.4 tttm -68.25 -36.93 80.21 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 121.174 -0.211 . . . . 10.0 111.092 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -60.26 -39.65 87.55 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.058 0.456 . . . . 10.0 110.188 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -71.93 -41.22 68.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.114 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -61.64 -37.09 82.71 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.895 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.89 -46.76 80.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.149 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 32.8 tp -64.36 -42.13 96.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.451 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.76 -44.56 95.89 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.967 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.59 -27.53 69.01 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.071 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.9 m -71.21 -25.73 62.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.074 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -99.8 -20.0 16.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.975 0.416 . . . . 10.0 110.376 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.89 21.49 52.82 Favored Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 111.018 -0.833 . . . . 10.0 111.018 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 49.1 pt -109.58 155.78 40.76 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.732 -0.234 . . . . 10.0 110.654 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -79.9 158.01 24.16 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.341 2.027 . . . . 10.0 111.97 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -120.76 122.95 41.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.553 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 24.0 mm -122.0 116.52 49.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.715 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -83.19 128.13 34.22 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.74 -0.837 . . . . 10.0 108.74 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 81.4 p -135.66 167.82 20.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.884 0.85 . . . . 10.0 112.987 -177.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 5.6 t -157.55 131.81 8.32 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.471 -1.24 . . . . 10.0 108.173 178.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -76.71 -14.56 59.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.842 0.353 . . . . 10.0 110.639 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -85.48 -44.43 12.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.954 -0.566 . . . . 10.0 111.111 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 48.9 p -86.05 -25.83 25.68 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.992 0.425 . . . . 10.0 110.368 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 14.2 ttt-85 66.07 27.55 10.55 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.435 -0.802 . . . . 10.0 110.682 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -91.9 127.53 37.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.262 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.35 7.22 67.49 Favored Glycine 0 C--O 1.228 -0.268 0 CA-C-N 115.977 -0.556 . . . . 10.0 113.939 178.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 95.3 t -66.57 -55.36 18.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.72 0.295 . . . . 10.0 111.63 -179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.46 -42.46 98.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.672 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -65.05 -31.77 73.16 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.319 0.489 . . . . 10.0 112.319 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.91 -46.67 89.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.107 0.48 . . . . 10.0 109.868 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -70.94 -40.03 72.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.384 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -62.92 -44.36 96.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.228 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 70.7 m -63.91 -33.68 76.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.859 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 58.1 tp -60.9 -42.82 98.76 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 47.8 t -69.76 -32.96 54.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.74 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 72.8 mtt180 -63.4 -41.19 98.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.557 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -64.65 -38.17 90.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 97.1 mt -67.02 -40.12 84.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.477 178.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 30.1 ttm180 -58.17 -46.52 85.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.584 -0.735 . . . . 10.0 109.701 179.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -70.39 -33.32 71.25 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.291 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -59.93 -41.79 92.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.756 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -68.22 -43.66 77.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.691 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -67.83 -33.52 74.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.078 0.466 . . . . 10.0 110.201 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -67.78 -28.92 68.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.704 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 54.8 ttp -62.01 -38.01 87.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.95 0.405 . . . . 10.0 111.233 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 49.9 m -73.54 -15.53 61.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.191 0.519 . . . . 10.0 111.077 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -105.53 2.48 28.46 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 28.0 t70 56.72 -92.27 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 114.773 -1.103 . . . . 10.0 113.426 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 115.11 89.62 1.64 Allowed Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 110.913 -0.875 . . . . 10.0 110.913 -178.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 55.5 mmtt -69.01 -50.8 45.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.747 0.308 . . . . 10.0 111.249 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 45.0 tptt -169.99 131.95 1.07 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -129.74 154.38 47.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.949 0.404 . . . . 10.0 111.348 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -130.85 -170.04 2.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.575 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 65.7 tttt -83.06 -42.95 16.85 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.897 0.38 . . . . 10.0 110.015 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -83.41 127.52 33.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.481 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 2.5 m -81.04 130.54 35.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.422 -0.354 . . . . 10.0 110.548 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 5.3 ptmm? -92.96 153.22 18.89 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.913 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.69 -12.88 58.47 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.587 0.588 . . . . 10.0 112.587 -178.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -118.7 148.55 42.65 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 6.8 t . . . . . 0 C--O 1.236 0.385 0 CA-C-N 115.895 -0.593 . . . . 10.0 111.185 179.929 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.134 -0.386 . . . . 10.0 112.134 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 11.8 p -122.7 145.83 48.04 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.667 0.27 . . . . 10.0 110.562 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 51.0 t -121.88 136.19 59.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.639 -0.255 . . . . 10.0 110.359 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 80.2 mttt -86.55 120.79 28.24 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.19 0.519 . . . . 10.0 110.862 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 44.7 t -105.65 123.55 60.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.493 179.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -91.15 137.26 32.5 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.038 0.447 . . . . 10.0 110.785 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 13.3 mt -105.46 153.22 39.91 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.388 -178.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -65.01 -13.71 41.29 Favored 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 123.263 2.642 . . . . 10.0 113.428 -179.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -90.27 37.92 0.92 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.967 -0.383 . . . . 10.0 109.967 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp 51.94 39.43 26.03 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.207 -0.906 . . . . 10.0 111.646 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 818' ' ' GLN . . . . . 0.475 HE22 ' C ' ' B' ' 40' ' ' TYR . 84.1 mt-30 -136.63 -169.51 2.48 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 114.515 1.302 . . . . 10.0 114.515 -177.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.85 167.73 27.36 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.123 -0.944 . . . . 10.0 111.539 -178.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 14.7 t -154.03 139.12 17.36 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.949 -1.13 . . . . 10.0 107.949 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 3.2 t -107.87 112.79 41.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 C-N-CA 120.443 -0.503 . . . . 10.0 111.202 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 5.6 t -110.22 148.91 13.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.54 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 2.6 m -88.68 108.33 19.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.115 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 61.5 t -77.7 121.18 29.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.942 0.401 . . . . 10.0 110.636 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 21.6 mtp85 -122.41 156.14 34.63 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.186 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -73.54 139.4 45.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.811 0.338 . . . . 10.0 110.766 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 110.82 -36.91 3.98 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.781 -0.724 . . . . 10.0 112.252 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 12.0 ptm -81.42 149.74 28.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.741 0.305 . . . . 10.0 110.61 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 97.9 p -100.03 176.3 5.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.952 0.406 . . . . 10.0 110.657 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 16.1 t -63.2 -36.82 77.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.193 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -62.47 -44.87 95.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.484 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -65.21 -47.52 76.58 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.048 0.452 . . . . 10.0 111.072 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 3.1 m -64.89 -43.0 94.33 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.769 -0.651 . . . . 10.0 112.416 -178.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.87 -16.63 56.8 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.31 0.856 . . . . 10.0 113.31 -178.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -59.23 -50.78 72.68 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.031 0.443 . . . . 10.0 111.01 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 5.5 mmmm -66.3 -25.92 67.08 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.387 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -80.11 -18.02 51.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.533 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 78.2 mt -100.68 -48.66 4.43 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.236 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -58.26 -33.16 69.08 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.983 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 840' ' ' VAL . . . . . 0.476 ' CG2' ' CE2' ' B' ' 40' ' ' TYR . 9.6 p -56.03 -22.63 13.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 115.805 -0.634 . . . . 10.0 112.096 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -119.53 13.23 12.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.586 -179.381 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 75.95 19.33 78.87 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.68 -0.771 . . . . 10.0 112.526 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 58.5 mt -92.65 175.51 6.79 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.935 -0.394 . . . . 10.0 109.935 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -152.22 155.15 37.19 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.382 -0.229 . . . . 10.0 110.382 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 22.4 mp0 -75.6 71.01 2.48 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.995 0.426 . . . . 10.0 111.054 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -129.4 -70.45 0.65 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.669 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -104.62 15.31 28.26 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.395 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 16.0 m -111.5 129.74 55.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.198 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 6.1 p -121.69 153.12 25.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.486 -0.324 . . . . 10.0 110.517 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 20.1 t -100.16 136.28 32.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.132 0.492 . . . . 10.0 111.523 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -112.83 135.01 54.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.687 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 61.1 mtp180 -78.97 131.4 36.32 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 178.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -106.73 114.12 28.03 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.121 0.486 . . . . 10.0 111.746 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 2.4 pt -150.75 141.21 16.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt 68.47 -53.29 0.55 Allowed 'General case' 0 N--CA 1.472 0.631 0 O-C-N 123.653 0.596 . . . . 10.0 112.567 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 167.09 -30.56 0.19 Allowed Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 111.21 -0.756 . . . . 10.0 111.21 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 11.9 mmt180 -83.68 150.64 25.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.749 0.309 . . . . 10.0 110.629 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 7.6 mptt -108.71 114.67 28.67 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.26 -0.427 . . . . 10.0 109.927 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.02 138.75 42.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.574 0.226 . . . . 10.0 111.212 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 1.6 t -62.99 146.9 12.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.95 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 1.8 t -134.2 160.59 37.39 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.165 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -99.35 157.62 16.28 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.502 -0.317 . . . . 10.0 110.417 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -78.79 -29.6 45.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.931 0.395 . . . . 10.0 111.127 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -89.25 50.03 1.86 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.992 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 1.3 m -123.91 153.1 41.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.823 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -67.59 141.49 56.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.83 0.348 . . . . 10.0 110.811 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 9.9 tp -91.86 -14.4 8.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.183 0.516 . . . . 10.0 111.08 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -55.28 -49.37 92.79 Favored Pre-proline 0 CA--C 1.541 0.62 0 N-CA-C 113.795 1.035 . . . . 10.0 113.795 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -68.89 -13.35 36.58 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 122.143 1.895 . . . . 10.0 113.058 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 8.8 mp -85.94 81.93 8.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.257 0.551 . . . . 10.0 110.557 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -139.52 123.4 17.63 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.107 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 87.68 15.6 61.36 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.911 -0.662 . . . . 10.0 112.02 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -127.09 159.44 34.2 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 122.871 -0.194 . . . . 10.0 110.613 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -102.47 174.07 6.07 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.092 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 93.1 mt -136.56 131.41 33.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.71 -0.223 . . . . 10.0 110.568 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 6.5 mt -117.11 129.09 74.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.585 -0.279 . . . . 10.0 110.301 179.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 24.3 t -102.64 126.92 56.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -140.79 179.22 6.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.95 0.405 . . . . 10.0 111.112 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 20.1 m -81.39 148.11 5.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.55 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 15.3 mt . . . . . 0 C--O 1.254 1.335 0 CA-C-O 118.402 -0.809 . . . . 10.0 111.063 -179.984 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PCW . . . . . 0.515 ' P ' ' O2P' ' A' ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PCW . . . . . 0.515 ' O2P' ' P ' ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' 17F . . . . . 0.431 ' N1 ' ' NZ ' ' B' ' 5' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 201' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 81.9 mt . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.939 0.4 . . . . 10.0 110.656 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 17.5 mttm -57.89 -37.21 73.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.452 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 93.6 mt -66.23 -40.27 90.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.67 -0.696 . . . . 10.0 110.253 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.36 -44.92 86.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.494 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -62.48 -38.68 90.82 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.268 0.556 . . . . 10.0 110.107 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -68.29 -50.61 52.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.596 -0.729 . . . . 10.0 110.176 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 36.2 m0 -60.31 -35.47 75.67 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.084 -0.507 . . . . 10.0 111.891 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -63.29 -43.96 96.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.027 0.441 . . . . 10.0 110.124 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 17.5 m -68.66 -26.16 65.18 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.483 -0.781 . . . . 10.0 110.451 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 70.7 t -78.47 -44.01 26.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.052 178.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.35 -40.94 98.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.622 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 3.3 p -64.16 -36.44 84.06 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 121.202 0.525 . . . . 10.0 109.918 179.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 69.8 m -68.38 -41.37 80.68 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.797 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -64.61 -40.53 95.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.35 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 2.5 p -67.0 -41.76 86.16 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 178.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -64.98 -38.6 91.49 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.617 -0.512 . . . . 10.0 109.617 178.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 39.2 mt -63.58 -44.72 93.23 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 86.9 mtt180 -65.84 -32.57 74.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.759 179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -69.28 -20.26 63.91 Favored 'General case' 0 N--CA 1.461 0.107 0 CA-C-O 121.133 0.492 . . . . 10.0 109.983 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.29 -40.02 10.65 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.768 -0.827 . . . . 10.0 108.768 177.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 76.2 mt -63.62 -30.07 71.23 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.245 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -54.16 -67.27 2.25 Favored Glycine 0 C--N 1.331 0.277 0 N-CA-C 110.82 -0.912 . . . . 10.0 110.82 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -62.47 -34.56 75.59 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.053 1.835 . . . . 10.0 110.94 177.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 2.6 t -54.81 -46.86 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-N 116.563 -0.289 . . . . 10.0 111.777 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 1.5 p -64.32 -34.19 77.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.836 0.351 . . . . 10.0 110.727 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -73.2 -48.66 33.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.164 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -62.36 -43.68 98.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.629 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -65.7 -38.57 89.61 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.777 -0.453 . . . . 10.0 109.777 179.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -68.02 -41.02 82.81 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.366 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -61.94 -37.19 83.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.596 0.712 . . . . 10.0 109.402 178.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 10.5 m-80 -68.85 -43.9 74.49 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.742 -0.836 . . . . 10.0 108.742 177.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 48.8 mt -63.0 -28.73 70.3 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 115.32 -0.855 . . . . 10.0 110.384 178.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -63.84 -40.73 97.27 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.373 179.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 42.2 mttp -71.96 -35.29 69.52 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.839 -0.8 . . . . 10.0 108.839 178.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.92 -52.33 60.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.278 -0.873 . . . . 10.0 109.213 178.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 17.8 p -66.58 -32.15 73.3 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.603 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -65.12 -47.56 76.71 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 108.4 -0.963 . . . . 10.0 108.4 178.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -62.03 -45.19 96.62 Favored Glycine 0 N--CA 1.441 -1.016 0 N-CA-C 109.603 -1.399 . . . . 10.0 109.603 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 75.2 mt -63.79 -30.54 71.62 Favored 'General case' 0 C--O 1.227 -0.131 0 O-C-N 123.608 0.24 . . . . 10.0 111.153 179.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 54.2 mtm-85 -65.35 -50.03 67.14 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.648 -0.871 . . . . 10.0 108.648 178.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -64.73 -40.62 95.63 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.53 -0.915 . . . . 10.0 108.53 178.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -58.94 -51.9 68.05 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.202 -0.908 . . . . 10.0 110.715 179.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 62.3 mtm -63.84 -28.0 69.56 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.795 0.331 . . . . 10.0 110.818 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 56.6 m -70.78 -13.46 62.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.296 178.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 41.8 mttm -109.43 -53.31 2.67 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 108.64 -0.874 . . . . 10.0 108.64 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -52.14 -64.5 0.79 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.078 -0.965 . . . . 10.0 111.395 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 95.8 mt -57.98 -39.61 78.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.977 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -65.72 -44.45 86.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.682 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -64.85 -40.53 95.31 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.518 -0.549 . . . . 10.0 109.518 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 54.2 t -62.08 -51.36 73.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.451 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.016 178.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -66.16 -46.6 76.86 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.593 0.59 . . . . 10.0 112.593 -179.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.12 -43.87 97.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.187 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -80.32 -24.78 39.7 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.302 0.482 . . . . 10.0 112.302 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -62.64 -27.52 43.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.924 -0.31 . . . . 10.0 110.728 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -61.31 -62.0 6.8 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-N 116.526 -0.306 . . . . 10.0 110.591 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -67.56 -28.51 38.04 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 121.73 1.62 . . . . 10.0 111.569 178.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -66.1 -50.37 64.29 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 109.524 -0.547 . . . . 10.0 109.524 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 41.7 mt -68.92 -37.75 79.13 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.009 -0.542 . . . . 10.0 110.058 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -61.48 -44.55 96.88 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.497 -0.557 . . . . 10.0 109.497 178.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -58.57 -49.08 78.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.506 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -65.39 -46.39 80.26 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 115.466 -0.788 . . . . 10.0 110.934 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -58.93 -52.47 65.61 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 111.888 0.329 . . . . 10.0 111.888 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -57.05 -46.39 82.47 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 120.782 0.325 . . . . 10.0 111.289 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.08 -38.28 75.68 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.639 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 15.3 t90 -66.43 -36.58 83.17 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 179.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -63.23 -42.21 99.21 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.465 -0.939 . . . . 10.0 108.465 178.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -66.56 -39.78 88.69 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.855 -0.795 . . . . 10.0 108.855 178.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -60.21 -49.65 76.77 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.818 178.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 79.4 mmm -65.29 -44.67 87.22 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.703 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.91 -49.74 76.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.917 179.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 59.4 mt -64.2 -44.03 93.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.298 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -60.67 -47.35 86.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.222 -0.444 . . . . 10.0 109.979 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 32.1 ttm105 -65.14 -37.34 87.11 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.125 0.488 . . . . 10.0 110.083 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -35.81 81.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.403 -0.817 . . . . 10.0 109.559 178.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp -80.84 -34.57 33.74 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.138 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 12.0 t -51.78 -44.92 37.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 N-CA-C 112.112 0.412 . . . . 10.0 112.112 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -50.6 -64.05 1.52 Allowed Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 112.613 0.597 . . . . 10.0 112.613 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -70.89 -35.93 8.57 Favored 'Trans proline' 0 C--N 1.355 0.91 0 C-N-CA 121.846 1.698 . . . . 10.0 113.031 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 28.5 mt -63.71 -39.78 95.15 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 121.031 -0.268 . . . . 10.0 111.0 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -73.86 -29.72 62.27 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.952 -0.759 . . . . 10.0 108.952 178.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.45 -44.52 90.85 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.89 -0.782 . . . . 10.0 108.89 178.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -58.9 -42.27 89.16 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 108.711 -0.848 . . . . 10.0 108.711 178.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 95.0 mt -63.36 -46.16 87.81 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.244 -0.889 . . . . 10.0 110.431 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 16.6 mt-30 -62.27 -54.1 45.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.897 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -60.82 -44.74 96.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.08 0.467 . . . . 10.0 110.504 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.02 -44.07 97.91 Favored Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.689 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.83 -39.39 93.49 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 109.919 -0.4 . . . . 10.0 109.919 179.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -60.07 -42.57 94.83 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.476 179.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 14.1 tm0? -67.07 -49.69 64.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.176 -0.466 . . . . 10.0 109.999 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 33.6 mttp -59.42 -47.1 86.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.501 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 77.8 mt -66.31 -35.42 80.34 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.455 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -60.41 -50.17 74.64 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.12 -36.47 84.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.854 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 83.0 mt -71.51 -38.64 71.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.995 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -66.83 -41.93 86.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.473 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -77.72 2.37 17.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.268 0.556 . . . . 10.0 110.24 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 29.3 tttp -105.25 -37.45 6.88 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.859 -0.793 . . . . 10.0 108.859 178.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 13.7 mt -68.45 -24.57 64.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.359 -0.837 . . . . 10.0 111.053 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -62.59 1.71 Allowed Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.495 -0.32 . . . . 10.0 111.851 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -68.06 -51.55 0.61 Allowed 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 122.055 1.837 . . . . 10.0 112.445 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 60.2 mt -66.98 -26.65 66.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.704 0.287 . . . . 10.0 111.171 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -75.81 -40.11 31.98 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 109.35 -1.5 . . . . 10.0 109.35 177.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -64.65 -43.86 92.3 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.767 -0.827 . . . . 10.0 108.767 178.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -62.62 -40.15 96.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.441 -0.799 . . . . 10.0 108.909 178.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 14.7 tpt -61.75 -41.82 98.17 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 115.693 -0.685 . . . . 10.0 109.368 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 -64.78 -42.88 94.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.473 . . . . 10.0 109.963 178.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -63.44 -46.84 84.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.251 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -68.19 -33.67 74.87 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.406 179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -65.5 -39.34 91.77 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 178.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 44.8 mtt85 -60.22 -47.22 86.91 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.031 -0.729 . . . . 10.0 109.031 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -64.68 -43.09 94.68 Favored 'General case' 0 C--O 1.226 -0.184 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 178.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -53.45 -54.42 37.3 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.424 -0.807 . . . . 10.0 110.331 179.052 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 39.9 t -73.84 -38.68 50.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.396 -0.82 . . . . 10.0 112.053 -178.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.51 -40.95 98.41 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.889 0.376 . . . . 10.0 110.632 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -66.76 -28.99 68.85 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 177.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . 0.408 ' O ' ' N ' ' A' ' 320' ' ' LEU . 19.2 mt -74.28 -40.65 62.17 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.191 -0.913 . . . . 10.0 109.131 178.09 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -62.19 -47.1 85.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.975 0.416 . . . . 10.0 110.345 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 1.4 p -66.9 -15.24 63.52 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.618 -0.719 . . . . 10.0 111.664 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -103.27 -38.19 7.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.087 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . 0.408 ' N ' ' O ' ' A' ' 316' ' ' LEU . 39.9 mt -64.82 -34.72 79.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.387 -0.369 . . . . 10.0 111.19 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.94 -60.82 8.37 Favored Pre-proline 0 CA--C 1.535 0.395 0 O-C-N 123.213 0.32 . . . . 10.0 110.541 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -65.16 -30.06 55.51 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 121.524 1.482 . . . . 10.0 111.08 177.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -61.8 -56.42 19.67 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 110.249 -0.278 . . . . 10.0 110.249 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 17.0 p -66.72 -36.55 82.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.924 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -63.07 -48.61 77.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.3 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -71.57 -22.53 61.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.889 0.376 . . . . 10.0 110.009 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 14.2 mt -69.98 -28.09 65.24 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 177.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -65.0 -39.73 93.9 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 107.323 -1.362 . . . . 10.0 107.323 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -64.93 -39.56 93.69 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.007 -0.997 . . . . 10.0 108.729 177.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 10.5 mmt180 -62.19 -53.4 55.84 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 108.658 -0.867 . . . . 10.0 108.658 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 95.6 mt -54.59 -44.01 72.65 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.454 -0.793 . . . . 10.0 110.366 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -62.97 -48.55 78.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.412 -0.358 . . . . 10.0 110.522 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.18 -45.64 90.5 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.592 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 4.0 mmt85 -66.68 -46.2 76.41 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.942 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 5.2 mt -60.43 -41.37 93.85 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.797 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -58.72 -44.53 90.42 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.901 -0.407 . . . . 10.0 109.901 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -68.77 -42.53 77.31 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.662 -0.496 . . . . 10.0 109.662 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 71.6 mt -65.49 -24.38 67.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.398 179.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -89.5 -38.28 14.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.883 0.373 . . . . 10.0 110.841 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -72.94 -53.78 10.38 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.128 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -71.06 -32.52 69.23 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.509 -0.922 . . . . 10.0 108.509 178.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -63.46 -46.37 92.71 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.344 -0.844 . . . . 10.0 111.121 179.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.72 -41.2 98.92 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 109.975 -1.25 . . . . 10.0 109.975 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.62 -44.18 91.36 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -58.57 -45.07 89.81 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.397 179.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 87.4 mt -63.09 -51.25 67.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.816 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.24 -44.64 95.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.155 0.502 . . . . 10.0 110.373 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -65.5 -43.34 90.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.88 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -62.48 -36.22 81.79 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -64.86 -46.94 79.72 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.548 -0.538 . . . . 10.0 109.548 178.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -65.1 -41.46 94.95 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.246 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 16.1 mtmm -71.82 -16.91 62.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.481 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -86.67 -42.43 13.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.55 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.63 -40.29 96.52 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.948 -0.39 . . . . 10.0 109.948 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -71.14 -27.79 63.81 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.419 0.628 . . . . 10.0 109.461 178.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -73.75 -33.75 64.44 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.467 -0.938 . . . . 10.0 108.467 178.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 82.4 mt -78.68 -38.23 39.8 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.136 -0.938 . . . . 10.0 111.747 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 1.9 p -63.11 -45.89 89.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.923 0.392 . . . . 10.0 109.967 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 17.6 p -71.96 -15.98 62.08 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.473 0.654 . . . . 10.0 109.256 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 18.6 tp -84.32 -28.87 26.78 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.396 -0.82 . . . . 10.0 109.118 178.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 3.1 m -64.71 -34.27 77.92 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.107 -1.071 . . . . 10.0 108.107 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -73.55 -0.08 14.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.703 -1.135 . . . . 10.0 110.538 178.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -115.38 -37.06 4.13 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.548 -0.908 . . . . 10.0 108.548 177.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -75.29 -14.78 60.53 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.591 -0.731 . . . . 10.0 111.72 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -110.64 -71.19 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 120.73 -0.388 . . . . 10.0 112.028 179.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -59.4 -52.22 5.11 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.06 1.84 . . . . 10.0 112.322 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -62.82 -40.24 96.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.561 0.22 . . . . 10.0 111.468 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.75 -43.21 94.06 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.975 -0.38 . . . . 10.0 109.975 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -65.34 -34.82 79.22 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 109.744 -0.465 . . . . 10.0 109.744 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -44.7 91.96 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 178.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 82.5 mt -62.29 -40.71 97.16 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.333 178.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 65.0 mtt180 -62.91 -43.68 98.14 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.249 -0.648 . . . . 10.0 109.249 178.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -62.33 -26.61 68.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.257 -0.883 . . . . 20.0 112.564 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -89.23 -38.63 6.67 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 109.684 -1.366 . . . . 10.0 109.684 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 31.9 mt -58.1 -35.88 72.08 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.706 0.262 . . . . 10.0 111.706 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 35.3 mt -55.96 -65.38 1.56 Allowed Pre-proline 0 CA--C 1.538 0.507 0 N-CA-C 111.612 0.227 . . . . 10.0 111.612 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.9 -30.53 39.86 Favored 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 122.069 1.846 . . . . 10.0 111.783 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 4.3 t -64.89 -48.91 82.35 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 CA-C-O 120.514 0.197 . . . . 10.0 110.567 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 41.6 mt -64.22 -35.61 81.39 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -66.25 -53.7 33.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.799 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 5.5 p -60.54 -38.05 83.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.861 0.362 . . . . 10.0 110.464 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -63.12 -49.32 74.89 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.923 -0.58 . . . . 10.0 109.835 178.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -62.89 -42.22 99.69 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 116.483 -0.326 . . . . 10.0 110.863 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 48.0 t -58.43 -47.3 88.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 12.7 m -69.42 -38.96 78.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.148 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -67.36 -49.46 63.89 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.688 0.255 . . . . 10.0 111.688 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 92.1 mt -59.82 -41.34 91.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.49 -0.323 . . . . 10.0 111.233 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 22.6 p -72.23 -31.45 65.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.112 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -73.39 -33.89 65.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.904 0.383 . . . . 10.0 110.087 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 83.4 mt -60.2 -28.35 67.9 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.331 0.586 . . . . 10.0 109.913 179.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -65.78 -40.19 91.73 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.365 -0.834 . . . . 10.0 109.688 178.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.37 -47.4 84.34 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 120.86 0.362 . . . . 10.0 110.43 179.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -58.1 -46.32 85.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.465 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 10.5 m -65.21 -41.85 94.08 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.224 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -64.9 -41.34 95.68 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.631 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.87 -12.49 57.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.633 0.605 . . . . 10.0 112.633 -178.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . 0.728 ' O ' ' CB ' ' A' ' 398' ' ' ASN . 8.5 mt -76.69 -19.57 57.57 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.259 0.552 . . . . 10.0 110.415 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . 0.728 ' CB ' ' O ' ' A' ' 397' ' ' LEU . 98.9 m-20 . . . . . 0 C--N 1.326 -0.417 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.281 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 46.8 mt . . . . . 0 C--O 1.235 0.335 0 CA-C-O 121.18 0.514 . . . . 10.0 110.385 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -69.88 -39.55 76.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.503 -0.771 . . . . 10.0 110.079 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 82.1 mt -68.08 -37.02 80.75 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.24 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 81.5 mt -66.04 -42.81 89.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.699 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -46.46 85.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.453 0.644 . . . . 10.0 109.857 179.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -62.92 -48.19 80.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.969 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 16.4 t90 -58.08 -37.74 75.05 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.104 -0.498 . . . . 10.0 112.173 -179.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -60.47 -41.39 94.09 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.071 0.462 . . . . 10.0 110.378 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 6.1 m -73.69 -19.93 60.68 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.595 -0.729 . . . . 10.0 110.623 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 54.6 t -74.19 -34.12 36.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.262 -0.644 . . . . 10.0 109.262 178.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.83 -39.37 83.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.188 178.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -44.46 84.3 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.176 -0.465 . . . . 10.0 109.949 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 2.2 p -66.49 -32.45 73.82 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.168 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.37 -39.32 92.13 Favored 'General case' 0 CA--C 1.521 -0.172 0 N-CA-C 108.494 -0.928 . . . . 10.0 108.494 177.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 73.5 m -64.9 -38.13 89.93 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -72.97 10.42 0.91 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.801 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 69.3 mt -124.78 -48.74 1.77 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.335 -0.987 . . . . 10.0 108.335 178.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -65.9 -49.69 67.14 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.231 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -69.14 -22.7 63.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.272 0.558 . . . . 10.0 109.883 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.93 -36.77 30.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.61 -0.723 . . . . 10.0 109.654 179.386 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 22.9 mt -60.69 -29.61 69.42 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.96 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -51.48 -73.85 0.34 Allowed Glycine 0 CA--C 1.519 0.332 0 C-N-CA 121.272 -0.49 . . . . 10.0 112.145 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.91 -36.06 98.85 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.629 2.219 . . . . 10.0 111.738 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 38.8 t -60.61 -49.8 82.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.795 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 23.9 p -70.89 -36.28 72.68 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.405 0.145 . . . . 10.0 110.728 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -55.94 -50.14 71.56 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.785 -0.821 . . . . 10.0 108.785 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 63.0 mt-10 -69.0 -40.76 78.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.18 -0.918 . . . . 10.0 109.93 178.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -58.54 -44.09 89.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.096 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 62.9 m95 -64.81 -38.93 92.63 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 178.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -63.53 -41.49 98.47 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.756 -0.831 . . . . 10.0 108.756 178.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -64.82 -43.66 92.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.337 -0.847 . . . . 10.0 109.463 178.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 33.4 mt -60.22 -35.06 74.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.052 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -65.94 -45.3 82.34 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 178.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 32.0 mttt -57.35 -46.33 83.44 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 108.57 -0.9 . . . . 10.0 108.57 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -60.11 -49.06 79.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.025 -0.988 . . . . 10.0 110.652 179.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 27.0 m -61.36 -44.75 96.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.438 -0.346 . . . . 10.0 111.002 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -64.79 -40.8 95.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.909 0.385 . . . . 10.0 110.215 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.94 -47.36 83.56 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.045 -1.222 . . . . 10.0 110.045 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 71.0 mt -60.71 -33.0 72.23 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -64.65 -48.79 73.53 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -62.99 -37.68 88.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.183 0.516 . . . . 10.0 110.08 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -67.66 -55.75 12.04 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.685 -0.688 . . . . 10.0 110.38 179.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 71.6 mtm -68.13 -28.37 67.26 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 114.555 1.317 . . . . 10.0 114.555 -177.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.8 p -62.48 -43.6 98.41 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.013 -0.675 . . . . 10.0 109.642 179.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -78.22 -42.28 31.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.165 178.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -57.62 -58.1 9.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.206 -0.906 . . . . 10.0 111.448 -179.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 93.0 mt -64.39 -41.58 96.59 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.077 0.399 . . . . 10.0 112.077 -178.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -62.57 -48.17 80.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.027 0.441 . . . . 10.0 110.021 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -68.61 -25.17 64.73 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 179.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 1.1 t -64.75 -42.84 96.08 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 N-CA-C 108.842 -0.799 . . . . 10.0 108.842 177.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -65.91 -34.53 78.33 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.225 -0.657 . . . . 10.0 109.225 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -81.0 0.21 36.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.4 -0.818 . . . . 10.0 111.265 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 56.7 mttm -117.47 -37.66 3.46 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.625 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 25.2 t -62.76 -41.41 92.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.28 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -57.93 -58.52 18.01 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 116.665 -0.243 . . . . 10.0 110.701 178.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -60.32 -36.44 87.5 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 122.199 1.932 . . . . 10.0 110.931 178.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -60.9 -49.38 77.71 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.876 179.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 53.8 mt -70.54 -37.78 74.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.985 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -63.66 -47.61 80.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.096 0.474 . . . . 10.0 109.97 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -68.73 -32.91 73.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.688 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -66.13 -42.75 88.69 Favored 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 108.446 -0.946 . . . . 10.0 108.446 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -62.74 -46.17 89.3 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.039 -0.726 . . . . 10.0 109.039 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 12.9 mtmt -57.13 -42.42 80.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.604 179.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 13.7 mtmm -72.57 -40.55 66.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.358 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -22.3 65.01 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.882 179.401 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 64.3 mt-30 -69.92 -44.2 70.12 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 107.949 -1.13 . . . . 10.0 107.949 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . 1.262 ' O ' ' CG ' ' C' ' 469' ' ' LEU . 26.0 mt-10 -68.72 -32.07 71.59 Favored 'General case' 0 C--O 1.226 -0.165 0 N-CA-C 108.895 -0.78 . . . . 10.0 108.895 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -69.78 -55.27 10.31 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.564 -0.743 . . . . 10.0 109.989 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 45.1 tpp -61.26 -56.95 14.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.628 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -63.63 -40.69 97.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.642 0.258 . . . . 10.0 110.478 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . 1.262 ' CG ' ' O ' ' C' ' 465' ' ' GLU . 96.4 mt -59.04 -47.4 85.35 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 115.836 -0.62 . . . . 20.0 110.438 179.087 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -68.02 -34.58 76.76 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.493 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -65.89 -43.61 87.78 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.21 -0.663 . . . . 10.0 109.21 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -69.24 -8.77 48.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.076 179.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -101.99 -51.76 3.33 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.048 178.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 69.3 t -67.16 -39.87 84.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.599 -0.728 . . . . 10.0 112.876 -178.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -54.4 -58.88 11.92 Favored Pre-proline 0 N--CA 1.464 0.264 0 C-N-CA 120.916 -0.314 . . . . 10.0 111.693 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -68.64 -28.01 31.67 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 121.378 1.385 . . . . 10.0 110.555 178.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.76 -40.83 92.46 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.631 -0.507 . . . . 10.0 109.631 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -62.95 -34.67 77.99 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.02 -0.733 . . . . 10.0 109.02 179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -70.12 -49.55 49.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.004 -0.543 . . . . 10.0 109.948 178.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -62.83 -46.49 87.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.235 179.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 31.9 mt -66.08 -32.68 74.28 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.951 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -68.59 -41.46 79.59 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -70.43 -38.36 74.55 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 178.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -67.12 -32.89 81.63 Favored Glycine 0 N--CA 1.442 -0.909 0 N-CA-C 109.757 -1.337 . . . . 10.0 109.757 177.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -73.09 -43.47 61.74 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 178.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 64.5 mtt180 -63.28 -38.65 91.99 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.847 -0.797 . . . . 10.0 108.847 178.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -50.41 64.24 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.49 177.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -62.83 -32.7 73.96 Favored 'General case' 0 C--O 1.225 -0.193 0 O-C-N 123.292 0.37 . . . . 10.0 110.252 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 30.9 mt -69.56 -38.39 77.42 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -68.12 -41.97 80.91 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.204 -1.036 . . . . 10.0 108.204 177.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -61.27 -47.17 87.24 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.134 -0.939 . . . . 10.0 108.63 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 43.1 mt -65.79 -40.56 92.07 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.918 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -60.4 -45.5 93.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.013 0.435 . . . . 10.0 110.467 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -80.25 10.9 3.94 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.882 -179.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -120.13 -46.06 2.43 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.525 -0.761 . . . . 10.0 108.979 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 94.1 mt -69.67 -34.82 74.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.701 -0.681 . . . . 10.0 111.719 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 13.3 m -65.3 -58.25 12.75 Favored Pre-proline 0 CA--C 1.537 0.467 0 C-N-CA 120.682 -0.407 . . . . 10.0 111.297 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.56 -47.44 11.49 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 121.727 1.618 . . . . 10.0 111.588 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 73.3 mt -66.63 -31.51 72.23 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-O 120.679 0.276 . . . . 10.0 111.213 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.29 -48.77 61.68 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 110.038 -1.225 . . . . 10.0 110.038 178.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -65.92 -39.88 90.94 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.244 -0.65 . . . . 10.0 109.244 178.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -60.31 -52.79 63.77 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.602 178.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 42.8 mmm -57.95 -36.45 72.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.679 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 74.4 mtt180 -66.46 -43.48 85.39 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.898 -0.408 . . . . 10.0 109.898 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.73 -41.16 88.31 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 178.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 41.1 mtt180 -62.01 -42.98 99.74 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 178.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -63.79 -36.45 83.92 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.409 -0.814 . . . . 10.0 110.114 178.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 67.5 mtt180 -62.58 -42.59 99.65 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.878 -0.786 . . . . 10.0 108.878 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -86.5 19.52 2.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.962 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -131.15 -53.43 1.04 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.996 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 86.5 t -68.12 -47.61 77.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.164 -0.471 . . . . 10.0 109.999 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.23 -33.44 75.76 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 108.874 -0.788 . . . . 10.0 108.874 178.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -64.86 -50.07 68.06 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 107.671 -1.233 . . . . 10.0 107.671 177.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 21.2 mt -59.26 -35.52 73.85 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.736 178.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -59.34 -53.75 54.6 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.779 -0.823 . . . . 10.0 108.779 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.59 14.56 0.99 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.608 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -126.43 -38.03 2.14 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 122.136 -0.353 . . . . 10.0 110.363 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 84.6 mt -87.69 -33.97 18.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.56 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -58.28 -57.88 22.99 Favored Pre-proline 0 C--N 1.33 -0.272 0 C-N-CA 121.174 -0.211 . . . . 10.0 111.499 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.61 -36.52 63.75 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 121.444 1.429 . . . . 10.0 110.613 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -61.46 -46.46 89.95 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.895 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 6.3 p -67.6 -31.1 70.9 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.969 -0.382 . . . . 10.0 109.969 179.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -67.76 -41.92 82.58 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.884 -0.784 . . . . 10.0 108.884 178.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -67.12 -37.8 84.49 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 177.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 21.3 mt -62.58 -32.26 73.22 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.401 -0.818 . . . . 10.0 109.809 178.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -65.74 -37.99 87.89 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.386 -0.598 . . . . 10.0 109.386 178.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -68.64 -43.59 75.98 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.593 -0.891 . . . . 10.0 108.593 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 80.8 mtt180 -61.54 -43.95 97.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.808 -1.087 . . . . 10.0 109.466 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 30.2 mt -65.16 -35.99 82.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.719 -0.673 . . . . 10.0 109.793 178.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.86 -46.65 86.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.095 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.66 -44.65 77.35 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.53 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 10.2 mtt180 -62.14 -46.0 90.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.672 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 47.9 mt -67.52 -32.69 73.66 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.505 -0.316 . . . . 10.0 110.537 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -64.68 -44.62 89.77 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.224 -0.658 . . . . 10.0 109.224 178.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.59 -41.53 96.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.428 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 83.9 mt -65.49 -28.97 69.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.67 178.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -77.57 -43.89 30.29 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.86 -0.422 . . . . 10.0 109.86 178.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -62.33 -48.58 79.19 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.714 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -71.21 -35.3 71.48 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 115.479 -0.782 . . . . 10.0 109.458 178.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -60.27 -45.98 95.11 Favored Glycine 0 N--CA 1.445 -0.737 0 N-CA-C 111.279 -0.728 . . . . 10.0 111.279 178.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.85 99.69 Favored Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 111.048 -0.821 . . . . 10.0 111.048 179.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.81 -45.26 82.98 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 53.4 mtt180 -61.5 -39.7 91.9 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.715 179.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 75.4 mt -60.1 -42.26 94.29 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -68.51 -45.36 72.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.754 -0.657 . . . . 10.0 109.323 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.03 -51.88 67.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.522 -0.763 . . . . 10.0 110.208 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -60.45 -38.8 85.31 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.162 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -67.66 -41.72 83.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.054 0.454 . . . . 10.0 110.703 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.62 -50.54 64.66 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -32.96 74.44 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.885 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.21 -43.15 92.45 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.647 -0.501 . . . . 10.0 109.647 178.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 25.3 m -63.52 -45.0 92.62 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.489 -0.56 . . . . 10.0 109.489 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -64.41 -39.62 94.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.46 178.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -64.3 -41.55 96.79 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.616 -0.72 . . . . 10.0 110.124 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 79.7 mt -68.6 -38.23 80.44 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.483 -0.326 . . . . 10.0 110.429 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 19.3 m -66.91 -39.05 87.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.396 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 3.2 p -73.95 -25.37 59.91 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.36 179.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 32.8 mt -75.84 -41.27 52.99 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 108.738 -0.838 . . . . 10.0 108.738 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 47.0 m -61.53 -25.95 67.62 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.526 -0.761 . . . . 10.0 110.819 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -61.29 -21.94 64.4 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.839 -0.619 . . . . 10.0 110.51 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -117.43 -21.72 8.52 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.886 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -66.42 -21.72 66.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.87 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -109.89 -67.59 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.596 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.25 -54.56 1.7 Allowed 'Trans proline' 0 C--N 1.357 0.982 0 C-N-CA 122.164 1.91 . . . . 10.0 113.098 -179.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -63.04 -44.64 95.32 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.925 -0.31 . . . . 10.0 111.685 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 4.1 mt -60.63 -40.94 93.81 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-O 120.756 0.312 . . . . 10.0 110.356 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -64.79 -37.62 88.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.306 178.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.29 -39.96 78.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.942 178.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 78.2 mt -61.6 -44.7 96.52 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.25 -0.648 . . . . 10.0 109.25 178.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -65.0 -38.6 91.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.514 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -70.05 -18.24 63.28 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.745 -0.661 . . . . 20.0 112.584 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -94.2 -35.55 5.99 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 108.961 -1.656 . . . . 10.0 108.961 178.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 63.5 mt -67.51 -40.92 85.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.366 -0.417 . . . . 10.0 111.82 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 94.5 mt -53.79 -60.75 6.48 Favored Pre-proline 0 CA--C 1.534 0.364 0 N-CA-C 112.418 0.525 . . . . 10.0 112.418 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -66.34 -36.41 27.64 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 121.744 1.629 . . . . 10.0 112.401 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 1.9 p -67.3 -37.43 79.05 Favored 'Isoleucine or valine' 0 C--N 1.34 0.165 0 C-N-CA 120.434 -0.506 . . . . 10.0 111.411 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 6.2 mt -63.31 -41.14 98.92 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.178 -0.675 . . . . 10.0 109.178 178.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -64.5 -45.45 87.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.515 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 3.9 p -67.28 -31.15 71.28 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 121.165 0.507 . . . . 10.0 110.14 178.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.06 -35.98 74.65 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.764 -0.828 . . . . 10.0 108.764 178.276 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -63.97 -37.92 89.19 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.383 178.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 58.4 t -62.59 -43.26 98.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 N-CA-C 108.895 -0.78 . . . . 10.0 108.895 178.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 8.6 m -66.07 -40.01 90.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.407 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -69.36 -48.61 60.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.109 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 76.9 mt -57.63 -47.79 81.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.626 -0.261 . . . . 10.0 110.706 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 25.9 p -61.45 -42.39 98.68 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -62.31 -44.0 97.53 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.235 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 91.5 mt -57.63 -44.98 85.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.471 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -67.08 -53.14 33.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.977 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -58.09 -47.03 84.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.208 -0.451 . . . . 10.0 112.075 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -63.03 -43.68 98.05 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.355 0.502 . . . . 10.0 112.355 -179.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 10.2 p -65.11 -29.28 70.13 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.807 -0.357 . . . . 10.0 111.427 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -68.67 -22.45 64.38 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.082 0.467 . . . . 10.0 110.371 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.06 -4.65 31.93 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.491 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 86.2 mt -95.68 -40.98 9.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.395 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 . . . . . 0 C--O 1.252 1.224 0 CA-C-O 118.411 -0.804 . . . . 10.0 110.468 -179.865 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 72.6 mtp . . . . . 0 C--O 1.233 0.234 0 CA-C-O 121.204 0.526 . . . . 10.0 110.576 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 5.5 t -160.3 152.86 20.94 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.602 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -86.97 118.96 26.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.236 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -108.58 120.02 41.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.021 0.438 . . . . 10.0 111.811 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.444 ' NZ ' ' N1 ' ' A' ' 40' ' ' 17F . 2.8 mtmt -109.59 116.2 31.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.53 179.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 45.3 mt -110.73 117.98 34.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.44 -0.345 . . . . 10.0 111.197 -178.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 47.6 t -104.69 118.19 51.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.026 0.441 . . . . 10.0 110.686 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 23.4 t -92.21 116.64 33.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 17.2 m -108.47 170.09 2.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.909 0.385 . . . . 10.0 111.256 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 150.39 170.95 18.2 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.901 -0.666 . . . . 10.0 111.581 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -87.9 -174.24 4.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.878 0.371 . . . . 10.0 111.371 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.38 141.58 21.43 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.004 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 108.6 -21.52 28.01 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.647 -0.787 . . . . 10.0 112.18 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 21.9 m -80.04 162.4 3.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 120.938 0.399 . . . . 10.0 110.854 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -90.2 52.14 3.47 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.809 -0.71 . . . . 10.0 113.451 -179.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt -60.73 -58.71 7.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.12 0.486 . . . . 10.0 110.34 179.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -65.93 -32.04 73.32 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.266 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.02 -50.21 69.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.908 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 86.0 mt -59.54 -42.27 91.94 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 121.03 0.443 . . . . 10.0 110.076 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 14.4 m -61.37 -53.68 53.54 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.569 -0.741 . . . . 10.0 111.423 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 96.3 mt -61.43 -32.69 54.04 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-O 120.759 0.314 . . . . 10.0 111.115 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -67.09 -27.84 67.69 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.142 0.496 . . . . 10.0 110.62 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 23.6 tp -88.58 -33.32 17.73 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.827 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 42.5 mm -81.1 -69.48 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.935 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -84.17 -14.19 50.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.77 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 68.18 29.09 6.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.588 0.709 . . . . 10.0 109.129 -178.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 74.9 t60 -124.97 144.64 50.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.987 -1.006 . . . . 10.0 110.165 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -103.09 131.71 49.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.657 0.265 . . . . 10.0 110.899 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 4.3 m -91.84 125.76 44.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.144 178.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.35 -11.25 26.07 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.281 0.562 . . . . 10.0 110.689 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -87.5 146.13 25.95 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.877 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -88.5 64.83 7.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.963 0.411 . . . . 10.0 110.224 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.14 140.0 76.39 Favored Pre-proline 0 C--O 1.237 0.432 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.065 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -71.57 -179.51 3.77 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 122.777 2.318 . . . . 10.0 113.007 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -166.9 136.0 2.85 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.846 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 3.5 mt -117.21 -66.3 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 179.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -147.79 94.92 2.42 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -118.89 150.21 40.25 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.094 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.19 141.02 46.9 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.883 -0.327 . . . . 10.0 111.397 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . 0.41 ' CE2' ' CG2' ' D' ' 840' ' ' VAL . 30.1 m-85 -124.29 147.26 48.25 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.53 -0.304 . . . . 10.0 111.811 -178.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.11 136.44 53.64 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 112.891 0.7 . . . . 10.0 112.891 -178.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 28.8 tttm -158.72 157.89 32.62 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.226 -0.897 . . . . 10.0 109.626 178.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -133.86 123.31 24.53 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.142 -0.318 . . . . 10.0 110.142 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 10.0 m -138.36 165.65 24.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.847 0.356 . . . . 10.0 111.101 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 16.0 t -90.32 97.06 6.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.667 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 46.1 mt -86.45 120.13 35.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.674 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 51.7 m-20 68.53 -67.26 0.21 Allowed 'General case' 0 N--CA 1.465 0.293 0 O-C-N 123.766 0.667 . . . . 10.0 111.291 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . -155.12 -12.25 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 121.039 -0.6 . . . . 10.0 112.871 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -121.81 132.99 54.9 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 117.145 0.472 . . . . 10.0 111.769 -179.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 9.9 t -79.83 130.76 35.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.993 -0.548 . . . . 10.0 110.605 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -142.45 150.79 41.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.888 0.375 . . . . 10.0 111.602 -179.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 26.6 tp -79.86 129.29 34.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.158 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 82.6 mt -111.99 123.03 49.38 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.939 -179.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -103.04 103.16 13.23 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.027 -1.101 . . . . 10.0 108.027 177.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 26.9 mt -92.94 138.86 19.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.959 -0.564 . . . . 10.0 111.502 -177.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 37.2 tp -114.01 121.14 42.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.882 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -98.72 96.22 7.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.433 -0.803 . . . . 10.0 108.888 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 47.5 p -80.64 163.52 23.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.721 -0.672 . . . . 10.0 112.689 -178.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.73 158.37 30.39 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.734 -0.666 . . . . 10.0 111.102 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -83.62 -53.58 3.35 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.8 -0.714 . . . . 10.0 111.776 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -113.31 135.51 53.77 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.054 -0.35 . . . . 20.0 110.054 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -158.66 -178.26 7.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.687 0.279 . . . . 10.0 110.843 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -113.94 -91.77 0.5 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.153 0.501 . . . . 10.0 109.968 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -159.85 78.99 0.7 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.652 -0.704 . . . . 10.0 109.915 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 48.6 m -91.46 130.86 37.24 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.586 -0.734 . . . . 10.0 111.056 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.36 -34.5 73.96 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 121.245 0.545 . . . . 10.0 109.834 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 83.9 mmm -62.7 -40.29 96.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.412 -0.813 . . . . 10.0 109.81 178.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -66.18 -44.97 82.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.437 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -58.4 -32.24 68.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.811 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -61.67 -58.36 8.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.998 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 21.0 p90 -70.61 -11.95 61.26 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 113.146 0.795 . . . . 10.0 113.146 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 66.3 mmm -75.6 -16.52 60.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.27 -0.423 . . . . 10.0 109.992 178.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 20.0 mtt180 -95.18 -17.5 21.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.44 . . . . 10.0 111.245 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -87.18 13.33 9.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.319 -0.4 . . . . 10.0 111.68 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -104.73 138.25 14.06 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.61 -0.805 . . . . 10.0 111.656 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -91.38 -37.4 13.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.268 0.556 . . . . 10.0 110.74 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -132.09 143.55 15.14 Favored Glycine 0 N--CA 1.444 -0.782 0 N-CA-C 110.82 -0.912 . . . . 10.0 110.82 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -124.62 123.35 39.86 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.242 0.544 . . . . 10.0 112.111 -178.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 97.5 mt -92.18 115.77 28.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.602 -0.726 . . . . 10.0 109.666 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 9.8 m -86.37 85.59 7.33 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.783 -0.451 . . . . 10.0 109.783 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 39.6 t -82.93 119.36 32.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.005 -0.543 . . . . 10.0 112.099 -178.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 19.3 p90 -133.81 135.34 43.75 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.047 178.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -79.07 128.46 33.3 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.652 -0.249 . . . . 10.0 110.437 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 34.0 pt -70.89 -13.26 16.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.815 0.34 . . . . 10.0 111.899 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -94.17 -2.76 52.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.05 0.453 . . . . 10.0 110.023 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -126.25 102.51 7.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.034 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.29 -37.39 69.81 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.094 -0.503 . . . . 10.0 112.331 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 23.5 tptp -57.87 -34.94 70.3 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 111.928 0.344 . . . . 10.0 111.928 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 62.1 m -66.56 -35.63 80.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.652 -0.249 . . . . 10.0 111.015 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -68.22 -39.18 82.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.246 0.546 . . . . 10.0 109.971 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -73.55 -34.42 65.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.922 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.84 -14.02 62.62 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.959 -0.564 . . . . 10.0 111.965 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 32.9 mm -58.6 -42.48 84.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.903 0.382 . . . . 10.0 110.322 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -66.7 -32.49 73.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.252 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -66.98 -38.14 85.51 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.193 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -80.41 -32.27 37.51 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.123 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -56.96 -48.03 79.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.766 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -65.78 -35.74 81.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.224 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -62.05 -44.55 96.45 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.476 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 53.0 mt -66.86 -39.21 83.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.277 0.561 . . . . 10.0 110.337 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -68.54 -20.95 64.58 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.465 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 1.6 ttp-105 -84.48 -38.94 19.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.607 -0.27 . . . . 10.0 111.589 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 34.7 m -71.79 -26.02 25.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 112.391 0.515 . . . . 10.0 112.391 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 66.5 mmtt -107.27 -9.6 16.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.447 179.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 5.8 t70 54.06 38.15 28.4 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.514 -0.766 . . . . 10.0 112.351 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 22.7 t -156.49 156.66 34.1 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.421 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -95.42 -17.17 21.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.051 -0.522 . . . . 10.0 109.647 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -85.71 74.78 10.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.352 -0.84 . . . . 10.0 110.298 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 44.4 t -129.37 132.82 24.52 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.795 -0.639 . . . . 10.0 109.903 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -64.04 103.3 0.41 Allowed 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.935 2.424 . . . . 10.0 112.241 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 38.3 mtt -126.29 153.27 45.03 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.305 -0.628 . . . . 10.0 109.305 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 96.9 t -135.5 130.56 50.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 18.2 tp -80.75 114.42 19.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.496 -0.927 . . . . 10.0 108.496 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 19.4 t -111.66 110.83 33.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.073 0.463 . . . . 10.0 112.185 -177.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -82.75 136.19 15.0 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 109.011 -1.635 . . . . 10.0 109.011 177.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -121.55 153.52 37.89 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 117.557 0.679 . . . . 10.0 112.366 -178.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 90.4 mttt 69.65 44.19 0.91 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.256 -0.884 . . . . 10.0 112.615 178.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 18.7 p -79.58 -4.12 50.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.376 0.608 . . . . 10.0 110.172 178.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -93.39 1.31 56.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.342 -0.845 . . . . 10.0 110.19 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 40.5 mt -99.92 141.5 22.88 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.172 -0.467 . . . . 10.0 109.741 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -81.19 7.99 4.63 Favored 'Trans proline' 0 CA--C 1.529 0.25 0 C-N-CA 122.701 2.267 . . . . 10.0 112.284 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.49 35.43 1.64 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.943 0.402 . . . . 10.0 111.042 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 4.7 ttt180 -60.92 105.28 0.45 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.136 0.493 . . . . 10.0 112.296 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.1 m -94.56 -41.62 9.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.902 -0.59 . . . . 10.0 109.617 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 38.3 t -93.93 111.24 24.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.695 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.16 158.08 36.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.055 0.455 . . . . 10.0 111.272 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.93 -40.11 75.74 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.768 -0.651 . . . . 10.0 112.381 -179.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 19.8 tptt -59.85 -46.41 89.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.497 0.189 . . . . 10.0 111.239 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -55.67 -43.12 76.05 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.205 0.526 . . . . 10.0 110.438 178.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.48 -44.32 83.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.545 -0.752 . . . . 10.0 111.539 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -64.61 -35.13 79.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.802 0.334 . . . . 10.0 110.992 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -61.05 -49.72 76.23 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.74 -0.663 . . . . 10.0 110.656 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 13.7 tp -67.24 -42.2 84.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.766 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.23 74.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.673 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 21.5 tpt180 -60.3 -38.24 83.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.354 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 38.2 m -70.79 -24.57 62.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.655 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -93.72 -7.97 42.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.019 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 72.25 26.78 71.32 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.825 -0.625 . . . . 10.0 111.697 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 47.7 pt -122.83 149.76 57.11 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.668 0.27 . . . . 10.0 110.672 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -77.34 151.81 29.94 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.629 2.219 . . . . 10.0 111.602 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -111.78 126.83 55.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.367 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 41.3 mm -126.22 126.18 68.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.061 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -90.46 125.3 35.53 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 74.0 p -132.29 160.26 36.73 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.662 0.986 . . . . 10.0 113.662 -177.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -155.36 123.68 5.9 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.224 -1.353 . . . . 10.0 107.98 178.096 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -74.28 -30.39 62.08 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.344 0.498 . . . . 10.0 112.344 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 33.1 tttp -64.93 -45.92 83.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.485 -0.325 . . . . 10.0 111.458 -179.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.75 -0.93 36.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.956 -179.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 16.9 ttt85 57.28 47.49 16.71 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.426 0.631 . . . . 10.0 110.924 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 33.8 tp60 -83.53 106.52 15.33 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.054 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 59.05 22.13 54.6 Favored Glycine 0 CA--C 1.52 0.377 0 N-CA-C 114.742 0.657 . . . . 10.0 114.742 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 60.9 t -64.69 -48.28 85.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 117.273 0.536 . . . . 10.0 110.23 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -64.49 -46.36 83.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.186 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -63.61 -31.23 72.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.57 -0.741 . . . . 10.0 112.525 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.68 -44.12 85.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.069 0.462 . . . . 10.0 110.444 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -72.02 -37.31 69.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.55 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -64.47 -40.44 95.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.969 0.414 . . . . 10.0 110.782 179.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 46.9 m -61.54 -40.56 95.14 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.004 179.055 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 30.9 tp -62.17 -45.57 92.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.396 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 89.7 t -60.21 -41.97 88.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.308 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 67.6 mtm-85 -62.66 -37.92 88.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.108 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -67.71 -39.09 84.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.914 0.388 . . . . 10.0 110.284 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 71.7 mt -66.75 -39.57 83.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 178.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -61.99 -42.74 99.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.183 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 21.9 mtmm -67.68 -32.68 73.51 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.123 179.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 -61.99 -45.61 92.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.355 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -63.8 -36.14 82.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.479 179.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -63.24 -41.83 99.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.781 -0.645 . . . . 10.0 109.397 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 56.7 tttp -68.34 -39.71 81.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.965 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 97.2 mtp -65.15 -20.81 66.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.969 0.414 . . . . 10.0 111.524 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 13.5 m -98.25 12.56 34.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.735 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -129.67 -40.18 1.41 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.97 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.51 163.69 18.06 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.903 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 159.89 -137.27 4.99 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.783 -0.723 . . . . 10.0 112.22 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 20.7 tptm -79.22 69.1 5.37 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.219 0.533 . . . . 10.0 111.179 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 53.7 tttt -131.17 89.77 2.78 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.982 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -116.07 130.36 56.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.185 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -80.0 -52.85 7.32 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.129 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -87.33 105.6 17.36 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.455 0.645 . . . . 10.0 110.386 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 25.0 mtmm -102.88 54.11 0.77 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.807 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 1.3 m -78.28 161.9 26.92 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.917 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 39.4 tttm -97.5 -16.45 20.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.038 0.447 . . . . 10.0 110.437 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 13.9 t -139.56 -173.48 3.63 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.811 -0.632 . . . . 10.0 110.172 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -85.4 160.69 19.7 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.852 0.358 . . . . 10.0 110.428 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 57.7 m . . . . . 0 C--N 1.322 -0.59 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.621 179.543 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.248 0 N-CA-C 112.031 -0.427 . . . . 10.0 112.031 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 9.6 p -136.97 146.73 45.74 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.707 0.289 . . . . 10.0 110.958 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 92.5 t -106.74 133.15 52.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.283 -0.417 . . . . 10.0 109.888 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -85.98 106.87 17.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.285 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 46.9 t -95.84 124.21 48.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.334 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -101.56 130.93 47.96 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.969 -0.382 . . . . 10.0 109.969 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 45.2 mt -103.42 155.98 36.08 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.555 -178.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.58 53.38 3.13 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 123.424 2.75 . . . . 10.0 112.036 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -152.63 31.86 0.51 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 817' ' ' LYS . . . . . 0.424 ' NZ ' ' N1 ' ' A' ' 37' ' ' 17F . 88.4 mttt 53.96 32.54 15.56 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 114.675 -1.148 . . . . 10.0 111.439 -179.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -136.99 -179.2 5.56 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 114.13 1.159 . . . . 10.0 114.13 -177.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.02 171.44 15.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.16 -0.927 . . . . 10.0 112.178 -178.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 45.2 m -155.01 131.52 10.51 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.623 -1.251 . . . . 10.0 107.623 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 4.0 t -97.28 113.26 31.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 120.562 -0.455 . . . . 10.0 111.081 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 26.1 t -105.61 137.82 33.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.883 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 1.2 m -72.95 144.62 47.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.766 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 45.2 t -76.19 119.47 24.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.552 -0.295 . . . . 10.0 110.403 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -114.08 130.42 56.57 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.917 0.389 . . . . 10.0 111.063 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -75.28 129.86 38.13 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.979 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 82.88 2.2 90.65 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.971 -0.558 . . . . 10.0 112.582 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 7.1 ttt -89.44 126.97 35.78 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 122.726 -0.279 . . . . 10.0 110.39 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.11 150.68 27.36 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.391 -0.226 . . . . 10.0 110.391 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 92.9 t -54.05 -38.85 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 O-C-N 123.228 0.33 . . . . 10.0 110.885 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -57.13 -31.05 64.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.319 -0.4 . . . . 10.0 111.396 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -82.98 -45.67 13.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.509 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.33 -42.68 78.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.031 0.443 . . . . 10.0 111.352 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -80.28 -8.57 59.53 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.855 -179.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -61.45 -61.19 2.71 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 110.051 -0.352 . . . . 10.0 110.051 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 39.3 mttt -62.77 -29.81 70.98 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.885 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -69.05 -25.77 64.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.942 0.401 . . . . 10.0 110.762 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 40.0 mt -93.07 -44.3 8.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.149 179.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 10.5 mmtt -61.27 -23.63 65.81 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.668 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 840' ' ' VAL . . . . . 0.41 ' CG2' ' CE2' ' B' ' 40' ' ' TYR . 1.4 p -49.66 -20.88 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 N-CA-C 112.916 0.71 . . . . 10.0 112.916 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -140.59 23.17 2.31 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.368 0.604 . . . . 10.0 111.721 177.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 75.59 28.41 61.4 Favored Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 115.601 -0.727 . . . . 10.0 114.654 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 96.6 mt -92.4 154.26 18.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 117.598 0.699 . . . . 10.0 110.215 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -121.68 143.28 49.44 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.815 0.341 . . . . 10.0 111.602 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -60.64 -28.69 68.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.813 -0.63 . . . . 10.0 111.822 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -76.81 -4.34 43.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.468 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 2.2 t -131.95 18.16 4.61 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 120.966 0.412 . . . . 10.0 110.972 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 79.6 m -142.65 153.29 43.3 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.485 -0.325 . . . . 10.0 110.472 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 14.6 p -130.6 141.81 45.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.42 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 26.0 t -109.75 122.96 65.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.351 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -103.8 142.85 33.66 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.953 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 42.3 mmm-85 -82.89 164.78 20.27 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.333 -0.849 . . . . 10.0 109.819 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 16.2 tp -124.52 62.07 1.13 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.469 0.652 . . . . 10.0 110.551 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 44.3 mt -84.4 102.25 10.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.28 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp 61.44 17.07 8.07 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.431 -0.804 . . . . 10.0 112.194 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 105.05 -18.32 42.99 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.94 -0.648 . . . . 10.0 112.412 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -81.35 138.45 35.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.968 0.413 . . . . 10.0 110.897 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -88.34 122.36 31.77 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.466 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 3.7 m -122.53 136.1 54.8 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.037 -0.529 . . . . 10.0 109.787 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 6.4 t -75.74 123.91 32.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 110.391 -0.225 . . . . 10.0 110.391 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 3.2 t -104.6 160.7 14.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.544 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -99.1 149.63 22.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.569 -0.287 . . . . 10.0 110.914 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -70.55 -27.42 64.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.924 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.16 1.61 39.63 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.532 0.567 . . . . 10.0 112.532 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 23.5 m -84.98 148.2 26.32 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 179.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -82.48 150.33 27.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.026 0.441 . . . . 10.0 111.622 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 8.8 tp -84.7 -10.32 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.845 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -58.11 -55.6 43.64 Favored Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 113.024 0.75 . . . . 10.0 113.024 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -77.81 13.21 1.74 Allowed 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 122.345 2.03 . . . . 10.0 112.161 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.83 -8.0 20.1 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.094 -0.503 . . . . 10.0 109.983 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -58.01 127.28 31.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.78 -0.646 . . . . 10.0 111.285 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 121.85 -16.43 8.87 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.479 -0.867 . . . . 10.0 113.402 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -126.95 -170.58 2.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.11 0.455 . . . . 10.0 112.115 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -113.26 170.24 8.37 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.991 -0.549 . . . . 10.0 110.784 -178.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 36.8 mt -130.83 129.74 42.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.671 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 17.5 mt -114.38 112.73 41.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.312 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 24.4 t -97.74 137.08 26.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 120.728 0.299 . . . . 10.0 110.615 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.55 171.05 14.66 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.091 -0.504 . . . . 10.0 109.909 179.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 5.8 m -105.11 149.15 8.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.076 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 92.3 mt . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.739 -0.648 . . . . 10.0 111.495 -179.197 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PCW . . . . . 0.41 ' P ' ' O1 ' ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PCW . . . . . 0.455 ' N ' ' N1 ' ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' 17F . . . . . 0.455 ' N1 ' ' N ' ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' 17F . . . . . 0.424 ' N1 ' ' NZ ' ' D' ' 817' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' 17F . . . . . 0.41 ' O1 ' ' P ' ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' 17F . . . . . 0.444 ' N1 ' ' NZ ' ' B' ' 5' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 201' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 88.4 mt . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 121.047 0.451 . . . . 10.0 110.432 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -59.23 -44.33 92.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.575 -0.739 . . . . 10.0 111.202 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 71.4 mt -75.28 -36.83 61.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.785 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 73.1 mt -60.33 -50.71 72.52 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.118 0.485 . . . . 10.0 111.045 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.16 -35.69 81.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.012 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -68.99 -41.75 77.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.512 179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 17.5 m0 -62.51 -33.55 75.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.309 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -66.73 -33.37 75.49 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.233 0.54 . . . . 10.0 109.926 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 19.2 m -73.05 -26.3 61.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.815 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 95.3 t -78.99 -44.89 24.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.514 178.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.11 -37.5 87.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.27 -0.423 . . . . 10.0 111.507 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 2.9 p -64.84 -36.15 83.41 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 178.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 40.6 m -71.96 -38.14 69.82 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 109.351 -0.611 . . . . 10.0 109.351 178.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -60.49 -45.87 92.18 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.421 178.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.95 -42.35 99.79 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.357 -0.383 . . . . 10.0 110.281 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 31.8 mmtt -64.32 -35.24 80.23 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.034 0.445 . . . . 10.0 109.91 178.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 55.8 mt -67.67 -46.19 73.08 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 86.3 mtt180 -61.97 -45.12 95.04 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.223 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -56.2 -42.38 77.09 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.583 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -79.26 -30.0 42.89 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.708 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 17.5 mt -61.93 -30.81 71.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.538 -0.301 . . . . 10.0 111.068 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -56.12 -67.0 2.44 Favored Glycine 0 C--N 1.331 0.268 0 N-CA-C 111.421 -0.671 . . . . 10.0 111.421 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -60.66 -37.11 81.85 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 121.955 1.77 . . . . 10.0 111.438 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 8.0 t -56.05 -47.18 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 O-C-N 123.172 0.295 . . . . 10.0 111.591 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 1.4 p -65.78 -39.16 90.72 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.517 -0.473 . . . . 10.0 110.03 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -61.29 -47.72 84.7 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 109.476 -0.565 . . . . 10.0 109.476 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -64.09 -41.3 97.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.364 179.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -62.36 -48.36 80.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.026 179.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 2.2 m95 -67.02 -40.7 87.29 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.5 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -56.07 -52.47 64.15 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.13 0.491 . . . . 10.0 110.037 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 54.0 m-80 -64.98 -42.99 94.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.413 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 7.1 mt -63.53 -33.49 75.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.248 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -66.96 -34.77 78.48 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.781 0.324 . . . . 10.0 110.403 179.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 16.3 mttp -72.96 -38.52 66.71 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.283 -1.006 . . . . 10.0 108.283 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.42 -53.84 49.04 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 114.97 -1.014 . . . . 10.0 109.732 178.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 6.5 p -64.12 -36.41 83.94 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.193 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -59.05 -46.28 88.63 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 109.086 -0.709 . . . . 10.0 109.086 178.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -63.41 -44.69 96.4 Favored Glycine 0 N--CA 1.442 -0.906 0 N-CA-C 109.582 -1.407 . . . . 10.0 109.582 178.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 94.3 mt -63.09 -31.96 73.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.762 -0.219 . . . . 10.0 111.167 179.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 49.2 mtt180 -66.18 -41.13 90.7 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.484 -0.562 . . . . 10.0 109.484 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -78.52 -25.01 45.46 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.259 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -76.68 -62.62 1.57 Allowed 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.473 -0.785 . . . . 10.0 110.199 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 93.1 mmm -56.79 -30.56 63.8 Favored 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 113.25 0.833 . . . . 10.0 113.25 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 3.1 p -63.38 -50.97 67.82 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.404 -0.518 . . . . 10.0 109.761 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -74.98 -33.1 61.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.044 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -59.74 -59.38 5.53 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.125 178.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.25 -35.42 78.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.878 -0.601 . . . . 10.0 111.114 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -61.89 -45.82 92.09 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 120.67 0.271 . . . . 10.0 110.585 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -72.19 -38.36 69.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.05 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 41.3 t -61.81 -39.33 83.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.92 -0.4 . . . . 10.0 109.92 178.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -75.29 -46.61 32.4 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.869 0.366 . . . . 10.0 110.769 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.33 74.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.526 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -90.2 -20.08 23.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.327 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.23 -29.9 47.67 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.206 0 N-CA-C 109.997 -0.371 . . . . 10.0 109.997 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -64.2 3.36 Favored Pre-proline 0 C--O 1.219 -0.513 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.147 178.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -59.87 -31.76 94.29 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 121.73 1.62 . . . . 10.0 111.548 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -61.21 -57.7 11.35 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.008 0.432 . . . . 10.0 109.895 178.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 96.3 mt -73.1 -38.56 66.3 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.822 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -58.42 -49.18 78.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.761 0.315 . . . . 10.0 110.448 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.48 -45.53 92.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.839 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -63.72 -37.56 87.83 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 116.059 -0.518 . . . . 10.0 111.106 179.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -69.6 -39.94 76.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.682 0.277 . . . . 10.0 110.266 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 48.7 mttp -64.27 -42.88 96.24 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 177.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -65.05 -44.5 88.8 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 178.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 6.7 t90 -60.6 -36.62 79.01 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.685 -0.689 . . . . 10.0 110.24 179.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -61.99 -49.89 74.27 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.733 -0.84 . . . . 10.0 108.733 178.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -59.85 -43.79 94.45 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.753 -0.658 . . . . 10.0 109.344 178.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -61.09 -47.24 87.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.596 -0.729 . . . . 10.0 111.258 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 95.6 mmm -71.43 -43.66 66.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.811 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -61.61 -48.16 82.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.903 0.382 . . . . 10.0 110.248 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 69.4 mt -67.23 -23.59 65.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.5 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.75 -51.51 13.98 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 177.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 45.0 mtt85 -60.4 -41.28 93.54 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.668 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.05 -20.54 58.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.611 -0.722 . . . . 10.0 111.063 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 47.5 mttp -103.19 -41.09 6.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.643 179.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 38.5 t -47.11 -43.18 7.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 112.432 0.531 . . . . 10.0 112.432 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 63.9 mt-10 -64.3 -63.78 3.45 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 112.755 0.65 . . . . 10.0 112.755 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.37 -36.15 88.27 Favored 'Trans proline' 0 C--N 1.357 0.982 0 C-N-CA 121.807 1.671 . . . . 10.0 111.998 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 23.1 mt -67.63 -31.57 71.68 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 110.005 -0.368 . . . . 10.0 110.005 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 5.9 mtt180 -72.89 -35.85 67.19 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -58.96 -46.66 87.5 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.5 -0.555 . . . . 10.0 109.5 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -65.0 -40.63 95.23 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 178.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -43.41 97.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.42 -0.809 . . . . 10.0 109.696 179.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -69.6 -44.93 69.74 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.536 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -60.79 -49.73 76.3 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 110.177 -0.305 . . . . 10.0 110.177 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -59.47 -42.43 97.58 Favored Glycine 0 N--CA 1.443 -0.843 0 N-CA-C 110.863 -0.895 . . . . 10.0 110.863 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -66.1 -44.58 83.94 Favored 'General case' 0 C--O 1.223 -0.334 0 O-C-N 123.539 0.199 . . . . 10.0 110.814 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 37.1 mtt180 -58.89 -46.74 87.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.906 0.384 . . . . 10.0 110.194 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -61.72 -47.55 84.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.525 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.97 -44.06 94.71 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.266 179.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 77.0 mt -60.25 -40.23 89.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.275 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -64.62 -47.68 77.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.015 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -64.52 -31.0 72.03 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.072 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 39.6 mt -72.2 -40.97 67.48 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.881 -0.6 . . . . 10.0 109.575 178.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -60.55 -36.18 77.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.234 0.54 . . . . 10.0 109.666 178.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -72.4 3.77 4.44 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.667 179.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 45.2 mttp -126.24 -24.69 3.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.567 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 82.6 mt -76.54 -33.08 58.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.631 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 4.5 m -89.66 -61.6 0.22 Allowed Pre-proline 0 CA--C 1.538 0.513 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.815 179.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -59.05 -63.86 0.12 Allowed 'Trans proline' 0 C--N 1.357 0.986 0 C-N-CA 122.4 2.067 . . . . 10.0 112.244 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 88.4 mt -63.17 -25.86 68.54 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.414 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -68.17 -49.03 49.43 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 110.1 -1.2 . . . . 10.0 110.1 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -63.44 -35.75 81.47 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.912 -0.403 . . . . 10.0 109.912 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -64.3 -45.12 89.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.095 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.7 ttt -67.47 -33.77 75.79 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.094 -0.706 . . . . 10.0 109.094 178.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -64.19 -44.2 92.72 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.165 -0.68 . . . . 10.0 109.165 178.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -65.58 -42.42 91.78 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.269 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 11.4 mmt180 -62.6 -37.57 86.76 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 178.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -67.22 -35.99 80.76 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 115.844 -0.616 . . . . 10.0 109.713 178.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -60.92 -50.86 71.71 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.72 -0.844 . . . . 10.0 108.72 178.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.33 -37.51 87.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.741 178.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -57.85 -55.29 36.81 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.202 178.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 87.5 t -71.28 -40.04 73.34 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.264 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.608 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -60.57 -47.82 84.5 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.978 -0.289 . . . . 10.0 110.366 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -64.95 -28.32 69.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.358 0.599 . . . . 10.0 109.398 178.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . 0.412 ' O ' ' N ' ' A' ' 320' ' ' LEU . 8.9 mt -71.2 -39.88 71.52 Favored 'General case' 0 C--O 1.216 -0.698 0 N-CA-C 108.744 -0.836 . . . . 10.0 108.744 177.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -61.45 -43.92 98.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.356 -0.383 . . . . 10.0 110.398 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -15.66 63.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.847 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -106.17 -39.08 6.07 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.504 -0.317 . . . . 10.0 111.756 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . 0.412 ' N ' ' O ' ' A' ' 316' ' ' LEU . 50.2 mt -60.15 -36.25 77.11 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 122.251 0.22 . . . . 10.0 111.132 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -60.75 -62.06 6.72 Favored Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.657 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -60.78 -33.83 92.41 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.709 1.606 . . . . 10.0 110.899 178.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -60.33 -49.77 76.26 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 32.6 m -66.59 -37.77 85.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.172 179.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.41 -41.26 93.78 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -66.0 -37.38 85.79 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.778 -0.823 . . . . 10.0 108.778 177.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 51.4 mt -61.77 -37.08 82.98 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.03 178.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -64.32 -40.79 96.61 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -62.16 -42.67 99.48 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -65.48 -50.6 64.74 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 115.512 -0.767 . . . . 10.0 109.671 178.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -55.87 -40.5 73.02 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.923 -0.581 . . . . 10.0 110.587 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.24 -45.46 94.42 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -64.42 -45.83 85.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.267 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 7.6 mmt85 -61.35 -46.19 91.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.54 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 64.5 mt -62.18 -41.99 98.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.962 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -61.08 -42.38 98.4 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 178.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.26 -40.39 86.2 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 78.2 mt -67.75 -20.72 65.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.125 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 71.4 mttt -87.35 -47.68 8.6 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 178.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -67.97 -62.33 1.45 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.958 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -68.76 -39.09 80.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.285 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -60.5 -43.63 98.61 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.934 -0.65 . . . . 10.0 111.74 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -64.79 -43.36 96.31 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 110.415 -1.074 . . . . 10.0 110.415 178.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -62.93 -40.43 97.6 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.413 -0.588 . . . . 10.0 109.413 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -60.21 -44.48 95.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.073 -0.967 . . . . 10.0 109.863 178.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 73.7 mt -64.68 -40.48 95.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.121 179.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -63.31 -45.81 89.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.73 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.02 -42.74 97.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.934 -0.576 . . . . 10.0 109.837 178.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -62.43 -41.67 98.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.114 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -65.37 -41.66 93.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.382 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.89 -48.46 80.37 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.642 -0.503 . . . . 10.0 109.642 178.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 47.6 mttm -62.43 -41.51 98.76 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.494 -0.775 . . . . 10.0 110.295 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.78 -45.76 91.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.196 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 28.8 m -61.38 -45.51 94.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.892 -0.594 . . . . 10.0 110.67 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -71.53 -31.19 66.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.003 0.43 . . . . 10.0 111.366 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -72.39 -25.39 61.48 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 40.9 mt -71.88 -39.84 69.35 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.252 -0.648 . . . . 10.0 109.252 178.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -44.12 88.03 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 178.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.1 p -70.71 -20.57 62.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.723 179.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 9.3 mt -80.38 -39.24 28.79 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.642 -0.873 . . . . 10.0 108.642 177.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 16.2 m -66.54 -31.78 72.71 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.534 -0.913 . . . . 10.0 108.534 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -75.06 9.01 2.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.086 -0.961 . . . . 10.0 110.782 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -128.33 -46.69 1.33 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.268 -1.012 . . . . 10.0 108.268 178.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -67.61 -7.3 25.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.458 -0.792 . . . . 10.0 112.518 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -106.42 -66.96 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.526 0 C-N-CA 120.95 -0.3 . . . . 10.0 111.806 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -66.28 -47.59 3.16 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 121.58 1.52 . . . . 10.0 112.557 -178.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -65.08 -38.98 92.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.506 0.193 . . . . 10.0 111.122 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 1.5 mt -68.47 -39.85 81.24 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.701 -0.4 . . . . 10.0 110.065 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -68.96 -35.38 76.68 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.557 -0.535 . . . . 10.0 109.557 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -47.21 81.82 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.855 -1.165 . . . . 10.0 107.855 177.574 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 65.3 mt -62.28 -41.19 98.27 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.311 -0.859 . . . . 10.0 110.775 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 52.4 mtt180 -63.39 -43.34 97.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.114 0.483 . . . . 10.0 110.035 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -68.13 -21.06 64.95 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.439 -0.8 . . . . 20.0 111.869 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -93.24 -37.35 5.66 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.821 -0.912 . . . . 10.0 110.821 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 18.5 mt -59.52 -37.52 78.55 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.306 0.484 . . . . 10.0 112.306 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 81.8 mt -58.85 -62.33 5.97 Favored Pre-proline 0 CA--C 1.535 0.378 0 N-CA-C 111.734 0.272 . . . . 10.0 111.734 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -63.68 -35.17 59.75 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.012 1.808 . . . . 10.0 112.044 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 15.6 t -64.46 -47.25 90.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-O 120.645 0.26 . . . . 10.0 110.581 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 18.3 mt -63.92 -32.3 73.78 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.655 -0.498 . . . . 10.0 109.655 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -69.87 -46.96 64.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.429 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.1 p -62.49 -36.85 83.82 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.187 -0.672 . . . . 10.0 109.187 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -68.47 -45.85 71.33 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.339 -0.846 . . . . 10.0 109.845 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 25.3 mtmt -60.17 -45.44 93.09 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.991 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 70.8 t -59.7 -44.63 94.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 109.752 -0.462 . . . . 10.0 109.752 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 27.9 m -65.93 -40.55 91.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.493 178.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 7.4 m-30 -65.23 -48.0 74.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.764 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 75.1 mt -58.77 -48.67 80.43 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.256 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 18.3 p -66.44 -25.52 66.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.519 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -82.0 -42.07 19.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.41 179.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.48 -41.37 85.14 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.41 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -64.45 -36.36 83.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.245 178.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.79 -43.28 84.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.039 0.447 . . . . 10.0 110.954 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -56.84 -52.43 65.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.761 -0.654 . . . . 10.0 111.009 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 394' ' ' THR . . . . . 1.251 ' CG2' ' ND2' ' A' ' 398' ' ' ASN . 0.9 OUTLIER -69.32 -22.47 63.77 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.838 0.352 . . . . 10.0 111.234 -179.633 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -68.1 -37.67 81.45 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.324 -0.398 . . . . 10.0 111.069 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -91.89 -38.58 12.22 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.956 0.408 . . . . 10.0 111.953 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 9.4 mp -75.97 -36.33 59.3 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.2 -0.455 . . . . 10.0 111.689 -178.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . 1.251 ' ND2' ' CG2' ' A' ' 394' ' ' THR . 98.8 m-20 . . . . . 0 N--CA 1.465 0.282 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.172 -179.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 1.1 mm? . . . . . 0 N--CA 1.464 0.243 0 CA-C-O 121.052 0.453 . . . . 10.0 110.677 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 12.6 mtmt -84.89 45.54 1.17 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.848 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 6.8 mp -63.1 -31.36 72.48 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.771 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.43 -37.34 86.63 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.392 -0.822 . . . . 10.0 110.386 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.4 -38.6 74.69 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -68.22 -36.34 79.35 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.118 -0.697 . . . . 10.0 109.118 178.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 68.9 t90 -66.49 -36.7 83.38 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.419 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -60.68 -46.39 90.53 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.939 -0.573 . . . . 10.0 109.96 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -32.81 74.69 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.129 0.49 . . . . 10.0 109.979 179.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 36.0 t -67.9 -37.61 78.7 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.089 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 177.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 21.8 m -68.52 -42.13 78.93 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.684 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.98 -43.36 88.03 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.897 -0.321 . . . . 10.0 110.538 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 7.4 p -65.7 -38.14 88.4 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.409 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.58 -40.1 88.77 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.156 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 30.8 m -62.52 -44.67 95.79 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 178.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -69.43 -25.29 64.04 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.137 178.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.0 -36.38 67.01 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.998 -1.112 . . . . 10.0 107.998 177.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -72.68 -23.6 60.9 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.235 -0.893 . . . . 10.0 110.191 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -64.33 -38.83 92.41 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 107.923 -1.14 . . . . 10.0 107.923 176.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -69.36 -30.19 68.14 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 115.103 -0.953 . . . . 10.0 109.057 178.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 88.5 mt -72.3 -1.74 16.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.633 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -92.82 -93.29 1.47 Allowed Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.748 -0.739 . . . . 10.0 111.483 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -52.94 -46.03 36.73 Favored 'Trans proline' 0 N--CA 1.473 0.3 0 C-N-CA 123.321 2.681 . . . . 10.0 113.172 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 67.6 t -55.08 -42.47 65.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.429 0.157 . . . . 10.0 111.178 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 2.8 m -72.71 -34.42 67.11 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.962 0.411 . . . . 10.0 110.069 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -61.7 -52.84 62.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.946 -0.57 . . . . 10.0 109.782 178.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.51 -19.38 64.52 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -70.8 -42.79 69.86 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.292 -1.003 . . . . 10.0 108.292 178.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 18.9 m0 -69.4 -33.71 73.41 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.691 -0.855 . . . . 10.0 108.691 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -67.89 -41.83 82.13 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.772 -0.825 . . . . 10.0 108.772 177.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -63.95 -38.79 92.37 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.572 -0.899 . . . . 10.0 108.572 177.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 30.1 mt -66.6 -27.78 67.98 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.707 -0.678 . . . . 10.0 109.986 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -68.18 -38.81 82.44 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 107.705 -1.22 . . . . 10.0 107.705 177.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -68.57 -41.83 79.18 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.52 -0.919 . . . . 10.0 108.52 177.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 56.3 mm-40 -58.96 -53.76 54.78 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 115.353 -0.84 . . . . 10.0 109.886 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 16.4 p -63.52 -37.05 85.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 10.0 112.073 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -69.59 -45.4 68.72 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -63.95 -48.47 75.7 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.271 -1.132 . . . . 10.0 110.271 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 20.4 mt -62.58 -28.47 69.9 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 109.974 -0.38 . . . . 10.0 109.974 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -65.3 -42.88 92.63 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -65.22 -44.34 88.55 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -62.65 -55.17 29.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.434 -0.803 . . . . 10.0 110.375 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 87.0 mmm -59.61 -45.7 91.15 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 112.972 0.73 . . . . 10.0 112.972 -179.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 15.8 p -57.28 -51.18 70.39 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.913 -0.315 . . . . 10.0 111.08 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -65.84 -46.18 79.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.726 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.18 -43.57 95.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.214 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 63.3 mt -70.69 -45.06 65.7 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.673 0.273 . . . . 10.0 111.175 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -59.98 -45.21 93.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.126 0.488 . . . . 10.0 110.345 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -74.87 -26.8 59.93 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.454 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.91 -35.0 73.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.769 0.319 . . . . 10.0 110.383 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -70.47 -34.0 71.91 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.48 -0.933 . . . . 10.0 108.48 177.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -82.2 -1.45 49.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.034 -0.984 . . . . 10.0 109.95 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -105.5 -44.41 4.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.603 -0.726 . . . . 10.0 109.055 178.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 53.6 t -61.07 -34.95 62.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.894 -0.593 . . . . 10.0 110.376 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -56.99 -62.46 5.11 Favored Pre-proline 0 CA--C 1.537 0.469 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.148 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -65.5 -29.25 53.23 Favored 'Trans proline' 0 C--N 1.36 1.164 0 C-N-CA 121.6 1.534 . . . . 10.0 111.08 178.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -61.32 -56.0 25.34 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 178.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 41.9 mt -61.05 -40.86 95.22 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.424 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -59.59 -50.31 74.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.804 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -72.12 -37.29 69.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.776 -178.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -65.17 -47.62 76.34 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -67.11 -32.33 73.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.26 -0.427 . . . . 10.0 109.948 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.15 -52.16 63.57 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.979 -0.748 . . . . 10.0 108.979 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 22.7 mttm -66.34 -34.32 77.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.188 -0.915 . . . . 10.0 110.108 179.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 6.9 m95 -68.64 -32.54 72.46 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.239 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 -66.85 -44.26 81.48 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 107.875 -1.157 . . . . 10.0 107.875 177.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -62.78 -41.79 99.4 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.833 -0.802 . . . . 10.0 108.833 177.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.55 -44.03 95.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.971 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 9.0 mmt -61.26 -44.44 97.24 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.57 -0.53 . . . . 10.0 109.57 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -61.89 -52.55 63.64 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.955 -0.757 . . . . 10.0 108.955 178.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 96.2 mt -54.6 -49.21 70.99 Favored 'General case' 0 C--O 1.225 -0.187 0 CA-C-N 115.62 -0.718 . . . . 20.0 111.474 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -60.49 -45.7 92.83 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 116.42 -0.355 . . . . 10.0 111.093 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -68.17 -46.16 71.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.608 0.242 . . . . 10.0 111.286 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -69.07 -15.94 63.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.798 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 65.2 mttt -97.31 -51.96 3.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.154 178.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 24.7 t -59.44 -39.08 78.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.107 -0.497 . . . . 10.0 112.049 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -54.86 -63.77 2.61 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 112.238 0.458 . . . . 10.0 112.238 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -68.86 -27.49 30.9 Favored 'Trans proline' 0 C--N 1.354 0.866 0 C-N-CA 121.823 1.682 . . . . 10.0 111.141 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 10.4 tp -65.3 -51.5 60.28 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 178.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 61.0 mtt180 -67.21 -31.61 72.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.607 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -63.85 -45.49 89.27 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.381 -0.6 . . . . 10.0 109.381 178.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.84 -30.46 56.35 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.298 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 20.4 mt -69.47 -40.77 76.9 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 109.679 -0.489 . . . . 10.0 109.679 178.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -67.02 -46.07 75.61 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.826 -0.435 . . . . 10.0 109.826 178.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -64.6 -41.46 96.2 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.798 -0.816 . . . . 10.0 108.798 178.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -64.42 -40.07 97.45 Favored Glycine 0 N--CA 1.443 -0.869 0 N-CA-C 110.88 -0.888 . . . . 10.0 110.88 178.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.39 -38.62 81.49 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 109.465 -0.569 . . . . 10.0 109.465 178.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -63.41 -43.71 96.71 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 108.797 -0.816 . . . . 10.0 108.797 178.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -65.04 -41.66 95.0 Favored 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 109.203 -0.666 . . . . 10.0 109.203 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 28.4 tptt -65.41 -42.4 92.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.085 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 67.7 mt -65.87 -43.66 87.73 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -61.55 -45.88 92.28 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.497 -0.927 . . . . 10.0 108.497 178.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -57.19 -51.96 67.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.875 -1.057 . . . . 10.0 109.03 178.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 78.6 mt -63.93 -42.22 97.42 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.865 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -61.36 -44.28 97.45 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.612 0.244 . . . . 10.0 111.233 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -72.08 -2.05 17.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.009 0.433 . . . . 10.0 111.253 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -111.31 -47.42 3.19 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.91 178.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 93.7 mt -64.93 -28.29 69.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.729 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 46.8 m -68.25 -62.17 3.35 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 120.791 -0.363 . . . . 10.0 110.832 178.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -62.19 -38.42 55.62 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.63 1.554 . . . . 10.0 111.288 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 13.0 mt -70.58 -32.39 69.76 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.581 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -63.65 -48.18 79.8 Favored Glycine 0 N--CA 1.449 -0.441 0 N-CA-C 110.807 -0.917 . . . . 10.0 110.807 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -63.05 -39.94 96.24 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -64.61 -45.53 86.51 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.039 179.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 85.2 mmm -60.62 -35.74 76.91 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.624 -0.51 . . . . 10.0 109.624 178.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 55.4 mtt180 -67.66 -41.58 83.56 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -63.13 -42.42 99.51 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.999 -0.741 . . . . 10.0 108.999 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -62.43 -47.32 84.6 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.45 -46.14 89.6 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 115.318 -0.856 . . . . 10.0 110.479 179.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -61.45 -46.03 91.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.784 0.326 . . . . 10.0 110.19 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -63.96 -36.15 83.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.634 179.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -76.0 -45.9 32.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.839 179.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 76.3 t -67.45 -43.38 87.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.619 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -64.56 -35.84 82.29 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.025 -0.732 . . . . 10.0 109.025 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.62 -44.39 86.66 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 107.316 -1.365 . . . . 10.0 107.316 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 50.9 mt -59.8 -35.42 74.64 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.24 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 67.6 mtt180 -62.02 -49.35 76.36 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.638 -0.504 . . . . 10.0 109.638 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 4.7 p -81.81 6.15 16.48 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.899 -0.591 . . . . 10.0 111.865 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 49.2 m170 -116.96 -45.86 2.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.857 0.36 . . . . 10.0 110.954 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 97.8 mt -76.04 -38.23 57.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.481 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -58.47 -58.66 17.41 Favored Pre-proline 0 CA--C 1.533 0.315 0 N-CA-C 111.658 0.244 . . . . 10.0 111.658 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.55 -37.5 58.08 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 121.518 1.479 . . . . 10.0 111.094 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -60.58 -47.54 85.76 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.802 0.334 . . . . 10.0 110.28 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 34.9 m -69.4 -32.35 71.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.066 -0.515 . . . . 10.0 109.94 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -67.31 -41.65 85.0 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.288 -0.634 . . . . 10.0 109.288 178.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -63.74 -38.82 92.52 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 107.971 -1.122 . . . . 10.0 107.971 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 79.7 mt -65.15 -31.64 72.93 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 115.142 -0.935 . . . . 10.0 110.061 178.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -63.39 -34.24 77.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.169 0.509 . . . . 10.0 109.706 178.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -80.04 -48.0 13.99 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.023 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 50.8 mtt180 -64.84 -50.86 64.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.738 -0.665 . . . . 10.0 111.835 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 70.5 mt -60.62 -33.03 72.16 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.329 -0.249 . . . . 10.0 110.329 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -66.55 -39.58 88.61 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.944 -0.761 . . . . 10.0 108.944 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.27 -41.39 81.11 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 109.216 -0.661 . . . . 10.0 109.216 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -60.89 -43.99 97.73 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.33 -0.85 . . . . 10.0 108.8 178.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 60.0 mt -67.97 -34.62 76.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.679 -0.692 . . . . 10.0 110.078 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.41 -42.63 99.58 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.179 -0.675 . . . . 10.0 109.179 178.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -66.92 -43.6 82.86 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.176 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 88.5 mt -66.02 -24.8 66.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.758 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -80.18 -42.85 22.61 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.78 -0.452 . . . . 10.0 109.78 178.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -67.68 -47.76 68.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.366 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -74.22 -35.87 63.9 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.426 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -63.94 -46.59 91.12 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.423 -1.071 . . . . 10.0 110.423 178.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.62 -41.96 99.75 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 110.5 -1.04 . . . . 10.0 110.5 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -62.73 -53.07 59.99 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 54.3 mtt85 -52.99 -46.81 68.49 Favored 'General case' 0 C--O 1.221 -0.427 0 O-C-N 123.781 0.676 . . . . 10.0 110.784 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 54.6 mt -59.34 -42.77 92.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.462 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -71.86 -42.85 66.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.756 0.312 . . . . 10.0 110.842 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -66.81 -52.72 40.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.633 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 21.2 m-30 -65.45 -20.25 66.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.643 0.259 . . . . 10.0 111.174 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -68.33 -39.4 81.96 Favored 'General case' 0 CA--C 1.519 -0.25 0 N-CA-C 107.619 -1.252 . . . . 10.0 107.619 177.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -78.13 -32.74 50.53 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.15 -0.932 . . . . 10.0 108.768 178.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.11 -33.89 76.81 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.441 -0.8 . . . . 10.0 109.492 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.83 -45.51 89.26 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.443 -0.798 . . . . 10.0 109.103 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -33.76 76.48 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.262 179.135 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -60.8 -37.28 81.41 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 108.49 -0.929 . . . . 10.0 108.49 178.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -80.14 -36.19 35.56 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.216 -0.902 . . . . 10.0 110.998 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 65.4 mt -63.75 -41.89 97.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.843 0.354 . . . . 10.0 111.072 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 2.7 p -67.43 -39.68 85.47 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.986 0.422 . . . . 10.0 110.342 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 7.5 p -74.21 -24.75 59.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.919 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 20.5 mt -74.89 -33.05 62.0 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.992 -0.744 . . . . 10.0 108.992 177.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 49.2 m -61.95 -26.82 68.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.298 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -65.34 -17.37 64.47 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-O 121.383 0.611 . . . . 10.0 110.26 178.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 3.8 mptt -111.15 -35.08 5.99 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.899 179.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -63.96 -22.6 66.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.64 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 75.9 mttt -114.15 -70.6 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.49 0 CA-C-O 119.313 -0.375 . . . . 10.0 111.951 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -58.43 -51.76 6.8 Favored 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 122.151 1.901 . . . . 10.0 113.2 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -63.82 -41.5 97.85 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.065 -0.254 . . . . 10.0 111.408 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 1.1 mt -63.88 -38.52 91.39 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.829 -0.348 . . . . 10.0 110.107 178.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -66.84 -39.03 87.5 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.66 -41.16 96.29 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.726 -0.842 . . . . 10.0 108.726 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 51.5 mt -63.15 -42.97 99.54 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.762 178.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -64.9 -43.03 94.2 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.021 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -65.36 -20.53 66.43 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.733 -0.667 . . . . 20.0 111.591 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -92.86 -38.37 5.5 Favored Glycine 0 CA--C 1.523 0.548 0 N-CA-C 109.397 -1.481 . . . . 10.0 109.397 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 26.4 mt -54.78 -42.71 72.08 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.36 0.504 . . . . 10.0 112.36 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 96.0 mt -58.99 -62.05 6.6 Favored Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 120.811 -0.356 . . . . 10.0 111.709 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.36 -38.64 89.59 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.231 1.954 . . . . 10.0 111.741 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 27.3 t -63.31 -46.75 94.73 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-O 120.722 0.296 . . . . 10.0 110.413 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 24.1 mt -64.61 -39.57 93.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.252 -0.277 . . . . 10.0 110.252 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -63.15 -48.95 76.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.33 -0.395 . . . . 10.0 110.631 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 23.1 p -65.79 -39.79 91.31 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.768 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.14 -40.77 96.87 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 116.22 -0.445 . . . . 10.0 109.831 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -61.26 -37.77 84.31 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.515 178.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 86.0 t -62.98 -46.21 96.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.21 -0.45 . . . . 10.0 109.874 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.17 -34.84 77.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.104 -0.498 . . . . 10.0 111.079 179.288 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -73.62 -44.77 56.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.158 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 15.8 mt -58.41 -47.38 84.1 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.393 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 14.1 p -64.11 -39.89 95.03 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.312 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -62.81 -50.71 69.91 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.998 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 67.9 mt -62.79 -28.64 70.13 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.166 0.432 . . . . 10.0 112.166 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -86.57 -33.15 20.32 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.556 0.576 . . . . 10.0 112.556 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -85.13 -38.7 18.76 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.65 0.611 . . . . 10.0 112.65 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -67.1 -29.24 68.94 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 112.25 0.463 . . . . 10.0 112.25 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.28 -30.21 70.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.848 0.356 . . . . 10.0 110.905 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -63.47 -26.62 68.81 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.928 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.97 -4.59 46.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.594 -179.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 82.8 mt -98.5 -15.79 19.44 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.359 -0.382 . . . . 10.0 111.398 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 . . . . . 0 C--O 1.246 0.877 0 CA-C-O 118.412 -0.804 . . . . 10.0 110.229 179.927 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.241 0 N-CA-C 109.818 -0.438 . . . . 10.0 109.818 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.5 m -109.94 104.59 13.53 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.793 0.33 . . . . 10.0 110.468 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -99.65 116.32 31.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.45 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -109.51 119.61 39.96 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.582 -179.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 6.8 mptt -93.86 122.89 36.81 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 42.4 mt -117.93 124.37 48.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.836 0.351 . . . . 10.0 111.232 -178.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 29.2 t -107.86 114.14 45.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.226 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 26.0 t -91.15 117.09 33.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.36 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 19.1 m -113.68 161.41 12.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.719 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 152.57 172.03 20.65 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 111.321 -0.711 . . . . 10.0 111.321 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.74 167.05 11.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.189 0.519 . . . . 10.0 112.081 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -67.66 -16.57 67.98 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 115.863 -0.608 . . . . 10.0 113.94 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -115.0 18.72 16.08 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.398 -0.906 . . . . 10.0 113.73 -179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 35.8 m -80.27 -32.27 13.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 117.691 0.746 . . . . 10.0 112.184 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.69 39.34 2.76 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.782 -0.723 . . . . 10.0 113.129 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -61.14 -47.99 83.67 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.9 p -62.49 -43.28 99.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.517 0.199 . . . . 10.0 111.106 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.01 -47.47 85.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.126 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 35.8 mt -61.82 -44.99 95.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.391 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 6.7 m -65.82 -51.4 59.26 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.041 -0.527 . . . . 10.0 112.283 -178.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 50.3 mt -62.48 -30.27 48.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-O 120.932 0.396 . . . . 10.0 110.688 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 28.4 tp60 -66.28 -25.1 66.71 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.753 179.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 36.2 tp -95.15 -32.97 12.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.066 0.46 . . . . 10.0 110.219 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 48.8 mm -73.27 -63.48 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.997 -0.547 . . . . 10.0 112.058 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -110.04 -3.6 16.36 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 -178.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 20.1 m-80 66.57 38.51 4.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.4 0.619 . . . . 10.0 109.703 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 21.2 t60 -123.52 114.21 19.77 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.55 -179.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -85.1 134.82 34.18 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.592 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 m -98.96 115.19 38.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 N-CA-C 109.668 -0.493 . . . . 10.0 109.668 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -85.84 -7.07 58.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.081 -0.508 . . . . 10.0 111.65 -178.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -101.39 161.61 13.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.077 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -85.81 91.7 8.41 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.084 0.469 . . . . 10.0 110.854 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.11 135.16 37.5 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.097 179.097 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.3 172.29 14.38 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.605 2.203 . . . . 10.0 112.364 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -165.6 136.13 3.68 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.398 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 4.2 mp -130.56 -62.54 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 107.398 -1.334 . . . . 10.0 107.398 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.94 85.36 1.68 Allowed 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.029 -0.987 . . . . 10.0 109.031 178.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -120.86 110.41 16.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.611 -0.722 . . . . 10.0 111.006 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.51 149.1 24.05 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.464 -0.789 . . . . 10.0 112.292 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -124.54 176.39 6.55 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.245 -0.888 . . . . 10.0 109.129 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -163.09 130.56 3.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.571 0.224 . . . . 10.0 111.268 -179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -157.49 158.02 34.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.401 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -120.83 128.0 52.44 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 7.9 m -139.53 173.52 10.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.999 0.428 . . . . 10.0 110.96 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 21.9 t -103.43 106.03 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.545 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 58.9 mt -102.99 114.42 42.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.684 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 61.32 27.19 16.89 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.947 -0.57 . . . . 10.0 111.571 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.63 -9.25 73.92 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.566 -0.826 . . . . 10.0 113.035 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -105.43 124.33 49.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.858 0.361 . . . . 10.0 110.903 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 12.7 t -80.85 136.91 36.17 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.723 -0.473 . . . . 10.0 109.723 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -154.68 161.0 41.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.727 0.299 . . . . 10.0 111.18 -179.256 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 29.7 tp -96.45 130.15 43.66 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 86.7 mt -109.3 115.86 30.78 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.925 0.393 . . . . 10.0 112.012 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -101.15 97.32 7.87 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.044 -1.095 . . . . 10.0 108.044 178.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 27.5 mt -93.5 129.24 44.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.897 -0.592 . . . . 10.0 112.496 -177.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 48.3 tp -119.26 115.59 24.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.861 -0.608 . . . . 10.0 109.91 178.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -89.59 119.31 29.9 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.793 -0.639 . . . . 10.0 110.293 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 40.2 p -75.74 156.83 34.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.881 -0.6 . . . . 10.0 112.074 -178.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.38 155.17 9.56 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.488 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.52 -53.14 26.22 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.636 -0.792 . . . . 10.0 111.587 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -132.77 128.79 37.59 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.854 -0.424 . . . . 20.0 109.854 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -140.09 171.41 14.21 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.152 -0.476 . . . . 10.0 109.77 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -108.18 -86.54 0.51 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.198 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -164.38 93.29 0.67 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.029 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 31.5 t -118.42 153.56 33.89 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.894 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.93 -28.76 69.75 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.179 0.514 . . . . 10.0 110.188 179.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 11.2 mmm -64.08 -31.59 72.83 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.06 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 48.8 ttt85 -67.17 -52.47 40.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.397 -0.82 . . . . 10.0 110.572 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -31.77 67.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.602 -0.727 . . . . 10.0 110.099 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -61.71 -57.59 11.36 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.31 -0.859 . . . . 10.0 112.313 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -71.07 -18.71 62.54 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.373 0.879 . . . . 10.0 113.373 -178.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 84.9 mtp -89.39 -5.51 57.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.09 0.472 . . . . 10.0 111.016 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 11.0 ttm105 -89.18 -33.1 17.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.671 -179.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -47.48 62.19 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.837 0.68 . . . . 10.0 112.837 -178.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.49 148.38 45.29 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.678 -0.772 . . . . 10.0 113.897 -178.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -107.52 -45.65 4.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.192 0.52 . . . . 10.0 109.795 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -92.05 133.77 11.91 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.239 -0.744 . . . . 10.0 111.239 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -125.69 132.1 52.47 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.329 0.492 . . . . 10.0 112.329 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 78.0 mt -97.3 114.35 26.1 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.762 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 21.1 m -87.31 89.94 8.18 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 21.9 t -91.14 123.48 43.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.78 -0.645 . . . . 10.0 111.417 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -132.95 168.73 17.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.822 -0.626 . . . . 10.0 109.668 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -102.8 120.89 41.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 110.022 -0.362 . . . . 10.0 110.022 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 42.2 pt -68.99 -7.75 8.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 112.124 0.416 . . . . 10.0 112.124 -179.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -102.92 7.12 39.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.279 0.562 . . . . 10.0 110.603 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -141.77 100.54 3.77 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.065 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.9 -27.04 64.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.886 -0.597 . . . . 10.0 112.16 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 9.2 tmtm? -58.28 -47.58 83.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.515 -0.311 . . . . 10.0 110.939 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 71.1 p -67.75 -31.0 70.61 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.26 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -67.19 -40.74 86.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.091 0.472 . . . . 10.0 110.142 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -71.88 -29.36 64.27 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.727 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.57 -11.64 61.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.914 -0.584 . . . . 10.0 112.006 -179.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 33.3 mm -59.46 -40.93 83.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.887 0.375 . . . . 10.0 110.086 179.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -64.18 -39.9 94.97 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 108.692 -0.855 . . . . 10.0 108.692 178.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 8.2 t-160 -63.26 -39.33 94.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.227 -0.897 . . . . 10.0 110.132 179.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -69.88 -52.22 26.62 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.529 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 8.6 ttt180 -54.1 -43.11 70.13 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.629 0.252 . . . . 10.0 111.435 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -65.39 -38.03 88.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.343 -0.389 . . . . 10.0 111.267 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.21 -36.45 77.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.965 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 73.8 mt -70.99 -37.86 69.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.344 178.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -60.39 -32.17 71.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.663 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 1.2 ttp-105 -68.01 -29.97 69.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.667 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 22.3 m -95.57 -9.35 9.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.541 -0.3 . . . . 10.0 111.536 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 14.0 mmtt -103.96 -18.22 14.68 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.572 -0.286 . . . . 10.0 110.861 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 15.2 t70 75.87 -39.0 0.36 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.644 -0.707 . . . . 10.0 112.527 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 5.0 m -107.73 156.29 19.26 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.726 0.298 . . . . 10.0 111.026 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 35.1 mp0 -81.18 -19.66 42.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.944 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . 0.403 ' OD2' ' NE2' ' B' ' 166' ' ' HIS . 31.6 t70 -79.16 84.12 5.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.522 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 19.8 t -127.39 132.6 24.41 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.858 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -65.53 99.23 0.36 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.581 2.188 . . . . 10.0 111.322 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 66.9 mtt -121.56 153.79 37.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.592 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 99.1 t -134.62 130.67 53.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 179.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 14.6 tp -85.35 114.67 22.59 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.644 -0.502 . . . . 10.0 109.644 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 66.2 t -109.34 112.05 38.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.784 -178.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -93.93 97.82 2.26 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 110.339 -1.104 . . . . 10.0 110.339 178.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -87.07 162.67 17.45 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.139 0.422 . . . . 10.0 112.139 -178.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 92.8 mttt 74.15 34.95 0.8 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.207 -0.906 . . . . 10.0 112.455 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 5.4 p -71.74 -7.47 48.29 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.983 0.42 . . . . 10.0 111.457 179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -90.33 -5.12 56.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.785 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 68.0 mt -96.52 129.22 33.76 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.267 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.79 1.1 8.47 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 123.191 2.594 . . . . 10.0 112.136 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.35 16.16 5.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.419 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -56.8 122.29 11.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.65 -0.705 . . . . 10.0 111.902 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.71 -22.54 11.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.318 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 38.9 t -98.55 118.18 44.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.56 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -72.12 151.24 43.16 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.263 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 2.0 m -58.59 -42.55 88.31 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.243 0.46 . . . . 10.0 112.243 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -67.13 -34.67 78.09 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.678 0.251 . . . . 10.0 111.678 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -61.36 -43.34 99.03 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.232 0.539 . . . . 10.0 109.931 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.53 -42.78 64.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.643 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -59.86 -43.97 94.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.053 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -61.25 -43.48 98.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.718 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 31.2 tp -65.04 -40.41 94.76 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.232 -0.44 . . . . 10.0 109.897 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.32 -46.43 88.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.707 -0.678 . . . . 10.0 110.402 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -64.54 -32.9 74.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.242 -0.436 . . . . 10.0 110.482 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 44.0 m -70.61 -18.31 62.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.593 179.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -106.08 1.11 26.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.852 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 66.69 28.93 74.01 Favored Glycine 0 CA--C 1.517 0.199 0 CA-C-N 115.914 -0.584 . . . . 10.0 112.801 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 49.4 pt -123.21 153.84 65.02 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.593 0.235 . . . . 10.0 110.874 -179.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -83.29 149.22 13.25 Favored 'Trans proline' 0 C--O 1.235 0.332 0 C-N-CA 122.435 2.09 . . . . 10.0 112.019 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -109.46 128.22 54.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.253 -0.431 . . . . 10.0 110.12 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 24.7 mm -126.48 123.99 64.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.085 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -83.01 127.01 33.17 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 107.792 -1.188 . . . . 10.0 107.792 178.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 11.1 m -133.58 160.6 36.99 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.136 0.493 . . . . 10.0 112.21 -177.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 12.7 t -157.58 123.53 4.72 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.025 -0.731 . . . . 10.0 109.025 178.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -76.89 -21.39 54.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.074 0.464 . . . . 10.0 110.065 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -73.06 -48.4 36.32 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.173 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 34.2 p -92.04 -6.21 51.48 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.032 0.444 . . . . 10.0 111.205 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 3.4 ttt-85 58.86 38.13 24.64 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.354 -0.839 . . . . 10.0 111.484 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -107.22 136.07 47.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.057 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 76.44 -10.09 18.38 Favored Glycine 0 CA--C 1.518 0.254 0 O-C-N 123.531 0.519 . . . . 10.0 114.332 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 22.5 t -55.52 -54.82 21.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 112.117 0.414 . . . . 10.0 112.117 -178.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.91 -47.7 82.14 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.994 -178.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -62.46 -36.55 82.8 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.255 0.465 . . . . 10.0 112.255 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -59.42 -47.19 86.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.935 0.398 . . . . 10.0 110.48 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -68.81 -42.55 77.13 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.644 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 17.2 m-30 -61.67 -43.69 98.37 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.658 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 97.0 m -59.11 -40.45 85.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.26 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 30.1 tp -57.5 -44.69 85.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.289 0.566 . . . . 10.0 109.56 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 44.5 t -65.73 -38.23 81.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.179 179.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -63.04 -35.68 81.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.843 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -69.83 -41.4 75.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.05 0.452 . . . . 10.0 110.004 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 85.1 mt -62.85 -43.64 99.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.31 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.34 -48.44 74.21 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.707 179.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 29.1 mtmm -64.77 -37.58 88.1 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.238 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . 0.403 ' NE2' ' OD2' ' B' ' 108' ' ' ASP . 3.1 t-160 -61.25 -43.05 99.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.845 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -65.97 -46.6 77.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.39 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.63 -47.82 83.68 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.384 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -62.9 -34.92 78.45 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.014 0.376 . . . . 10.0 112.014 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 15.1 mmt -71.74 -34.92 69.92 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.901 0.381 . . . . 10.0 110.583 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 21.6 m -70.85 -24.59 62.54 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.2 -0.455 . . . . 10.0 111.409 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 27.5 mtmt -97.34 -4.68 38.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.754 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 47.8 t0 62.62 94.96 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.794 0.683 . . . . 10.0 112.015 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . -83.07 76.18 2.28 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.816 -0.707 . . . . 10.0 112.227 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 39.1 mmtm -73.76 74.14 1.56 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.087 0.47 . . . . 10.0 111.13 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -113.65 115.65 28.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.852 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 20.3 mmmt 70.97 -59.92 0.53 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.995 0.739 . . . . 10.0 112.995 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -75.43 93.09 2.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.926 0.393 . . . . 10.0 110.367 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.36 155.79 15.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.872 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -94.76 101.16 12.98 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 178.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 10.8 m -70.89 87.48 0.72 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.555 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 23.2 mmtt -151.35 -156.9 0.76 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.211 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.48 100.78 3.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.343 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . 0.436 ' NZ ' ' O1P' ' A' ' 4' ' ' PCW . 19.4 tptp -105.13 -9.86 17.5 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.81 -179.326 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 85.7 m . . . . . 0 C--O 1.236 0.37 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.938 179.905 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.036 -0.426 . . . . 10.0 112.036 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.28 131.75 53.78 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.806 0.336 . . . . 10.0 110.694 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 49.0 t -118.64 140.83 40.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.996 -178.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.96 123.11 34.2 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.353 178.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 47.0 t -107.6 136.96 41.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 116.11 -0.496 . . . . 10.0 109.952 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -90.58 133.3 35.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.933 0.397 . . . . 10.0 111.487 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 83.7 mt -101.67 147.63 34.13 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.766 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.72 45.16 0.84 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 123.247 2.631 . . . . 10.0 113.458 -178.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -148.98 27.58 0.86 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.117 0.484 . . . . 10.0 109.998 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 49.3 mttm 60.37 44.16 12.57 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.176 -0.92 . . . . 10.0 111.826 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -147.91 177.1 9.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.952 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.97 168.46 19.92 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.858 0.361 . . . . 10.0 111.287 -178.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 12.0 t -147.63 151.55 36.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.737 -0.665 . . . . 10.0 109.283 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 4.2 t -104.9 117.46 50.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.809 0.338 . . . . 10.0 111.016 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 21.1 t -112.68 140.81 30.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.716 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.22 137.03 33.71 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.71 179.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 22.0 t -87.43 120.88 37.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.824 0.345 . . . . 10.0 110.15 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 16.5 mtp180 -129.34 135.11 48.32 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.698 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -78.84 49.37 0.9 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.92 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . -161.04 25.98 0.27 Allowed Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 120.457 -0.878 . . . . 10.0 112.34 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 11.6 ptm -151.94 159.06 43.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.626 0.25 . . . . 10.0 111.128 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 93.9 p -100.98 -179.71 4.13 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.737 -179.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 98.6 t -67.1 -33.39 62.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 108.898 -0.779 . . . . 10.0 108.898 178.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -59.38 -43.14 92.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.463 -0.789 . . . . 10.0 110.546 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -68.73 -56.07 9.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.115 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 1.7 m -57.59 -37.22 72.84 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.383 0.883 . . . . 10.0 113.383 -178.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -91.89 -8.98 44.87 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.915 0.709 . . . . 10.0 112.915 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -62.07 -56.81 15.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.956 0.407 . . . . 10.0 110.499 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -59.93 -33.16 71.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.82 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -67.75 -36.57 80.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.491 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 88.0 mt -86.13 -43.31 13.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.42 -0.355 . . . . 10.0 111.913 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 16.1 mmtp -61.64 -30.71 70.89 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.16 0.429 . . . . 10.0 112.16 -179.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 5.1 p -71.11 -17.82 20.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.926 0.394 . . . . 10.0 111.226 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -108.93 -2.85 18.01 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.893 0.331 . . . . 10.0 111.893 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 83.91 33.52 20.98 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 120.934 -0.651 . . . . 10.0 113.057 179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 64.3 mt -121.27 154.78 35.89 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -123.15 152.56 41.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.855 0.36 . . . . 10.0 111.035 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -66.73 -6.24 15.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.592 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -74.13 -27.1 60.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.691 -0.686 . . . . 10.0 111.599 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 1.9 m -124.38 20.57 8.79 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.655 0.264 . . . . 10.0 111.697 -178.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 82.6 m -143.9 157.34 44.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.926 0.393 . . . . 10.0 110.721 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 4.4 p -144.43 156.54 14.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.87 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 3.8 m -100.62 127.95 53.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.168 0.508 . . . . 10.0 112.3 -179.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -107.03 117.28 33.64 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 12.7 mtm180 -75.93 127.39 32.89 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 110.126 -0.324 . . . . 10.0 110.126 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.66 87.66 6.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.008 0.433 . . . . 10.0 110.883 -179.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 54.1 mt -99.67 103.1 14.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.353 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt 52.91 28.7 6.83 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.42 0.896 . . . . 10.0 113.42 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 98.53 6.37 56.47 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.535 -0.841 . . . . 10.0 113.318 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 45.0 mmt-85 -113.99 117.03 30.18 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.387 -0.478 . . . . 10.0 111.143 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -73.43 109.59 7.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.819 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 4.0 m -104.42 117.4 34.08 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.422 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 2.1 t -67.55 132.86 32.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.742 -179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 28.7 m -136.27 146.75 47.03 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.118 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -81.4 170.03 16.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.508 -179.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -83.26 -18.49 38.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.04 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.04 -16.41 63.15 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.702 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.19 148.38 43.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.273 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -82.16 161.57 22.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.385 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 9.2 tp -89.32 -0.48 8.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.499 0.666 . . . . 10.0 110.861 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -62.42 -51.33 74.1 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 113.193 0.812 . . . . 10.0 113.193 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -78.08 31.8 0.44 Allowed 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 122.491 2.127 . . . . 10.0 112.864 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -117.62 25.96 10.04 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.239 0.542 . . . . 10.0 110.108 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -71.78 105.38 3.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.915 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 90.17 13.16 60.74 Favored Glycine 0 CA--C 1.517 0.217 0 C-N-CA 120.842 -0.694 . . . . 10.0 113.095 178.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -114.43 156.15 25.04 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 122.709 -0.289 . . . . 10.0 110.648 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -114.4 154.5 28.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.577 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 6.3 mt -128.21 135.56 49.87 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.409 -0.359 . . . . 10.0 111.696 -178.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 63.9 mt -118.88 118.28 57.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 108.488 -0.93 . . . . 10.0 108.488 178.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 11.9 t -90.02 124.3 42.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.566 0.222 . . . . 10.0 110.58 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -127.0 155.29 43.44 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.014 0.435 . . . . 10.0 111.045 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 13.5 t -76.28 143.55 12.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.426 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 79.7 mt . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.438 -0.791 . . . . 10.0 111.313 -179.869 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PCW . . . . . 0.436 ' O1P' ' NZ ' ' B' ' 184' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PCW . . . . . 0.411 ' O2P' ' NZ ' ' B' ' 184' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 201' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 74.8 mt . . . . . 0 CA--C 1.518 -0.28 0 CA-C-O 121.288 0.566 . . . . 10.0 110.171 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 41.5 mttm -61.42 -35.83 78.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.948 -1.023 . . . . 10.0 110.458 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 25.0 mt -66.6 -34.24 77.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.833 -0.622 . . . . 10.0 110.799 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 95.9 mt -66.43 -44.08 83.91 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.344 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.62 -35.16 76.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.956 0.407 . . . . 10.0 110.535 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -65.66 -48.11 73.26 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 178.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 3.2 m95 -65.77 -30.65 71.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.725 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -63.05 -34.57 77.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.396 0.617 . . . . 10.0 109.717 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 49.6 m -78.21 -23.18 47.62 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.458 -0.792 . . . . 10.0 109.671 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 77.6 t -77.76 -45.75 27.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.806 -0.633 . . . . 10.0 109.697 178.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 4.9 p -63.31 -43.14 98.65 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.887 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 26.8 p -61.09 -42.35 98.35 Favored 'General case' 0 C--N 1.333 -0.113 0 N-CA-C 109.75 -0.463 . . . . 10.0 109.75 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 84.6 m -67.31 -38.49 85.04 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.877 178.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 1.7 m-30 -61.47 -40.64 95.25 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.089 0.471 . . . . 10.0 109.958 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 28.6 m -68.26 -45.97 71.71 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.092 178.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.4 -31.77 73.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.066 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 11.2 mt -67.49 -40.66 85.23 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.47 -0.567 . . . . 10.0 109.47 178.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 85.6 mtm180 -72.66 -33.42 66.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.861 179.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -62.14 -30.51 71.09 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -90.9 -32.66 15.93 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.329 -0.85 . . . . 10.0 109.952 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 18.3 mt -59.56 -38.02 79.99 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.532 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -53.21 -67.83 1.93 Allowed Glycine 0 C--N 1.33 0.231 0 N-CA-C 111.426 -0.67 . . . . 10.0 111.426 178.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -58.73 -37.89 91.8 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.565 2.177 . . . . 10.0 111.786 177.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 4.6 t -55.94 -50.39 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-O 120.609 0.242 . . . . 10.0 110.754 179.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 4.7 p -67.16 -32.32 73.35 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.56 -0.456 . . . . 10.0 110.366 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -64.56 -52.0 59.88 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 178.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -61.18 -43.91 98.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.845 178.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -61.06 -48.82 79.95 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.838 179.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 17.5 m95 -63.28 -39.11 93.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.723 0.297 . . . . 10.0 110.833 179.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -62.8 -49.99 72.77 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.213 0.53 . . . . 10.0 110.269 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -68.45 -36.03 78.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.783 179.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 13.6 mt -65.05 -32.34 74.01 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -68.28 -37.52 80.77 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.942 -0.762 . . . . 10.0 108.942 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -67.81 -39.95 83.89 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.734 -0.839 . . . . 10.0 108.734 178.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.26 -50.83 68.63 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.626 -0.716 . . . . 10.0 109.468 178.41 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 2.2 p -63.59 -38.06 89.7 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.819 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -61.38 -44.05 97.82 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 109.917 -0.401 . . . . 10.0 109.917 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -66.03 -45.54 86.82 Favored Glycine 0 N--CA 1.443 -0.866 0 N-CA-C 109.19 -1.564 . . . . 10.0 109.19 177.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 46.8 mt -59.63 -34.21 72.49 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 115.256 -0.472 . . . . 10.0 111.166 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 69.9 mtt180 -70.72 -44.38 66.98 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 178.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -64.78 -29.64 70.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.318 -0.856 . . . . 10.0 109.757 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -86.93 -38.83 16.32 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.716 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 1.7 mmt -62.01 -36.64 82.13 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.827 -0.17 . . . . 10.0 111.329 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 2.0 p -62.0 -39.99 94.11 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.79 -0.819 . . . . 10.0 108.79 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -73.35 -45.57 54.3 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.201 178.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.91 -54.26 41.25 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 115.892 -0.595 . . . . 10.0 109.462 179.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 75.7 mt -63.52 -44.17 95.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.142 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -58.69 -55.18 38.45 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 120.746 0.308 . . . . 10.0 110.815 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -63.89 -50.09 70.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.821 -0.627 . . . . 10.0 111.603 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 46.1 t -59.55 -45.58 93.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 112.057 0.391 . . . . 10.0 112.057 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -72.48 -40.52 66.87 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.348 0.499 . . . . 10.0 112.348 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -68.68 -33.35 73.82 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.892 0.377 . . . . 10.0 110.696 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -88.12 -24.51 23.36 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.498 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -63.45 -24.25 35.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.016 0.436 . . . . 10.0 110.005 179.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -62.45 -64.5 2.98 Favored Pre-proline 0 N--CA 1.451 -0.419 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.43 178.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -63.59 -29.19 70.05 Favored 'Trans proline' 0 C--N 1.361 1.193 0 C-N-CA 121.802 1.668 . . . . 10.0 111.363 177.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 5.0 m-30 -59.58 -57.77 11.52 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 109.424 -0.584 . . . . 10.0 109.424 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 72.7 mt -72.35 -32.86 66.85 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 115.686 -0.688 . . . . 10.0 111.003 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -60.98 -49.06 78.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.748 0.309 . . . . 10.0 110.585 179.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -63.31 -44.97 93.48 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -61.41 -43.65 98.5 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.805 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -62.64 -46.23 89.19 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 110.258 -0.275 . . . . 10.0 110.258 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 71.0 mttt -59.6 -45.57 91.52 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.089 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -65.8 -46.02 80.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.0 179.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 4.0 m0 -58.51 -41.14 84.76 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.39 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -59.86 -48.12 82.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.817 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -64.12 -41.63 97.16 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -60.9 -40.1 91.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.861 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 96.2 mmm -75.6 -39.25 58.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.742 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -62.05 -52.58 63.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.286 0.565 . . . . 10.0 109.612 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.54 -22.44 66.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.504 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -78.63 -46.44 19.24 Favored 'General case' 0 C--O 1.221 -0.406 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 178.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 43.0 mtt85 -62.98 -33.96 76.52 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.271 0.558 . . . . 10.0 109.78 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -70.63 -7.02 41.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.338 -0.846 . . . . 10.0 110.477 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -112.62 -36.38 5.23 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.493 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 53.5 t -48.96 -49.08 15.96 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.673 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -62.7 -59.04 13.77 Favored Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 111.747 0.277 . . . . 10.0 111.747 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -56.26 -44.05 50.11 Favored 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 122.032 1.821 . . . . 10.0 111.932 178.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 34.8 mt -64.74 -40.06 94.69 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 116.578 -0.283 . . . . 10.0 110.304 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -65.9 -35.36 80.42 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 109.214 -0.661 . . . . 10.0 109.214 178.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.94 -44.18 90.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.738 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -61.98 -48.24 81.24 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.9 -43.85 97.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.32 -0.855 . . . . 10.0 110.584 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -63.62 -50.55 68.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.745 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -59.15 -45.86 89.87 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.899 0.38 . . . . 10.0 110.139 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.38 -44.64 96.54 Favored Glycine 0 N--CA 1.442 -0.921 0 N-CA-C 111.015 -0.834 . . . . 10.0 111.015 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -62.22 -38.29 88.62 Favored 'General case' 0 C--O 1.221 -0.441 0 N-CA-C 110.438 -0.208 . . . . 10.0 110.438 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -58.24 -43.61 87.88 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -71.16 -49.98 38.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.144 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 59.9 mttt -57.48 -49.34 76.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.538 -0.756 . . . . 10.0 111.507 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 69.8 mt -66.46 -34.35 77.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.519 -0.31 . . . . 10.0 110.986 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.77 -53.25 57.14 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.682 -0.488 . . . . 10.0 109.682 179.194 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.4 -37.55 81.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.633 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 60.8 mt -64.57 -48.63 74.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.8 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 15.3 mt-30 -69.74 -33.36 72.35 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.84 0.353 . . . . 10.0 111.037 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.5 -11.2 60.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.148 178.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 9.8 mttp -103.3 -38.64 7.14 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.94 -0.573 . . . . 10.0 109.84 177.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 59.0 mt -63.73 -19.9 65.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.727 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 14.8 m -80.63 -64.7 0.29 Allowed Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 116.578 -0.283 . . . . 10.0 111.736 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -68.72 -51.3 0.51 Allowed 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.954 1.769 . . . . 10.0 111.964 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 93.0 mt -66.81 -25.09 66.28 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.938 0.399 . . . . 10.0 110.193 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -72.88 -41.19 50.06 Favored Glycine 0 N--CA 1.444 -0.822 0 N-CA-C 109.075 -1.61 . . . . 10.0 109.075 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -64.41 -41.79 96.44 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 178.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -64.11 -31.87 73.23 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.156 -0.475 . . . . 10.0 109.851 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 11.0 tpt -67.68 -42.3 82.34 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.741 -0.837 . . . . 10.0 108.741 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 61.6 mtt180 -69.82 -40.11 76.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.449 -0.796 . . . . 10.0 109.801 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -62.37 -43.26 99.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.497 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . 0.573 ' CG ' ' CD1' ' C' ' 469' ' ' LEU . 23.1 mmt180 -70.06 -32.03 69.92 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.547 178.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -67.18 -38.65 85.77 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.738 -0.838 . . . . 10.0 108.738 178.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 82.3 mtt180 -56.74 -54.68 43.47 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 108.993 -0.743 . . . . 10.0 108.993 178.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -64.13 -39.82 94.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.498 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -57.37 -54.98 40.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.89 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 31.5 t -73.68 -36.2 46.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.636 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -63.55 -44.52 93.92 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.874 -0.33 . . . . 10.0 110.553 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -63.95 -31.97 73.35 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.492 -0.929 . . . . 10.0 108.492 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 7.3 mt -69.44 -37.36 77.33 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.276 -0.874 . . . . 10.0 109.044 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 70.2 mtt180 -62.11 -47.2 85.69 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.997 -0.372 . . . . 10.0 109.997 178.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 1.6 m -69.16 -9.24 51.91 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.148 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -104.21 -46.57 4.39 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.642 179.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 96.4 mt -64.17 -34.51 78.23 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.42 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.71 -60.67 8.65 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-O 119.668 -0.206 . . . . 10.0 111.422 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -66.76 -31.29 39.84 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 121.632 1.554 . . . . 10.0 111.494 178.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 4.6 m-30 -64.84 -42.01 95.26 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.824 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 11.9 p -71.93 -38.54 69.83 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 178.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -62.95 -44.27 96.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.192 0.52 . . . . 10.0 109.638 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -71.18 -31.23 67.39 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.42 -32.04 73.36 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.201 -0.666 . . . . 10.0 109.201 178.111 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 80.9 mtt180 -64.62 -39.44 93.71 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.589 -0.893 . . . . 10.0 108.589 177.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -66.7 -40.43 88.47 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.956 -0.757 . . . . 10.0 108.956 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -63.83 -49.15 73.95 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.459 178.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 69.9 mt -58.81 -42.15 88.46 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.878 -0.601 . . . . 10.0 109.607 178.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -62.8 -50.42 71.07 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.591 178.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -56.28 -42.7 77.91 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.889 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -71.34 -54.46 10.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.057 -0.52 . . . . 10.0 111.348 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 94.1 mt -63.22 -44.45 95.22 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.78 0.659 . . . . 10.0 112.78 -178.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -63.25 -42.24 99.15 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.543 0.211 . . . . 10.0 110.659 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.39 -38.77 91.0 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.778 -0.823 . . . . 10.0 108.778 178.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 39.5 mt -67.93 -18.85 64.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.955 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 82.5 mttt -75.84 -47.49 25.35 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.934 -0.765 . . . . 10.0 108.934 178.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -69.97 -50.35 42.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.545 -0.752 . . . . 10.0 109.3 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -61.85 -47.77 83.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.008 -0.996 . . . . 10.0 109.796 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -64.23 -41.25 98.37 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.961 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -58.46 -41.16 95.18 Favored Glycine 0 N--CA 1.45 -0.38 0 N-CA-C 111.05 -0.82 . . . . 10.0 111.05 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -70.36 -39.98 74.3 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 68.7 mtt180 -60.94 -44.24 97.52 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.368 179.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 66.6 mt -65.67 -44.0 87.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.502 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.65 -48.9 79.72 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -66.17 -33.24 75.33 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.399 -0.819 . . . . 10.0 110.75 179.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -62.94 -45.3 93.1 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.453 -0.573 . . . . 10.0 109.453 179.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 -69.33 -38.5 78.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.485 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.63 94.96 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.108 0.48 . . . . 10.0 110.083 178.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 14.4 mtmm -81.12 -18.36 46.74 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.117 178.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -72.76 -42.29 64.16 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.259 -0.645 . . . . 10.0 109.259 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -62.39 -36.2 81.57 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.395 -0.595 . . . . 10.0 109.395 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -66.32 -34.57 78.29 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.941 -0.572 . . . . 10.0 109.465 178.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -69.1 -42.94 75.45 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.081 -1.081 . . . . 10.0 108.081 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 86.1 mt -65.15 -40.94 95.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.278 -0.873 . . . . 10.0 112.42 -179.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 1.7 p -61.74 -45.75 92.6 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.879 0.371 . . . . 10.0 110.844 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.4 p -70.97 -33.98 70.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.967 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 16.1 mt -66.35 -43.63 85.53 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.625 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 1.8 p -68.55 -28.87 67.35 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.101 0.477 . . . . 10.0 109.877 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -78.11 2.23 18.61 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-O 121.616 0.722 . . . . 10.0 110.034 178.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -117.81 -36.83 3.55 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.401 -0.963 . . . . 10.0 108.401 177.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -72.1 -13.06 61.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.613 -0.722 . . . . 10.0 111.688 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -111.91 -70.1 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.552 0 C-N-CA 120.834 -0.346 . . . . 10.0 111.117 178.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -60.04 -55.2 1.73 Allowed 'Trans proline' 0 C--N 1.355 0.868 0 C-N-CA 121.928 1.752 . . . . 10.0 112.302 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -64.95 -41.07 95.81 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.304 0.483 . . . . 10.0 112.304 -179.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 10.9 mt -66.01 -40.65 91.28 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.588 -0.445 . . . . 10.0 111.253 179.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -69.92 -32.34 70.59 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.886 -0.783 . . . . 10.0 108.886 178.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.78 -42.25 95.23 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.049 -1.093 . . . . 10.0 108.049 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 51.6 mt -66.33 -34.4 77.9 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.154 -0.93 . . . . 10.0 109.936 178.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -63.41 -44.87 93.4 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.05 -0.722 . . . . 10.0 109.05 178.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -73.03 -5.44 38.9 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.467 -0.788 . . . . 20.0 112.076 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -102.76 -41.15 2.36 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 109.748 -1.341 . . . . 10.0 109.748 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 89.1 mt -71.34 -37.99 71.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.463 -0.369 . . . . 10.0 111.439 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 58.5 mt -56.43 -59.64 11.49 Favored Pre-proline 0 CA--C 1.534 0.365 0 N-CA-C 112.212 0.449 . . . . 10.0 112.212 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -62.77 -35.37 68.88 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 121.84 1.693 . . . . 10.0 111.718 179.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.16 -33.71 64.8 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 C-N-CA 120.652 -0.419 . . . . 10.0 110.643 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.73 -36.2 81.91 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -67.72 -44.17 78.25 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.92 -0.582 . . . . 10.0 109.74 178.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 13.7 m -62.25 -40.85 97.55 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.058 -0.719 . . . . 10.0 109.058 178.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -65.4 -43.01 91.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.247 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -57.78 -50.1 74.38 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.598 -0.274 . . . . 10.0 110.91 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 81.7 t -59.07 -46.32 91.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.347 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 14.7 m -66.91 -40.67 87.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.914 -0.584 . . . . 10.0 111.682 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -68.44 -45.96 71.11 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.012 0.375 . . . . 10.0 112.012 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 37.4 mt -59.88 -43.29 94.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.034 0.445 . . . . 10.0 110.627 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 34.0 p -75.95 -16.2 60.04 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.502 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -87.0 -48.63 7.95 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.985 -0.376 . . . . 10.0 109.985 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 77.9 mt -59.9 -42.45 93.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.051 0.453 . . . . 10.0 109.834 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -64.75 -36.35 84.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.639 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -49.56 65.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.533 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -55.79 -50.03 71.57 Favored 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.743 0.652 . . . . 10.0 111.643 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 5.0 m -60.92 -32.73 72.22 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.589 -0.732 . . . . 10.0 111.089 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -77.4 -11.73 59.88 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-O 120.658 0.266 . . . . 10.0 111.209 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 21.5 mmtm -87.34 -38.54 16.13 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.789 -0.364 . . . . 10.0 110.669 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 8.7 mp -100.08 -107.17 0.22 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.058 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 . . . . . 0 N--CA 1.463 0.212 0 O-C-N 123.527 0.517 . . . . 10.0 111.753 -179.329 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 1.4 pt? . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 121.341 0.591 . . . . 10.0 110.425 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -104.78 15.15 28.41 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.443 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 58.7 mt -62.28 -39.82 94.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.495 -0.775 . . . . 10.0 111.664 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -62.33 -23.84 67.0 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.061 0.457 . . . . 10.0 111.073 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -79.01 -50.07 11.69 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.118 -0.697 . . . . 10.0 109.118 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -58.79 -44.72 90.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.243 -0.89 . . . . 10.0 110.394 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 25.9 m0 -64.76 -32.58 74.32 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.953 -0.567 . . . . 10.0 111.419 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -61.67 -50.27 73.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.452 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -37.51 87.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.21 0.528 . . . . 10.0 110.602 179.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 74.9 t -67.99 -41.86 84.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.964 178.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 81.9 m -62.71 -48.08 80.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.795 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 2.5 p -60.86 -46.2 91.55 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.683 0.278 . . . . 10.0 111.206 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 12.1 p -66.19 -39.01 89.36 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.906 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -66.24 -40.03 89.95 Favored 'General case' 0 CA--C 1.522 -0.106 0 CA-C-N 116.552 -0.295 . . . . 10.0 110.402 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 30.8 m -63.15 -48.22 79.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.438 . . . . 10.0 110.012 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -66.62 -29.11 69.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.681 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 53.0 tp -67.31 -46.38 73.71 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 61.2 mtt180 -62.59 -40.49 97.07 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.669 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -61.77 -48.6 79.93 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.778 -0.646 . . . . 10.0 109.813 178.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -60.18 -42.67 95.49 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.768 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 49.0 mt -57.48 -26.77 61.76 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.612 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -56.57 -78.09 0.14 Allowed Glycine 0 CA--C 1.52 0.377 0 C-N-CA 120.957 -0.64 . . . . 10.0 111.613 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -57.64 -33.4 96.6 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.901 2.401 . . . . 10.0 111.95 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 21.9 t -61.72 -49.15 85.49 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 CA-C-N 116.717 -0.22 . . . . 10.0 111.004 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 19.7 m -69.78 -34.7 74.11 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 110.075 -0.342 . . . . 10.0 110.075 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -61.92 -49.99 73.94 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.221 -0.659 . . . . 10.0 109.221 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -63.63 -40.79 97.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.703 -0.68 . . . . 10.0 109.212 178.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -58.27 -43.07 87.8 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.937 179.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 28.5 m0 -67.87 -36.48 80.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.865 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -70.53 -30.13 66.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.504 0.668 . . . . 10.0 109.429 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -73.46 -38.95 65.3 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.232 -1.025 . . . . 10.0 108.232 177.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 42.0 mt -68.31 -24.02 64.8 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 177.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -67.01 -47.94 69.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.118 -1.438 . . . . 10.0 107.118 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -65.65 -36.73 84.52 Favored 'General case' 0 C--N 1.333 -0.11 0 N-CA-C 108.576 -0.898 . . . . 10.0 108.576 178.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -59.47 -57.67 11.94 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.105 -0.952 . . . . 10.0 109.454 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 33.8 m -63.48 -42.93 98.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.59 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -63.15 -41.2 99.23 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.782 0.325 . . . . 10.0 110.457 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -66.54 -48.56 61.94 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 110.013 -1.235 . . . . 10.0 110.013 178.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 14.9 mt -59.82 -33.63 72.0 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 120.499 0.19 . . . . 10.0 110.527 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 27.7 mtt180 -62.62 -38.91 92.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.464 -0.335 . . . . 10.0 110.769 179.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -67.64 -40.19 84.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.341 0.591 . . . . 10.0 109.697 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -72.04 -50.08 31.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.301 -0.863 . . . . 10.0 110.91 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 92.1 mmm -63.49 -37.53 87.66 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.795 1.035 . . . . 10.0 113.795 -178.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 4.4 p -59.47 -45.65 91.04 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -70.46 -42.13 71.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.461 -0.79 . . . . 10.0 109.82 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -58.23 -48.17 81.22 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.739 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 78.2 mt -61.86 -50.11 73.54 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.678 0.251 . . . . 10.0 111.678 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -62.82 -42.94 99.93 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.822 0.344 . . . . 10.0 110.412 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -66.05 -43.13 88.4 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.31 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 2.8 p -66.76 -33.95 66.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 121.087 -0.245 . . . . 10.0 111.204 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -73.93 -43.58 57.85 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.996 0.426 . . . . 10.0 110.069 178.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -72.01 -11.8 60.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.915 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.09 -30.41 10.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.975 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 5.4 p -69.76 -29.9 42.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.746 0.308 . . . . 10.0 110.567 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -62.84 -59.6 12.1 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.198 178.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -63.58 -29.56 70.29 Favored 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 122.079 1.853 . . . . 10.0 110.952 178.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.3 -48.08 62.64 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.264 179.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 18.0 mt -64.77 -38.39 90.81 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 178.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -63.57 -50.24 70.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.903 -0.589 . . . . 10.0 109.816 178.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -62.07 -45.66 92.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.824 -0.626 . . . . 10.0 109.691 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -62.24 -41.24 98.25 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.841 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -64.09 -40.06 95.41 Favored 'General case' 0 C--O 1.225 -0.225 0 N-CA-C 109.562 -0.533 . . . . 10.0 109.562 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 43.0 mttp -61.08 -41.91 97.53 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 108.703 -0.851 . . . . 10.0 108.703 178.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 35.1 mttm -66.6 -42.05 87.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.358 -0.837 . . . . 10.0 109.906 178.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 13.8 m0 -64.2 -35.18 79.95 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.043 178.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -67.49 -46.06 74.05 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . 0.771 ' O ' ' CG ' ' C' ' 469' ' ' LEU . 42.2 mt-10 -60.24 -44.25 95.4 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 121.191 0.52 . . . . 10.0 109.901 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -71.61 -48.09 50.31 Favored 'General case' 0 C--O 1.217 -0.652 0 CA-C-N 115.486 -0.779 . . . . 10.0 112.402 -179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 11.3 mmt -60.17 -43.94 95.43 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.802 -0.359 . . . . 10.0 110.582 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -65.33 -46.53 79.89 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.793 -0.817 . . . . 10.0 108.793 178.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . 0.771 ' CG ' ' O ' ' C' ' 465' ' ' GLU . 96.2 mt -59.64 -46.3 89.42 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 115.39 -0.823 . . . . 20.0 111.499 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 19.3 m-30 -63.87 -44.14 93.99 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.99 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 19.5 ttm105 -65.23 -47.06 78.15 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.621 0.248 . . . . 10.0 111.219 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -65.01 -9.2 19.96 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.274 -0.421 . . . . 10.0 112.055 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -111.84 -43.67 3.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.648 -0.251 . . . . 10.0 111.188 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 42.4 t -64.95 -38.57 83.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.79 -0.186 . . . . 10.0 110.848 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -58.13 -59.7 12.47 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 120.879 -0.328 . . . . 10.0 111.311 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -65.32 -35.67 39.24 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 121.649 1.566 . . . . 10.0 111.384 178.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 10.2 mt -62.08 -41.95 98.7 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 109.82 -0.437 . . . . 10.0 109.82 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -63.16 -35.05 79.01 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -68.71 -51.33 42.74 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.767 -0.652 . . . . 10.0 109.298 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -62.93 -36.87 84.85 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.335 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 35.9 mt -66.09 -35.25 80.02 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -69.84 -36.71 75.8 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -63.57 -48.83 75.81 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 107.699 -1.223 . . . . 10.0 107.699 177.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -65.85 -33.37 85.6 Favored Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 114.999 -1.0 . . . . 10.0 111.319 178.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.63 -44.79 73.48 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 110.356 -0.239 . . . . 10.0 110.356 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -63.83 -39.57 94.53 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.125 -0.694 . . . . 10.0 109.125 178.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -65.33 -49.35 69.75 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.659 -0.867 . . . . 10.0 108.659 177.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -59.04 -38.99 80.62 Favored 'General case' 0 CA--C 1.522 -0.11 0 CA-C-N 115.943 -0.572 . . . . 10.0 110.613 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 39.3 mt -63.32 -44.23 95.54 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -69.61 -37.24 76.78 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.666 -0.494 . . . . 10.0 109.666 178.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -60.16 -43.84 95.48 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 177.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 58.2 mt -71.6 -37.56 70.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.569 179.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -61.6 -40.41 94.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.646 0.26 . . . . 10.0 110.305 179.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -75.66 9.59 2.19 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.081 -0.509 . . . . 10.0 111.009 178.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 56.8 mttp -123.2 -55.14 1.78 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.621 -0.718 . . . . 10.0 109.192 178.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 91.5 mt -61.23 -33.71 73.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.855 -0.612 . . . . 10.0 112.39 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 13.6 m -69.8 -61.04 3.25 Favored Pre-proline 0 CA--C 1.536 0.417 0 C-N-CA 120.734 -0.387 . . . . 10.0 111.668 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.17 -48.09 3.9 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 121.708 1.606 . . . . 10.0 111.801 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 12.4 mt -66.26 -34.01 77.03 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-N 116.908 -0.133 . . . . 10.0 110.983 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.87 -50.94 55.74 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.524 -0.846 . . . . 10.0 111.002 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -67.0 -34.28 77.4 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.931 0.396 . . . . 10.0 110.337 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -69.2 -46.66 66.88 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 58.4 mmm -61.22 -32.26 72.03 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -64.97 -44.5 89.17 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -68.15 -38.53 82.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.887 -0.597 . . . . 10.0 109.872 178.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -61.26 -45.28 95.18 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 107.963 -1.125 . . . . 10.0 107.963 177.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -62.25 -42.93 99.76 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.342 -0.844 . . . . 10.0 109.596 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -58.86 -49.44 77.74 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.596 -0.52 . . . . 10.0 109.596 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -61.41 -38.52 87.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.69 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -70.18 -51.41 31.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.778 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 66.7 t -65.29 -42.17 93.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.667 -179.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.62 -34.56 78.57 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.589 -0.523 . . . . 10.0 109.589 179.24 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -69.97 -39.82 75.75 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.548 -1.279 . . . . 10.0 107.548 177.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 81.9 mt -64.61 -28.67 69.78 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.901 -0.591 . . . . 10.0 109.899 178.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 28.8 mtt180 -62.37 -30.93 71.54 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.568 -0.53 . . . . 10.0 109.568 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.13 2.23 24.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.691 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 50.7 m170 -115.07 -16.4 11.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.505 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 93.2 mt -111.95 -55.0 2.56 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.652 -0.249 . . . . 10.0 111.448 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -50.71 -60.19 5.94 Favored Pre-proline 0 N--CA 1.468 0.465 0 N-CA-C 113.134 0.79 . . . . 10.0 113.134 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -66.5 -29.22 44.96 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.44 1.426 . . . . 10.0 110.98 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -66.19 -45.03 82.23 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.188 -0.46 . . . . 10.0 109.992 179.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 11.1 p -66.83 -29.22 69.1 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.882 -0.414 . . . . 10.0 109.882 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -70.76 -41.02 72.31 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 72.7 mt-10 -63.22 -39.54 94.91 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 107.704 -1.221 . . . . 10.0 107.704 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 32.9 mt -64.0 -36.25 83.35 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.151 -0.931 . . . . 10.0 109.426 177.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -60.59 -38.78 85.78 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -65.28 -45.37 84.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.24 0.543 . . . . 10.0 109.694 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -68.25 -41.31 81.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.443 -0.799 . . . . 10.0 110.121 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 53.3 mt -65.21 -35.08 79.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.204 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -61.36 -46.4 90.37 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.38 -39.39 89.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.821 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 4.4 ttm180 -60.79 -39.69 89.79 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 178.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 71.5 mt -72.05 -33.96 68.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.575 -0.738 . . . . 10.0 109.914 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -59.36 -43.91 92.76 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 178.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.61 -40.88 98.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.366 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 94.9 mt -69.66 -11.37 60.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.778 -0.646 . . . . 10.0 111.171 179.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -94.18 -51.87 4.63 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.924 -0.769 . . . . 10.0 108.924 178.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -59.28 -54.75 43.28 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.585 -0.734 . . . . 10.0 110.044 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -75.83 -23.97 55.81 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.725 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.22 -54.33 24.53 Favored Glycine 0 N--CA 1.449 -0.484 0 N-CA-C 111.176 -0.769 . . . . 10.0 111.176 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.7 -34.34 89.37 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 110.988 -0.845 . . . . 10.0 110.988 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -66.28 -53.21 39.4 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 55.2 mtt85 -59.57 -34.89 73.27 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.378 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 58.7 mt -63.27 -41.09 98.99 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.142 0.496 . . . . 10.0 109.775 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -72.83 -40.84 65.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.611 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -60.65 -50.49 73.29 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.816 -0.629 . . . . 10.0 109.544 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -58.92 -38.61 79.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.062 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.55 -43.17 94.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.155 179.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -66.15 -49.77 66.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.753 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.4 -36.64 80.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.851 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.06 -40.84 95.28 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 71.0 m -62.54 -49.17 76.39 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.944 -0.761 . . . . 10.0 108.944 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.49 -38.71 85.19 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.175 178.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -66.45 -38.37 87.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.278 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 75.2 mt -67.44 -35.69 79.73 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 178.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 16.9 m -70.01 -37.69 75.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.259 0.552 . . . . 10.0 109.796 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 3.1 p -78.55 -5.0 51.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.519 0.676 . . . . 10.0 110.156 179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 19.7 mt -98.88 -30.42 12.39 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.25 -0.886 . . . . 10.0 109.64 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.97 -30.33 69.59 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.027 0.441 . . . . 10.0 110.117 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -71.36 -5.76 34.96 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 121.505 0.669 . . . . 10.0 110.06 178.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -113.12 -35.17 5.46 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.516 -0.766 . . . . 10.0 109.175 177.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -65.65 -24.91 67.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.248 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -102.89 -73.14 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.463 0 CA-C-O 119.208 -0.425 . . . . 10.0 111.969 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -58.95 -51.38 6.96 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 122.444 2.096 . . . . 10.0 113.735 -178.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.13 -52.28 59.85 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.617 0.228 . . . . 10.0 111.617 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 16.5 mt -59.88 -40.73 89.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.864 -0.153 . . . . 10.0 111.4 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -63.06 -45.43 92.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.719 0.295 . . . . 10.0 110.709 178.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -66.67 -32.57 73.96 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.732 -0.387 . . . . 10.0 110.382 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 38.1 mt -63.2 -39.09 93.63 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 177.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -71.95 -36.92 70.02 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.154 -0.684 . . . . 10.0 109.154 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -64.01 -23.38 67.31 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.218 -0.901 . . . . 20.0 111.292 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -94.91 -33.0 6.84 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 109.317 -1.513 . . . . 10.0 109.317 178.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 13.9 mt -62.46 -41.0 98.45 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.938 0.347 . . . . 10.0 111.938 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 90.0 mt -58.26 -60.12 11.2 Favored Pre-proline 0 C--N 1.327 -0.389 0 C-N-CA 121.145 -0.222 . . . . 10.0 111.543 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -65.08 -31.42 54.99 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 122.052 1.835 . . . . 10.0 112.155 178.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -68.13 -36.51 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 C-N-CA 120.7 -0.4 . . . . 10.0 110.251 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 34.5 mt -71.26 -35.77 71.52 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 68.7 mt-10 -64.8 -50.35 67.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.125 178.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 2.7 p -64.6 -42.1 95.78 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.424 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -60.48 -42.05 95.49 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 66.3 mttt -65.38 -38.86 91.3 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-N 115.932 -0.577 . . . . 10.0 110.679 178.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 49.0 t -59.38 -49.56 83.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 N-CA-C 109.437 -0.579 . . . . 10.0 109.437 178.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 4.6 m -62.78 -40.12 96.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.876 178.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.59 -45.63 89.54 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.958 -0.565 . . . . 10.0 111.066 179.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 52.7 mt -59.97 -42.3 93.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.306 -0.407 . . . . 10.0 110.272 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 20.8 m -67.56 -46.91 71.35 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.01 -0.737 . . . . 10.0 109.01 178.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -55.9 -50.92 69.34 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.596 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 97.0 mt -55.41 -54.0 49.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.845 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -65.07 -50.08 67.55 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.941 0.348 . . . . 10.0 111.941 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -60.38 -37.44 80.78 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -71.18 -39.85 71.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.536 0.207 . . . . 10.0 111.069 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 83.8 m -59.52 -33.81 71.84 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.963 0.411 . . . . 10.0 110.401 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -63.93 -22.36 66.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.833 -0.621 . . . . 10.0 111.583 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.67 -24.62 14.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.896 0.379 . . . . 10.0 110.699 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 81.3 mt -75.95 -31.19 58.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.326 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 . . . . . 0 C--O 1.245 0.823 0 CA-C-O 118.566 -0.731 . . . . 10.0 110.495 179.823 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 17.6 mmt . . . . . 0 C--O 1.233 0.235 0 CA-C-O 121.162 0.506 . . . . 10.0 110.597 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 2.7 m -99.1 -55.83 2.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.666 -0.697 . . . . 10.0 111.085 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -81.39 144.51 31.38 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.292 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -128.93 109.48 11.28 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.661 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 40.8 mmtt -93.41 106.07 18.07 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.356 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 8.7 mt -102.6 108.4 19.66 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.733 -179.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 49.9 t -99.89 115.04 40.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.189 0.518 . . . . 10.0 110.61 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 39.3 t -87.73 112.35 23.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 17.6 m -108.95 160.16 7.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.826 0.346 . . . . 10.0 111.038 -179.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 158.35 171.86 24.76 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.596 -0.812 . . . . 10.0 111.938 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.41 -176.82 3.31 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.156 0.503 . . . . 10.0 112.13 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -92.51 111.41 4.06 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.005 -0.617 . . . . 10.0 112.489 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 124.08 -20.28 7.16 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.905 -0.664 . . . . 10.0 111.959 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 24.8 m -53.38 -51.67 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 112.658 0.614 . . . . 10.0 112.658 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.55 29.54 1.41 Allowed Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.461 -0.876 . . . . 10.0 113.944 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -58.73 -51.21 70.92 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.258 0.551 . . . . 10.0 110.715 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.09 -44.66 91.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.325 -0.852 . . . . 10.0 111.484 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.32 -46.22 89.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.35 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 46.4 mt -62.6 -39.15 92.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.837 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 18.6 m -67.8 -45.86 73.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.791 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 67.5 mt -65.48 -31.67 54.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.173 0.511 . . . . 10.0 110.087 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -69.58 -20.53 63.65 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.332 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 6.8 tp -92.16 -46.74 7.6 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.415 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 40.8 mm -75.73 -63.8 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 112.781 0.66 . . . . 10.0 112.781 -178.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -87.79 -15.86 35.73 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.025 0.38 . . . . 10.0 112.025 -178.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 64.6 t30 66.21 47.67 1.8 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.629 0.728 . . . . 10.0 110.046 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 51.6 t60 -143.14 134.62 26.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.458 -0.792 . . . . 10.0 110.388 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -93.35 133.65 36.38 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.381 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 6.1 m -98.19 137.45 25.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.095 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -94.26 -18.15 21.95 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.359 0.599 . . . . 10.0 110.467 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -93.2 175.88 6.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.692 -0.686 . . . . 10.0 111.684 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -94.95 133.99 38.1 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.872 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -101.31 95.81 5.35 Favored Pre-proline 0 C--O 1.235 0.298 0 N-CA-C 110.113 -0.328 . . . . 10.0 110.113 178.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -66.31 103.97 0.7 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.545 2.163 . . . . 10.0 108.509 179.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 87.8 m -120.32 141.12 50.32 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 114.117 1.154 . . . . 10.0 114.117 -176.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 5.0 mp -113.82 -28.58 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 N-CA-C 106.583 -1.636 . . . . 10.0 106.583 176.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -176.65 103.5 0.06 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 114.651 -1.159 . . . . 10.0 110.378 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 52.6 m-20 -114.35 139.03 49.8 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 4.0 m -116.01 131.0 57.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.91 0.385 . . . . 10.0 111.8 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -129.81 150.06 51.27 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.111 -0.7 . . . . 10.0 109.111 179.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 35.4 ttp180 -165.1 136.98 4.23 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.08 -0.248 . . . . 10.0 111.436 -178.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 7.4 tttm -150.58 162.9 39.75 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.376 -0.601 . . . . 10.0 109.376 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -103.09 118.15 36.16 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.886 -0.412 . . . . 10.0 109.886 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 9.1 m -139.36 166.99 20.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-O 121.056 0.455 . . . . 10.0 111.303 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 10.9 t -96.93 129.23 47.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 109.122 -0.696 . . . . 10.0 109.122 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 9.6 mt -113.29 94.38 3.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.752 0.311 . . . . 10.0 111.095 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 61.56 41.17 12.74 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.521 -0.763 . . . . 10.0 111.744 178.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.56 -33.19 6.04 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.532 -0.758 . . . . 10.0 112.284 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -91.87 111.67 23.29 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.778 0.323 . . . . 10.0 110.928 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 3.8 m -76.74 132.3 39.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.782 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 73.5 m -148.75 175.64 11.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.749 0.309 . . . . 10.0 111.368 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 22.3 tp -106.56 126.27 52.05 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.596 -0.52 . . . . 10.0 109.596 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 66.7 mt -105.76 126.82 52.61 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.5 0.556 . . . . 10.0 112.5 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -106.56 117.04 33.0 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.129 -1.063 . . . . 10.0 108.129 178.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 4.0 mp -113.5 143.53 23.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 120.598 0.237 . . . . 10.0 111.125 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 12.4 tp -128.1 122.71 32.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.895 0.378 . . . . 10.0 111.823 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -88.51 105.95 17.96 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 107.429 -1.323 . . . . 10.0 107.429 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 27.1 p -80.9 164.65 22.47 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.539 0.94 . . . . 10.0 113.539 -177.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -73.22 140.0 46.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.218 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.68 -9.78 60.95 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.607 -0.806 . . . . 10.0 112.413 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -141.13 79.21 1.68 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.198 0.523 . . . . 20.0 110.241 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -134.62 152.83 52.06 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.057 -179.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -103.42 -154.45 0.5 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.319 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -82.79 103.0 11.95 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.3 -0.56 . . . . 10.0 111.099 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -123.14 143.07 50.24 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.708 -0.678 . . . . 10.0 109.84 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.37 -30.98 71.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.949 0.404 . . . . 10.0 110.396 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 1.1 mmt -61.42 -45.95 92.15 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.561 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -64.21 -43.58 94.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.545 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.4 -19.2 63.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.761 -0.654 . . . . 10.0 111.357 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -97.03 -45.75 6.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.298 179.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . 0.282 0.6 OUTLIER -69.05 -25.44 64.47 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 113.124 0.787 . . . . 10.0 113.124 -179.077 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 34.0 mtp -93.72 2.25 56.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.237 0.541 . . . . 10.0 110.134 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -95.54 -25.86 16.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.731 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.44 -4.17 58.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.7 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -83.81 156.53 33.08 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.752 -0.737 . . . . 10.0 112.687 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -113.88 -46.49 3.02 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.188 0.518 . . . . 10.0 109.693 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -111.63 137.26 14.16 Favored Glycine 0 N--CA 1.444 -0.797 0 N-CA-C 110.161 -1.176 . . . . 10.0 110.161 179.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -122.02 124.11 43.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.26 0.552 . . . . 10.0 112.406 -178.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 70.2 mt -97.18 110.27 22.85 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.472 -0.785 . . . . 10.0 109.685 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 26.3 m -85.94 92.81 8.78 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 47.1 t -91.36 121.96 42.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.847 -0.615 . . . . 10.0 112.203 -178.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 29.7 p90 -128.33 158.95 36.8 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.419 -0.81 . . . . 10.0 109.066 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -100.13 126.05 46.33 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 110.088 -0.338 . . . . 10.0 110.088 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 32.0 pt -69.49 -9.98 12.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.394 0.616 . . . . 10.0 110.288 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -87.68 -11.83 47.18 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.095 -0.957 . . . . 10.0 110.353 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -133.08 106.86 7.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.028 -178.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.26 -31.67 70.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.698 -0.683 . . . . 10.0 112.357 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -61.42 -35.58 77.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.696 0.284 . . . . 10.0 110.493 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 15.6 m -66.5 -32.69 74.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.475 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -68.64 -39.08 80.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.55 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -76.67 -25.76 54.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.259 0.552 . . . . 10.0 110.621 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -68.63 -17.64 64.15 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.841 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.92 -39.53 72.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.742 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 67.0 t60 -67.5 -37.5 82.93 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.61 -0.515 . . . . 10.0 109.61 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -63.45 -36.09 82.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.577 -0.738 . . . . 10.0 110.022 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -80.01 -40.41 27.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.435 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 ttm180 -56.65 -45.25 81.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.558 -0.292 . . . . 10.0 111.177 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 63.1 mm-40 -64.35 -38.76 92.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.906 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -62.71 -42.49 99.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.0 -0.545 . . . . 10.0 109.718 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 57.9 mt -66.26 -47.47 84.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.757 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 49.6 mtpt -57.15 -41.38 79.02 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.86 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 55.4 ttp85 -68.45 -46.55 69.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.909 -0.587 . . . . 10.0 112.313 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 35.1 m -68.27 -30.78 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.177 0 N-CA-C 112.551 0.575 . . . . 10.0 112.551 -179.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -87.15 -9.34 55.51 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 121.152 -0.219 . . . . 10.0 111.14 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 5.9 t70 63.06 29.91 16.27 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 123.803 0.69 . . . . 10.0 111.25 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 53.1 m -163.48 145.08 9.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.486 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.29 -11.34 41.1 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.541 0.686 . . . . 10.0 109.271 178.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -91.24 72.63 6.22 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.794 -1.094 . . . . 10.0 109.532 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 58.6 t -123.09 133.43 24.51 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.361 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -63.0 107.89 0.69 Allowed 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.819 2.346 . . . . 10.0 111.555 179.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 54.4 mtt -127.0 153.15 46.29 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.118 -0.492 . . . . 10.0 109.91 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 92.6 t -134.11 132.57 55.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 109.307 -0.627 . . . . 10.0 109.307 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 20.1 tp -85.89 117.94 25.06 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 23.2 t -114.52 117.88 56.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.972 0.415 . . . . 10.0 111.496 -178.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -101.14 110.51 3.9 Favored Glycine 0 N--CA 1.45 -0.407 0 N-CA-C 110.517 -1.033 . . . . 10.0 110.517 178.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -97.75 166.38 11.51 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.031 0.382 . . . . 10.0 112.031 -178.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 36.8 mttm 72.55 35.05 1.17 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 123.702 0.801 . . . . 10.0 112.187 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 31.7 p -71.47 -13.36 61.79 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.064 0.394 . . . . 10.0 112.064 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -88.99 2.53 53.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.967 0.413 . . . . 10.0 111.172 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 38.0 mt -98.07 137.51 20.86 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.044 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -74.73 -14.14 21.9 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.768 2.312 . . . . 10.0 111.899 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.25 37.25 0.32 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.295 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -71.21 110.43 5.86 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.378 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.58 -18.22 14.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.063 179.136 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 40.4 t -105.68 113.9 43.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 115.658 -0.701 . . . . 10.0 109.543 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -76.39 152.43 36.28 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.662 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.5 -44.05 93.19 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.768 -0.651 . . . . 10.0 112.401 -179.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 8.4 tmtm? -61.25 -40.1 92.8 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.946 0.403 . . . . 10.0 110.908 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -63.45 -44.48 94.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.683 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.63 -44.93 80.68 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.236 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -62.35 -36.16 81.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.748 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.47 -47.87 80.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.778 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 18.9 tp -63.96 -41.84 97.45 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.501 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.69 -47.1 86.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.436 179.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -62.95 -34.96 78.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.977 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 14.7 m -66.55 -25.75 66.81 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.213 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 16.2 m-30 -99.69 -4.73 30.16 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.473 -0.331 . . . . 10.0 111.481 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 71.53 33.24 64.01 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 111.624 -0.59 . . . . 10.0 111.624 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 48.8 pt -123.54 147.71 53.69 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-O 120.574 0.226 . . . . 10.0 110.813 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -73.07 151.92 50.45 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.625 2.216 . . . . 10.0 111.714 179.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -114.2 127.16 55.77 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.766 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 34.4 mm -125.14 122.05 62.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.082 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -90.89 124.37 35.13 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.595 -0.891 . . . . 10.0 108.595 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 44.6 p -130.34 172.66 11.6 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 122.105 0.955 . . . . 10.0 113.373 -177.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 6.0 t -160.99 117.08 2.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.045 -1.434 . . . . 10.0 107.341 178.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.57 -17.87 62.91 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.769 0.319 . . . . 10.0 111.244 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 70.5 tttt -84.0 -44.61 13.98 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.209 0.448 . . . . 10.0 112.209 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 36.6 p -93.8 -13.69 27.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.735 0.302 . . . . 10.0 111.317 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 18.6 ttt-85 67.49 44.98 1.64 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.078 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -85.33 103.24 14.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.486 -0.779 . . . . 10.0 111.592 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 58.9 37.23 90.62 Favored Glycine 0 CA--C 1.519 0.285 0 CA-C-N 115.889 -0.596 . . . . 10.0 114.306 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 70.4 t -66.25 -54.52 25.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.911 0.386 . . . . 10.0 110.711 -179.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.45 -32.38 71.28 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -58.17 -42.62 86.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.85 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.89 -48.19 82.29 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.966 0.412 . . . . 10.0 110.64 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -65.17 -43.15 92.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.808 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 16.0 m-30 -60.71 -41.89 96.15 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.419 179.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 32.8 m -58.93 -38.16 78.34 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.501 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 24.2 tp -62.4 -46.11 90.08 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.047 179.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 43.2 t -64.04 -39.35 85.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.987 -0.552 . . . . 10.0 109.571 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -63.53 -29.96 71.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.705 -0.679 . . . . 10.0 110.683 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -77.97 -43.72 28.84 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.208 178.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 93.2 mt -60.17 -45.32 96.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.475 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -59.48 -48.12 82.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.356 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -66.39 -36.13 82.07 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.966 0.412 . . . . 10.0 110.821 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -63.04 -44.19 96.58 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.524 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -71.77 -39.41 69.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.604 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -57.55 -40.75 79.58 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.259 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -59.93 -36.04 76.21 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.936 -0.574 . . . . 10.0 112.165 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 25.3 mmt -90.44 -22.96 21.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.87 0.367 . . . . 10.0 111.556 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 31.4 t -79.37 -39.04 33.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.968 -179.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -95.24 3.99 53.98 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.732 -179.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 27.8 t70 70.26 -56.05 0.6 Allowed 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.497 -0.774 . . . . 10.0 112.977 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 96.66 -75.68 0.72 Allowed Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 121.217 -0.515 . . . . 10.0 111.976 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 60.7 mmtt -114.15 100.5 8.42 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.981 -0.377 . . . . 10.0 109.981 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.68 130.3 42.44 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.646 -179.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -60.5 116.64 4.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.564 -0.744 . . . . 10.0 110.468 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -130.34 -30.48 1.92 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.253 -0.43 . . . . 10.0 111.347 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 95.7 mttt 70.0 121.99 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.43 0 O-C-N 123.684 0.615 . . . . 10.0 112.454 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 11.3 tptp -139.26 127.07 22.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.97 -179.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 23.3 m 70.41 155.36 0.14 Allowed 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 113.131 0.789 . . . . 10.0 113.131 179.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -153.12 -67.02 0.15 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.177 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 2.1 m -103.58 131.61 50.56 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.962 -0.563 . . . . 10.0 109.511 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 81.9 tttt 64.13 87.02 0.12 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.448 0.642 . . . . 10.0 111.186 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 4.9 t . . . . . 0 C--N 1.323 -0.557 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.903 -179.558 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.285 0 N-CA-C 111.503 -0.639 . . . . 10.0 111.503 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.01 136.73 52.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.737 0.303 . . . . 10.0 111.404 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 20.9 t -122.57 142.07 40.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.977 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -93.92 125.78 38.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.033 0.444 . . . . 10.0 111.641 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 59.4 t -99.47 118.22 45.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.082 -0.71 . . . . 10.0 109.082 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -91.84 113.79 26.16 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.173 0.511 . . . . 10.0 111.185 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 23.6 mt -81.04 150.39 68.46 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.329 -0.851 . . . . 10.0 110.94 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.24 -7.41 15.6 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.178 2.585 . . . . 10.0 113.295 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -90.28 17.22 7.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.986 0.422 . . . . 10.0 110.618 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 817' ' ' LYS . . . . . 0.401 ' NZ ' ' O1P' ' A' ' 28' ' ' PCW . 53.8 tttt 66.23 45.03 2.38 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 115.429 -0.805 . . . . 10.0 111.72 179.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -146.33 175.48 10.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.608 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.33 167.76 23.51 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.894 0.702 . . . . 10.0 112.894 -178.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 2.6 t -147.63 145.26 28.9 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.101 -0.954 . . . . 10.0 108.833 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 21.9 t -101.1 115.25 42.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.963 0.411 . . . . 10.0 111.328 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 24.1 t -110.66 141.54 25.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.449 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 1.2 m -80.84 128.13 33.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 42.5 t -66.28 127.86 28.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.735 0.302 . . . . 10.0 110.477 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -118.91 127.4 53.45 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.983 0.42 . . . . 10.0 110.881 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -77.05 74.6 3.63 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.675 -0.693 . . . . 10.0 112.349 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 165.41 -40.18 0.28 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.506 -0.854 . . . . 10.0 112.769 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 10.5 ptm -75.22 154.85 37.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.041 0.448 . . . . 10.0 111.738 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.81 169.4 9.49 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.164 -179.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 87.6 t -57.95 -42.92 83.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.515 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -56.03 -34.72 66.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.828 -0.624 . . . . 10.0 111.321 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -77.27 -49.39 15.16 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.306 -0.406 . . . . 10.0 111.133 -179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 3.4 m -63.39 -40.79 98.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.396 -0.366 . . . . 10.0 111.626 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -71.58 -24.11 61.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.536 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -63.8 -32.55 74.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.037 0.446 . . . . 10.0 110.274 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 14.0 tttm -72.47 -6.42 43.62 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.552 -0.749 . . . . 10.0 111.282 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -117.73 -46.77 2.64 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.967 0.413 . . . . 10.0 111.49 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 74.8 mt -65.73 -43.92 87.56 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.819 0.674 . . . . 10.0 112.819 -179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -67.75 -21.24 65.28 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.131 0.419 . . . . 10.0 112.131 -179.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 50.5 t -75.54 -23.67 16.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.042 0.449 . . . . 10.0 110.583 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 5.6 mtt-85 -106.55 -6.9 17.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.628 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 85.1 40.22 8.11 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.786 -0.721 . . . . 10.0 112.633 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 76.1 mt -114.68 129.04 56.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.791 0.329 . . . . 10.0 110.65 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -90.53 134.61 34.25 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.052 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 14.7 mp0 -57.61 -34.25 69.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.965 -0.562 . . . . 10.0 112.096 -179.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -72.01 -5.6 36.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.137 0.494 . . . . 10.0 111.565 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 3.6 m -126.04 25.43 6.75 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.081 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 64.3 m -145.31 165.22 29.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.01 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 11.4 p -143.66 145.86 21.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.886 -0.412 . . . . 10.0 109.886 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 60.2 t -114.43 135.75 53.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.9 0.381 . . . . 10.0 110.944 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -118.69 141.35 48.69 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.194 179.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 34.3 mtm180 -94.08 121.9 36.04 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.136 -0.69 . . . . 10.0 109.136 178.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -84.19 113.67 21.25 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.113 -179.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 15.9 mt -111.07 72.96 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.685 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 96.1 mttt 66.43 9.09 6.22 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.998 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 147.28 -42.44 0.9 Allowed Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 121.109 -0.567 . . . . 10.0 111.848 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 7.3 mmt180 -69.74 139.94 53.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.737 0.303 . . . . 10.0 111.27 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 858' ' ' LYS . . . . . 0.407 ' NZ ' ' O2P' ' A' ' 6' ' ' PCW . 52.9 mtmt -108.86 120.75 43.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.366 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 6.9 m -115.31 132.0 56.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.864 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 11.5 t -65.73 137.78 24.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.646 -0.252 . . . . 10.0 111.052 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -124.5 149.3 47.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.528 -0.306 . . . . 10.0 110.268 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -92.74 163.99 13.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.83 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -80.35 -34.44 36.52 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.237 -179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -72.36 -10.66 60.07 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.677 0.621 . . . . 10.0 112.677 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 2.7 m -68.01 148.61 50.79 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 110.032 -0.358 . . . . 10.0 110.032 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -80.22 152.46 29.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.506 0.193 . . . . 10.0 110.7 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 6.0 tp -89.76 -4.92 10.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.241 0.543 . . . . 10.0 110.871 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -56.99 -50.99 85.03 Favored Pre-proline 0 CA--C 1.539 0.543 0 N-CA-C 113.342 0.867 . . . . 10.0 113.342 -179.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -76.61 6.02 4.37 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 121.912 1.741 . . . . 10.0 113.171 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -90.75 47.03 1.37 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.218 0.532 . . . . 10.0 111.151 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -93.33 108.35 20.02 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.464 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 90.83 -0.23 76.17 Favored Glycine 0 CA--C 1.517 0.193 0 C-N-CA 121.069 -0.586 . . . . 10.0 113.617 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -98.73 134.88 41.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.861 0.331 . . . . 10.0 111.286 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -83.85 139.92 32.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 10.0 109.937 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 96.1 mt -114.13 118.2 33.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.109 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 1.3 pt -111.69 120.36 61.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.385 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 6.1 t -97.64 142.8 13.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.333 -178.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 878' ' ' GLU . . . . . 0.409 ' OE2' ' P ' ' A' ' 6' ' ' PCW . 9.8 mm-40 -125.26 160.04 30.22 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.547 178.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 80.8 t -93.79 132.46 37.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 116.258 -0.428 . . . . 10.0 109.999 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 44.6 mt . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.377 -0.82 . . . . 10.0 109.589 179.158 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PCW . . . . . 0.409 ' P ' ' OE2' ' D' ' 878' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PCW . . . . . 0.401 ' O1P' ' NZ ' ' D' ' 817' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 201' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 90.3 mt . . . . . 0 N--CA 1.457 -0.102 0 CA-C-O 120.982 0.42 . . . . 10.0 110.69 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -63.35 -34.26 77.32 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.562 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 88.1 mt -67.73 -37.79 82.66 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.324 179.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 66.9 mt -69.86 -40.79 75.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.786 -0.643 . . . . 10.0 111.376 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -63.12 -44.44 95.61 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.296 0.57 . . . . 10.0 109.764 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -64.65 -42.97 95.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.674 178.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -58.26 -41.81 85.1 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.43 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -61.92 -36.33 81.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.998 0.428 . . . . 10.0 110.8 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 41.6 m -72.0 -22.59 61.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.399 179.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 77.0 t -80.45 -39.46 18.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 7.5 m -61.49 -44.1 97.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.133 179.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.38 -43.41 94.56 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.013 -0.54 . . . . 10.0 111.443 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.3 -44.33 91.95 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.753 0.311 . . . . 10.0 110.283 179.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -62.7 -35.2 78.96 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.909 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 9.9 m -72.65 -44.26 62.09 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.526 -0.306 . . . . 10.0 110.542 178.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -61.38 -43.8 98.25 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.724 -0.472 . . . . 10.0 109.724 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 67.8 mt -62.44 -40.74 97.56 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.619 -0.718 . . . . 10.0 110.284 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 52.0 mtm180 -66.31 -41.26 89.98 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.322 179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -64.35 -36.69 84.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.092 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.05 -33.99 61.8 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.653 178.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 18.3 mt -60.64 -26.17 66.85 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.645 179.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -56.71 -71.68 0.7 Allowed Glycine 0 N--CA 1.452 -0.285 0 N-CA-C 110.595 -1.002 . . . . 10.0 110.595 178.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -58.8 -30.42 92.68 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.392 2.061 . . . . 10.0 111.092 177.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 5.0 t -61.56 -51.71 69.65 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.065 0 CA-C-N 116.882 -0.145 . . . . 10.0 110.791 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 12.6 p -67.22 -34.3 77.18 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.141 -0.318 . . . . 10.0 110.141 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -64.96 -48.47 73.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.327 178.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -64.6 -39.58 93.98 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -63.87 -48.4 76.83 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.077 178.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -59.59 -42.26 92.15 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.319 179.141 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -63.66 -48.88 75.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.539 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -64.22 -46.88 81.92 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.406 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 57.3 mt -61.0 -40.2 92.64 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.605 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -63.53 -44.27 94.72 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 109.685 -0.487 . . . . 10.0 109.685 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -64.43 -36.49 84.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.493 -0.321 . . . . 10.0 110.517 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -68.56 -45.44 72.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.543 178.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 4.3 p -68.6 -31.07 69.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.161 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -59.92 -47.4 85.91 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 108.323 -0.992 . . . . 10.0 108.323 177.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -68.99 -43.86 70.65 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 110.263 -1.135 . . . . 10.0 110.263 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 20.8 mt -57.02 -42.57 80.63 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 115.735 -0.233 . . . . 10.0 110.845 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -70.69 -39.9 73.23 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.962 -0.384 . . . . 10.0 109.962 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -59.6 -40.8 88.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.623 179.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -81.67 -30.83 32.54 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.327 -0.851 . . . . 10.0 110.236 179.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 49.7 ttm -64.6 -44.87 89.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.489 -0.323 . . . . 10.0 110.868 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 13.1 p -62.87 -45.27 93.33 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.863 -0.792 . . . . 10.0 108.863 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 15.1 mttm -60.43 -55.19 36.52 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.487 -0.779 . . . . 10.0 109.881 178.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -56.43 -45.96 80.51 Favored 'General case' 0 C--O 1.225 -0.222 0 O-C-N 123.652 0.595 . . . . 10.0 110.753 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 24.2 mt -60.35 -45.34 93.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.766 -0.197 . . . . 10.0 111.029 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 71.1 mt-10 -66.16 -41.8 89.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.63 0.252 . . . . 10.0 110.433 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 -64.39 -43.76 93.44 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.67 -0.493 . . . . 10.0 109.67 178.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 35.5 t -65.31 -44.16 94.9 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.641 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.256 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -62.49 -48.21 80.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.041 0.448 . . . . 10.0 111.062 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.58 -41.87 98.33 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.178 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -77.18 -28.26 53.95 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 111.676 0.25 . . . . 10.0 111.676 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -71.43 -20.14 20.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 C-N-CA 121.186 -0.206 . . . . 10.0 110.73 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -59.36 -61.07 8.59 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.505 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -65.23 -28.62 55.72 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.515 1.477 . . . . 10.0 111.059 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 7.9 m-30 -64.04 -58.25 7.25 Favored 'General case' 0 C--O 1.231 0.091 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 80.8 mt -65.45 -37.51 87.11 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.731 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -62.47 -44.89 95.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.917 0.389 . . . . 10.0 110.192 179.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -64.3 -52.21 59.63 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.077 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -62.02 -29.05 70.02 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.81 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -66.44 -49.13 67.74 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 23.9 mtmt -63.05 -44.94 94.48 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.824 -0.626 . . . . 10.0 109.336 178.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -58.26 -50.16 74.57 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.604 -0.726 . . . . 10.0 109.724 178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -39.35 90.44 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.618 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -60.8 -47.62 85.49 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -63.88 -42.07 97.58 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -58.99 -49.2 78.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.393 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 99.7 mmm -67.23 -40.08 86.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.464 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -60.7 -49.68 76.55 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 110.003 -0.369 . . . . 10.0 110.003 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 66.1 mt -64.84 -35.49 81.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.844 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.73 -42.52 95.17 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.206 178.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 15.1 mtt85 -74.25 -38.66 63.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.84 0.352 . . . . 10.0 110.788 179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -65.83 -26.23 67.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.367 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -95.2 -37.51 11.01 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.862 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 2.2 p -62.22 -24.86 36.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 C-N-CA 121.31 -0.156 . . . . 10.0 111.355 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -62.93 -62.47 5.6 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 178.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -63.86 -31.54 67.54 Favored 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 121.694 1.596 . . . . 10.0 111.068 177.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 40.8 mt -65.09 -37.05 86.25 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 18.9 mtt180 -67.81 -34.88 77.61 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 178.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -67.74 -40.39 84.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.346 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -61.43 -47.93 83.47 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 108.89 -0.781 . . . . 10.0 108.89 178.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 48.6 mt -65.1 -38.71 91.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.335 -0.848 . . . . 10.0 110.537 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -66.57 -59.44 3.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.327 -0.397 . . . . 10.0 111.099 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -61.49 -37.85 85.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.048 0.451 . . . . 10.0 110.223 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -64.59 -49.0 66.98 Favored Glycine 0 N--CA 1.441 -0.996 0 N-CA-C 110.755 -0.938 . . . . 10.0 110.755 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.33 -35.11 79.81 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 110.249 -0.278 . . . . 10.0 110.249 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -57.37 -45.7 84.14 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.794 -0.447 . . . . 10.0 109.794 178.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -71.04 -49.04 49.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.09 178.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -55.4 -43.2 75.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.724 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 64.0 mt -74.0 -39.28 63.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.891 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -60.99 -47.87 84.45 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 120.936 0.398 . . . . 10.0 109.936 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.87 -39.32 94.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.623 -0.717 . . . . 10.0 109.959 179.07 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 26.7 mt -67.37 -42.77 82.89 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.751 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -64.54 -43.73 93.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.763 0.316 . . . . 10.0 110.48 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.7 -3.94 21.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.257 0.551 . . . . 10.0 110.702 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -108.08 -34.67 6.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.484 -0.78 . . . . 10.0 109.125 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 57.7 mt -64.3 -31.34 72.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.22 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 2.6 m -68.27 -62.41 3.14 Favored Pre-proline 0 CA--C 1.54 0.564 0 CA-C-N 116.602 -0.272 . . . . 10.0 111.431 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -65.04 -50.98 1.79 Allowed 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 121.853 1.702 . . . . 10.0 112.229 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 92.0 mt -65.85 -25.55 67.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.767 0.318 . . . . 10.0 110.87 -179.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -76.74 -48.55 8.69 Favored Glycine 0 N--CA 1.443 -0.848 0 N-CA-C 110.49 -1.044 . . . . 10.0 110.49 178.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -64.06 -42.3 97.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.394 0.14 . . . . 10.0 110.776 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -64.09 -35.59 81.26 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.977 0.418 . . . . 10.0 110.158 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 27.0 ttt -68.11 -39.41 82.81 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 66.4 mtt180 -67.32 -36.74 82.08 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 178.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -65.05 -44.44 89.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.841 -0.618 . . . . 10.0 109.391 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -66.28 -37.92 86.58 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 177.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -62.85 -35.02 78.59 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 115.488 -0.778 . . . . 10.0 109.649 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 77.9 mtt180 -59.85 -45.64 91.79 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.771 -0.826 . . . . 10.0 108.771 178.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -69.59 -42.45 74.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.853 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -54.39 -53.23 56.78 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.826 -0.624 . . . . 10.0 109.723 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 95.6 t -70.37 -41.7 78.48 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.36 0 CA-C-N 115.389 -0.823 . . . . 10.0 111.538 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -58.61 -53.89 53.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.625 0.25 . . . . 10.0 111.17 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -60.32 -33.83 72.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.265 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 8.9 mt -72.89 -40.71 65.34 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.928 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.7 ttm105 -62.7 -51.55 66.75 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.548 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 3.6 m -67.15 -13.4 61.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.237 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -96.15 -43.63 7.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.85 0.357 . . . . 10.0 110.127 178.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 57.6 mt -64.63 -33.56 76.21 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.21 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -54.52 -60.96 6.39 Favored Pre-proline 0 CA--C 1.534 0.328 0 O-C-N 123.149 0.281 . . . . 10.0 111.352 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -68.62 -34.84 18.4 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 121.599 1.532 . . . . 10.0 110.69 178.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -57.31 -50.05 74.17 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.227 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 8.4 p -64.69 -36.71 85.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.529 -0.305 . . . . 10.0 110.801 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.89 -39.96 79.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.139 0.495 . . . . 10.0 109.977 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -67.27 -34.4 77.35 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.032 -0.729 . . . . 10.0 109.032 177.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 63.8 mt -68.09 -33.02 73.75 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 108.708 -0.849 . . . . 10.0 108.708 177.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 84.7 mtt180 -67.4 -39.31 85.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.167 -1.049 . . . . 10.0 108.167 177.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -61.04 -42.15 97.93 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.895 -1.15 . . . . 10.0 107.895 177.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 -63.07 -53.95 45.66 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.391 -0.822 . . . . 10.0 109.08 178.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 98.3 mt -53.3 -42.74 66.94 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.851 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -60.69 -45.32 94.64 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.239 -0.437 . . . . 10.0 109.949 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -68.99 -46.58 67.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.37 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 4.3 mmt85 -60.92 -52.73 63.8 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.505 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 83.9 mt -63.15 -34.92 78.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.993 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.82 -44.32 90.23 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.221 -0.659 . . . . 10.0 109.221 178.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.12 -39.78 94.77 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.401 -0.963 . . . . 10.0 108.401 178.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 70.2 mt -66.68 -22.55 66.08 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.971 178.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -75.38 -48.13 24.37 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.017 -0.734 . . . . 10.0 109.017 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -68.93 -47.75 64.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.637 -0.71 . . . . 10.0 109.829 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -65.85 -49.76 67.0 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.627 179.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.85 -37.76 94.86 Favored Glycine 0 C--N 1.33 0.227 0 CA-C-N 115.929 -0.578 . . . . 10.0 112.445 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.38 -46.21 94.75 Favored Glycine 0 N--CA 1.449 -0.457 0 N-CA-C 110.829 -0.908 . . . . 10.0 110.829 178.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -70.3 -37.33 74.76 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 19.0 mtt180 -57.46 -58.72 7.05 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.269 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 92.7 mt -58.3 -39.82 80.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.565 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -64.9 -49.21 71.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.768 0.318 . . . . 10.0 110.323 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -64.94 -43.73 91.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.182 -0.463 . . . . 10.0 111.209 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 22.7 m-30 -63.53 -39.69 95.09 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.922 -0.399 . . . . 10.0 109.922 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -64.92 -44.17 90.42 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.705 178.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -59.25 -44.73 92.38 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.256 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 16.4 mtmm -68.33 -27.14 66.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.525 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.23 -43.48 73.95 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 178.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.47 -45.19 94.62 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -63.36 -38.46 91.25 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.888 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -66.91 -35.61 80.39 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.142 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 78.4 mt -71.21 -39.87 71.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.192 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 68.7 m -62.78 -44.55 95.89 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 178.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 4.4 p -76.16 -16.57 59.84 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.417 179.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.18 -35.41 59.15 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 107.488 -1.301 . . . . 10.0 107.488 177.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 29.1 m -67.71 -25.32 65.6 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -72.36 -2.4 19.12 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.21 -0.904 . . . . 10.0 109.923 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 31.2 mttp -123.16 -42.31 2.27 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -63.28 -22.25 66.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.535 -0.757 . . . . 10.0 111.429 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -102.12 -67.91 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.454 0 C-N-CA 120.819 -0.352 . . . . 10.0 111.544 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -65.52 -55.36 0.45 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 122.268 1.979 . . . . 10.0 113.316 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -60.89 -38.85 87.11 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.285 0.476 . . . . 10.0 112.285 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 3.0 mt -67.03 -42.25 85.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.776 0.322 . . . . 10.0 110.478 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . 0.654 ' O ' ' CG ' ' A' ' 373' ' ' GLN . 2.7 mt-10 -69.19 -29.85 67.92 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.746 -0.464 . . . . 10.0 109.746 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -69.98 -44.42 69.47 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 178.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.72 -46.85 88.8 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.385 -0.825 . . . . 10.0 109.634 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 52.5 mtt85 -65.62 -36.69 84.44 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.654 ' CG ' ' O ' ' A' ' 369' ' ' GLU . 98.7 mt-30 -63.08 -30.52 71.66 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.546 -0.752 . . . . 20.0 111.297 179.237 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -86.44 -36.09 9.99 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 109.149 -1.58 . . . . 10.0 109.149 178.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 17.6 mt -58.09 -40.31 80.82 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.011 0.374 . . . . 10.0 112.011 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 83.4 mt -55.4 -62.92 3.63 Favored Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 112.069 0.396 . . . . 10.0 112.069 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -63.19 -32.49 73.98 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 121.969 1.78 . . . . 10.0 111.564 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 6.5 t -63.45 -44.79 99.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 N-CA-C 109.916 -0.401 . . . . 10.0 109.916 178.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 33.7 mt -60.92 -35.63 77.19 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.438 -0.578 . . . . 10.0 109.438 178.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -62.86 -52.03 64.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.874 178.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.2 -38.11 85.38 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.611 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -67.97 -43.12 79.73 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.707 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -62.0 -48.42 80.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.486 -0.325 . . . . 10.0 110.538 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 75.8 t -57.51 -42.77 81.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.467 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 5.3 p -74.82 -55.03 6.24 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.174 0.435 . . . . 10.0 112.174 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -60.53 -44.53 95.97 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.311 0.856 . . . . 10.0 113.311 -178.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 56.8 mt -61.29 -41.98 97.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.689 0.281 . . . . 10.0 111.335 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 93.5 p -79.12 -26.12 42.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.329 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -65.92 -39.99 91.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 95.4 mt -61.85 -35.14 77.4 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.945 -0.571 . . . . 10.0 109.953 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -68.1 -42.4 80.37 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.55 -0.907 . . . . 10.0 108.55 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.7 -40.37 94.78 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.545 -0.752 . . . . 10.0 111.085 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -63.63 -51.82 63.54 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.493 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 4.8 m -58.63 -30.58 67.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.725 -0.671 . . . . 10.0 111.452 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -58.66 -37.47 76.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.601 -0.272 . . . . 10.0 111.684 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -90.13 -24.05 21.19 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.071 0.397 . . . . 10.0 112.071 -179.328 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 93.7 mt -71.74 -74.47 0.15 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.814 0.34 . . . . 10.0 110.915 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 . . . . . 0 C--N 1.326 -0.44 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.392 -179.447 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 6.6 tt . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.819 0.342 . . . . 10.0 110.147 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 62.2 mttt -75.09 -43.71 51.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.649 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 55.9 mt -62.34 -28.16 69.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.185 0.517 . . . . 10.0 111.515 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.12 -37.99 84.83 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.011 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.87 -38.83 61.82 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.387 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -57.56 -41.63 81.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.318 -0.856 . . . . 10.0 109.013 178.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -64.67 -33.99 77.23 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 115.415 -0.811 . . . . 10.0 111.847 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.68 -50.06 75.3 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.893 0.378 . . . . 10.0 110.21 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 1.2 m -63.79 -34.79 78.7 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.579 -0.526 . . . . 10.0 109.579 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 50.6 t -64.82 -41.38 92.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.003 178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 2.8 m -61.05 -46.55 90.23 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 42.3 m -60.55 -38.33 84.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.86 178.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 91.5 m -63.15 -44.99 93.99 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.093 -0.503 . . . . 10.0 109.889 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -64.72 -41.41 96.0 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.389 178.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 15.0 m -62.84 -44.34 96.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.019 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -66.88 -26.72 67.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.231 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 30.5 mt -70.86 -38.05 73.12 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 178.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 86.9 mtt180 -66.96 -40.11 87.41 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 108.751 -0.833 . . . . 10.0 108.751 178.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -65.16 -23.52 67.14 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 115.421 -0.809 . . . . 10.0 110.379 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -82.57 -48.25 11.2 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.57 -0.9 . . . . 10.0 108.57 177.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 84.6 mt -52.88 -35.05 57.33 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.203 -0.908 . . . . 10.0 112.151 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.94 -77.67 0.13 Allowed Glycine 0 CA--C 1.52 0.352 0 N-CA-C 111.84 -0.504 . . . . 10.0 111.84 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -56.94 -32.6 93.16 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.807 2.338 . . . . 10.0 111.742 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 5.6 t -60.0 -50.21 81.02 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.226 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.925 179.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 21.4 p -70.78 -36.43 73.04 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.499 0.19 . . . . 10.0 110.901 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -57.82 -48.78 78.74 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.566 -0.531 . . . . 10.0 109.566 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -76.33 -29.73 57.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.669 -0.696 . . . . 10.0 110.543 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -66.3 -46.99 75.05 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.824 0.345 . . . . 10.0 110.14 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 47.3 m0 -64.86 -37.5 87.82 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.39 -34.19 75.6 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.574 178.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -68.95 -39.35 79.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.761 -1.2 . . . . 10.0 107.761 177.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 69.1 mt -66.33 -25.9 67.05 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.251 -0.886 . . . . 10.0 110.287 178.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -63.0 -53.33 55.61 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.874 -0.787 . . . . 10.0 108.874 178.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -66.87 -31.52 72.17 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.0 -53.81 44.16 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.56 -0.745 . . . . 10.0 110.614 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 9.5 p -69.87 -40.27 75.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.855 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -67.0 -44.54 80.1 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.639 0.257 . . . . 10.0 110.726 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -61.8 -48.6 82.93 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 110.117 -1.193 . . . . 10.0 110.117 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 16.9 mt -61.16 -34.51 75.15 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 110.017 -0.364 . . . . 10.0 110.017 178.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 20.9 mtt85 -65.97 -43.28 88.31 Favored 'General case' 0 C--O 1.22 -0.454 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 178.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -62.92 -33.82 76.13 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-O 121.328 0.585 . . . . 10.0 109.678 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -74.43 -59.6 2.65 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.09 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 75.1 mtm -62.36 -27.9 69.39 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 114.538 1.31 . . . . 10.0 114.538 -177.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 25.4 p -57.52 -59.07 5.72 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.259 0.552 . . . . 10.0 110.144 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 21.6 pttt -74.04 -31.27 62.82 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.334 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.38 -43.28 99.13 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.286 -0.415 . . . . 10.0 110.577 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 81.2 mt -76.46 -42.23 44.5 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.418 -0.355 . . . . 10.0 111.311 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -62.62 -40.6 97.47 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.095 0.474 . . . . 10.0 110.055 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.11 -30.43 62.32 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.961 -0.755 . . . . 10.0 108.961 178.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 1.2 t -57.83 -43.89 85.16 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 CA-C-N 116.068 -0.514 . . . . 10.0 109.819 178.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -67.35 -40.51 85.85 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -69.69 -10.19 57.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.099 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.62 -39.72 6.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.15 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 50.4 t -70.13 -36.4 67.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.797 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -55.08 -61.5 5.8 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 116.778 -0.192 . . . . 10.0 111.429 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.51 -26.37 40.42 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 121.823 1.682 . . . . 10.0 111.502 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.33 -47.93 62.93 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.796 -0.446 . . . . 10.0 109.796 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 17.5 mt -67.42 -32.22 72.96 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.29 -0.633 . . . . 10.0 109.29 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -67.11 -47.88 69.82 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.114 -0.699 . . . . 10.0 109.114 178.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -66.81 -41.11 88.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.962 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -64.9 -40.09 94.54 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.931 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -62.94 -43.51 98.6 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 27.5 mtmt -63.13 -46.39 87.47 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 15.5 mtmm -64.65 -36.97 85.98 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.221 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 36.1 t90 -66.33 -37.23 84.87 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.899 -0.778 . . . . 10.0 108.899 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -64.68 -45.17 87.8 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.536 -0.912 . . . . 10.0 108.536 177.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -61.2 -42.76 99.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.653 178.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . 0.522 ' OE1' ' CD1' ' C' ' 469' ' ' LEU . 0.4 OUTLIER -67.19 -39.51 86.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.968 -0.56 . . . . 10.0 109.877 178.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.11 -43.46 98.36 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 108.989 -0.745 . . . . 10.0 108.989 178.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -63.71 -45.11 91.47 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.133 -1.062 . . . . 10.0 108.133 177.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . 0.522 ' CD1' ' OE1' ' C' ' 466' ' ' GLU . 96.5 mt -56.09 -45.11 79.53 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 115.35 -0.841 . . . . 20.0 109.782 177.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 15.4 m-30 -64.89 -41.82 95.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.521 179.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 59.6 mtt180 -66.57 -44.67 81.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.977 0.418 . . . . 10.0 111.174 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -78.0 -2.94 39.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.043 -0.526 . . . . 10.0 112.188 -179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 62.5 mttt -116.08 -63.2 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.518 0.199 . . . . 10.0 111.29 178.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 66.1 t -57.54 -43.23 82.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.292 0.849 . . . . 10.0 113.292 -178.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.26 -59.74 12.84 Favored Pre-proline 0 CA--C 1.533 0.308 0 N-CA-C 112.34 0.496 . . . . 10.0 112.34 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -65.38 -29.99 53.69 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 121.835 1.69 . . . . 10.0 111.264 178.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 12.5 mt -67.44 -40.75 85.46 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -63.48 -34.78 78.53 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 109.222 -0.658 . . . . 10.0 109.222 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -68.49 -47.29 67.42 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.22 -45.17 94.53 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.857 -0.611 . . . . 10.0 109.589 178.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 62.9 mt -67.39 -33.08 74.46 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.633 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -66.25 -47.12 74.79 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -66.67 -41.91 87.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.615 178.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.22 -39.24 97.67 Favored Glycine 0 N--CA 1.447 -0.586 0 N-CA-C 110.842 -0.903 . . . . 10.0 110.842 178.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.04 -36.74 78.04 Favored 'General case' 0 C--O 1.219 -0.507 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 178.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 64.3 mtt180 -64.52 -39.67 94.21 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.34 -0.615 . . . . 10.0 109.34 178.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -67.67 -43.85 79.25 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 177.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -65.64 -31.87 73.13 Favored 'General case' 0 C--O 1.226 -0.149 0 CA-C-N 115.725 -0.67 . . . . 10.0 109.599 178.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 21.1 mt -66.66 -41.32 88.39 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 108.626 -0.879 . . . . 10.0 108.626 177.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -64.12 -39.48 94.12 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 108.298 -1.001 . . . . 10.0 108.298 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -60.9 -53.6 55.32 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.248 -1.019 . . . . 10.0 108.248 177.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 82.3 mt -57.81 -38.4 75.47 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 115.358 -0.837 . . . . 10.0 111.466 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -61.07 -37.53 83.01 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.886 0.374 . . . . 10.0 110.298 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -81.56 -17.06 49.68 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.603 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 10.5 mtmm -103.64 6.37 37.06 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.685 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 32.6 mt -124.93 -44.08 1.95 Allowed 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 112.093 0.405 . . . . 10.0 112.093 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 10.3 m -66.93 -62.32 3.92 Favored Pre-proline 0 CA--C 1.539 0.534 0 N-CA-C 112.215 0.45 . . . . 10.0 112.215 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -67.18 -21.36 48.57 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 122.158 1.905 . . . . 10.0 111.89 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 12.6 mt -87.1 -41.75 13.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.939 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.49 -45.09 94.15 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 111.446 -0.662 . . . . 10.0 111.446 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -64.48 -32.56 74.24 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 121.239 0.543 . . . . 10.0 109.846 178.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -73.02 -40.24 65.34 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.443 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 87.2 mmm -60.46 -34.69 74.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 10.0 109.652 178.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -70.76 -34.3 71.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.1 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -71.38 -36.81 71.55 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.025 -1.102 . . . . 10.0 108.025 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -62.53 -38.38 89.75 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 107.836 -1.172 . . . . 10.0 107.836 177.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -64.05 -35.48 80.88 Favored 'General case' 0 C--O 1.226 -0.138 0 CA-C-N 115.65 -0.704 . . . . 10.0 109.994 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 -64.16 -32.8 74.51 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.715 -0.846 . . . . 10.0 108.715 178.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -96.57 13.12 29.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.118 -0.946 . . . . 10.0 110.909 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -128.74 -67.56 0.79 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.29 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 47.7 t -69.01 -49.76 59.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.626 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -66.75 -34.18 77.26 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.919 0.39 . . . . 10.0 110.36 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -68.31 -39.31 82.04 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.116 -1.068 . . . . 10.0 108.116 177.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 11.3 mt -67.48 -24.69 65.62 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.452 -0.794 . . . . 10.0 110.366 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -58.75 -51.59 69.3 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.05 -0.722 . . . . 10.0 109.05 178.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.3 9.87 4.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.417 0.627 . . . . 10.0 110.901 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 49.7 m170 -113.89 -39.16 4.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.146 -0.479 . . . . 10.0 109.874 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 95.0 mt -89.39 -30.75 18.13 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.582 -0.736 . . . . 10.0 111.714 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -58.11 -54.63 53.68 Favored Pre-proline 0 CA--C 1.531 0.222 0 C-N-CA 121.235 -0.186 . . . . 10.0 110.739 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -67.47 -32.03 32.75 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 121.31 1.34 . . . . 10.0 110.048 177.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -62.8 -46.08 89.63 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.933 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 3.8 p -68.33 -33.52 74.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.015 0.436 . . . . 10.0 110.084 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -66.18 -45.5 80.63 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 178.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -65.84 -36.4 83.35 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 178.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 19.0 mt -60.81 -39.39 88.79 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.405 178.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 54.7 mtt85 -63.54 -38.46 91.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.179 178.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -62.78 -46.7 86.81 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.449 -0.945 . . . . 10.0 108.449 178.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 48.2 mtt180 -63.16 -41.89 99.34 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 114.896 -1.047 . . . . 10.0 109.77 178.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 76.7 mt -65.24 -41.69 94.09 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.456 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -59.26 -49.63 77.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.227 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -61.7 -47.92 83.13 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.723 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -64.6 -42.19 95.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.484 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 26.3 mt -64.36 -43.11 95.58 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 120.64 0.257 . . . . 10.0 110.34 179.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -63.42 -40.32 96.87 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.949 -0.389 . . . . 10.0 109.949 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.17 -41.21 99.19 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.955 -0.757 . . . . 10.0 108.955 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 96.1 mt -69.97 -19.63 63.35 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.681 179.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -87.46 -41.0 13.85 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 178.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.99 -51.64 52.52 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.722 -0.844 . . . . 10.0 108.722 178.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -70.66 -34.06 71.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.393 -0.821 . . . . 10.0 108.822 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.18 -45.66 85.22 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.956 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.02 -41.11 99.65 Favored Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 110.237 -1.145 . . . . 10.0 110.237 178.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.45 92.58 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 109.327 -0.62 . . . . 10.0 109.327 178.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 74.4 mtt180 -64.72 -38.52 91.27 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.952 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 85.9 mt -61.12 -41.7 97.18 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.555 -0.535 . . . . 10.0 109.555 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -68.34 -43.36 77.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.419 178.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -61.0 -47.53 86.04 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.052 179.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 15.7 m-30 -61.28 -43.56 98.67 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.399 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -59.67 -46.82 87.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.508 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -63.01 -54.86 31.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.564 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -58.63 -39.62 81.01 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.973 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.18 -41.4 90.34 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 116.491 -0.322 . . . . 10.0 110.466 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 47.2 m -62.39 -45.29 93.82 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -64.21 -29.7 70.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.317 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -79.48 -46.68 16.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.33 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 56.2 mt -60.04 -40.7 90.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.52 -0.309 . . . . 10.0 111.144 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 4.8 p -65.6 -47.79 74.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.867 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 12.3 p -68.83 -32.21 71.74 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.881 -0.328 . . . . 10.0 110.808 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 25.4 mt -63.84 -44.87 91.88 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.576 -0.527 . . . . 10.0 109.576 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.4 p -71.84 -34.82 69.6 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.777 -0.453 . . . . 10.0 109.777 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 74.4 mt-10 -63.74 -24.16 67.66 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.686 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 48.1 mttp -97.91 -31.39 12.21 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.141 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -63.84 -39.01 93.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.696 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -56.03 -61.86 5.72 Favored Pre-proline 0 CA--C 1.534 0.327 0 CA-C-N 116.42 -0.354 . . . . 10.0 111.44 179.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -65.65 -35.48 37.28 Favored 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 121.822 1.681 . . . . 10.0 111.736 179.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.8 82.69 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 121.145 -0.222 . . . . 10.0 110.814 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 57.3 mt -64.82 -41.61 95.63 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.204 -0.295 . . . . 10.0 110.204 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . 0.562 ' O ' ' CG ' ' C' ' 571' ' ' GLN . 88.1 mt-10 -64.17 -44.14 92.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.662 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -67.88 -41.1 83.34 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.374 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 33.5 mt -58.79 -49.46 77.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.238 -0.437 . . . . 10.0 109.826 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 59.2 mtt180 -65.85 -38.89 90.06 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.731 -0.47 . . . . 10.0 109.731 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . 0.562 ' CG ' ' O ' ' C' ' 567' ' ' GLU . 98.5 mt-30 -61.51 -40.21 93.8 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.665 -0.698 . . . . 20.0 111.974 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -78.44 -37.31 27.89 Favored Glycine 0 CA--C 1.521 0.445 0 N-CA-C 109.927 -1.269 . . . . 10.0 109.927 179.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 18.8 mt -54.87 -37.21 65.99 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 112.021 0.378 . . . . 10.0 112.021 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 53.4 mt -56.27 -66.02 1.32 Allowed Pre-proline 0 CA--C 1.538 0.484 0 N-CA-C 112.419 0.526 . . . . 10.0 112.419 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -68.72 -32.82 22.75 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 121.578 1.519 . . . . 10.0 112.11 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 15.4 t -65.27 -49.18 80.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.751 -0.204 . . . . 10.0 111.034 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 46.1 mt -65.2 -36.87 85.53 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 110.14 -0.319 . . . . 10.0 110.14 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -66.24 -46.37 77.38 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 110.091 -0.337 . . . . 10.0 110.091 178.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 44.0 m -62.15 -43.12 99.54 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.968 0.414 . . . . 10.0 109.986 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 5.3 m-30 -65.51 -37.37 86.58 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.903 -0.59 . . . . 10.0 109.564 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -60.82 -41.21 95.26 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 95.2 t -61.65 -39.9 84.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.115 -0.698 . . . . 10.0 109.115 178.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 13.4 m -68.92 -36.94 78.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.238 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -70.32 -43.2 70.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.733 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 98.6 mt -61.55 -45.94 92.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.12 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 2.9 p -65.63 -40.94 93.09 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.69 -0.485 . . . . 10.0 109.69 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -60.46 -53.11 61.49 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 115.76 -0.655 . . . . 10.0 110.632 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.3 mt -56.09 -45.13 79.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.868 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -68.91 -39.63 79.57 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.665 0.617 . . . . 10.0 112.665 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -70.93 -41.1 71.61 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.993 0.425 . . . . 10.0 110.814 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -64.52 -39.66 94.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.759 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.38 -25.9 67.77 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.947 0.351 . . . . 10.0 111.947 -179.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -72.95 -39.21 66.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.12 0.486 . . . . 10.0 110.191 179.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -77.03 -26.48 53.74 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.872 -0.604 . . . . 10.0 110.634 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 83.4 mt -95.82 46.8 1.09 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.05 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.428 -0.796 . . . . 10.0 109.665 -179.968 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.3 ptt? . . . . . 0 C--O 1.23 0.053 0 CA-C-O 120.976 0.417 . . . . 10.0 110.503 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 7.1 t -142.98 22.38 1.92 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.716 0.769 . . . . 10.0 110.295 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -108.87 137.53 46.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.341 -0.845 . . . . 10.0 109.639 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -125.84 157.33 37.87 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.809 0.338 . . . . 10.0 111.386 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 mmtm -114.77 112.57 23.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.707 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 25.8 mt -108.65 117.28 33.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.971 0.415 . . . . 10.0 110.841 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 39.8 t -107.42 119.34 56.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.131 0.491 . . . . 10.0 110.724 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 21.6 t -90.63 121.1 40.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.545 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 18.3 m -114.91 165.27 10.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.917 0.389 . . . . 10.0 110.952 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 144.92 163.82 10.28 Favored Glycine 0 N--CA 1.445 -0.7 0 N-CA-C 110.8 -0.92 . . . . 10.0 110.8 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.53 176.1 7.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.293 0.568 . . . . 10.0 111.893 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.64 123.61 6.16 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.915 -0.659 . . . . 10.0 111.963 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 121.23 -20.06 8.54 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.627 -0.797 . . . . 10.0 112.12 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 34.2 m -65.2 -36.43 77.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.795 0.331 . . . . 10.0 111.58 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 104.7 39.26 2.39 Favored Glycine 0 CA--C 1.518 0.257 0 C-N-CA 120.598 -0.811 . . . . 10.0 113.596 179.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -59.73 -51.98 67.45 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.943 0.401 . . . . 10.0 111.267 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -60.04 -36.3 76.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.895 -0.593 . . . . 10.0 111.895 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.92 -50.99 68.65 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.691 0.282 . . . . 10.0 110.745 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 72.0 mt -59.72 -36.83 77.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.456 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 29.2 m -68.79 -51.05 45.13 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.291 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 97.6 mt -63.11 -32.0 54.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-O 120.816 0.341 . . . . 10.0 110.977 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 38.0 tp60 -64.45 -30.34 71.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.533 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 23.8 tp -85.35 -30.71 23.46 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.114 0.483 . . . . 10.0 110.474 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 43.2 mm -73.13 -59.36 3.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.954 -0.567 . . . . 10.0 112.086 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -125.1 4.92 7.9 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 113.179 0.807 . . . . 10.0 113.179 -178.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 54.6 t30 58.27 51.43 8.45 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.293 0.568 . . . . 10.0 111.198 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 40.6 t60 -129.39 120.9 26.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.839 -0.618 . . . . 10.0 110.089 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -84.29 118.26 24.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.414 -0.357 . . . . 10.0 110.64 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 10.1 m -77.39 141.57 15.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.541 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -105.74 -24.02 12.6 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.258 0.551 . . . . 10.0 109.948 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 3.4 pm0 -86.43 140.36 30.06 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.28 -0.873 . . . . 10.0 111.054 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -85.49 68.73 10.54 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.395 0.617 . . . . 10.0 109.814 178.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.3 138.02 84.12 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.724 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -72.25 -178.37 3.22 Favored 'Trans proline' 0 N--CA 1.463 -0.303 0 C-N-CA 123.158 2.572 . . . . 10.0 111.706 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.2 m -166.71 137.39 3.26 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.443 -0.344 . . . . 10.0 110.711 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 76.8 mt -123.01 -52.91 2.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 107.817 -1.179 . . . . 10.0 107.817 177.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -148.1 115.06 6.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.079 -0.964 . . . . 10.0 109.001 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -132.66 133.61 43.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.093 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 2.0 p -120.96 122.27 39.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.987 0.423 . . . . 10.0 111.796 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -122.49 155.52 36.02 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -153.97 141.05 19.39 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.814 0.34 . . . . 10.0 111.21 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -158.48 155.98 29.47 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.726 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -105.24 131.28 52.91 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.529 -0.545 . . . . 10.0 109.529 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 15.7 m -139.02 158.22 29.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.685 0.279 . . . . 10.0 111.104 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 54.6 t -92.43 100.62 11.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.047 -0.723 . . . . 10.0 109.047 178.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 39.1 mt -88.86 104.67 15.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.683 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 58.67 12.77 2.32 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.95 1.093 . . . . 10.0 113.95 178.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 132.45 -33.13 2.71 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.414 -0.898 . . . . 10.0 113.087 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -101.38 134.87 43.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.639 0.257 . . . . 10.0 110.703 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 5.6 t -81.61 140.86 34.19 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 71.3 m -147.09 158.59 43.99 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.833 0.349 . . . . 10.0 111.328 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.04 122.46 40.06 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 82.9 mt -111.87 120.98 43.78 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.541 0.571 . . . . 10.0 112.541 -178.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.88 113.19 24.79 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 107.697 -1.224 . . . . 10.0 107.697 177.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 12.4 mt -101.5 127.05 55.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 120.811 0.338 . . . . 10.0 110.934 -178.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.6 tp -109.04 113.87 27.12 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.861 -0.609 . . . . 10.0 111.737 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -90.85 101.56 14.32 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.89 -0.781 . . . . 10.0 108.89 178.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 38.0 p -80.95 165.05 22.11 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 112.912 0.708 . . . . 10.0 112.912 -178.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.36 156.83 33.42 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.473 -0.785 . . . . 10.0 111.392 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -79.83 -55.82 3.48 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.786 -0.721 . . . . 10.0 111.969 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -120.32 127.82 52.7 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.762 -0.458 . . . . 20.0 109.762 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -163.02 168.33 21.18 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.697 -0.483 . . . . 10.0 109.697 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -105.37 -136.96 0.36 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.586 -0.279 . . . . 10.0 110.943 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -103.47 90.11 3.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.1 0.476 . . . . 10.0 110.97 -179.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 3.1 m -101.4 139.39 37.13 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.702 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.11 -37.78 88.55 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.006 0.431 . . . . 10.0 111.183 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 39.4 ttp -64.76 -35.77 82.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.036 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 22.6 ttt85 -66.5 -51.53 55.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.545 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.33 -38.99 72.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.876 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 3.0 tp60 -58.53 -56.09 26.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.64 -0.709 . . . . 10.0 112.255 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -67.28 -15.74 63.87 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 113.594 0.961 . . . . 10.0 113.594 -178.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 86.2 mtp -80.16 -18.31 50.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.773 0.321 . . . . 10.0 111.197 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 4.1 mtt-85 -75.15 -29.75 60.57 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.864 0.364 . . . . 10.0 110.715 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.59 -0.39 37.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.853 -0.612 . . . . 10.0 112.468 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -84.92 127.56 8.24 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.331 -0.937 . . . . 10.0 112.44 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -86.93 -42.28 13.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.218 0.532 . . . . 10.0 109.823 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -130.32 144.45 15.75 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 110.538 -1.025 . . . . 10.0 110.538 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -122.64 129.26 51.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.046 0.451 . . . . 10.0 111.861 -178.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 78.7 mt -96.88 108.82 21.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.549 -0.751 . . . . 10.0 109.886 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 19.3 m -85.47 91.08 8.12 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.027 -0.36 . . . . 10.0 110.027 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 47.4 t -89.6 121.61 39.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.542 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -130.51 152.1 50.26 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.661 -0.7 . . . . 10.0 109.882 179.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -91.67 125.97 36.59 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.976 -0.379 . . . . 10.0 109.976 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 43.8 pt -70.44 -8.06 10.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.2 0.524 . . . . 10.0 111.16 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.43 5.56 42.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.104 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -132.07 106.81 8.24 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.402 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -39.52 82.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.906 -0.588 . . . . 10.0 112.479 -179.085 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -59.1 -36.06 74.5 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.778 0.288 . . . . 10.0 111.778 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 21.1 m -64.71 -36.53 84.59 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.001 0.429 . . . . 10.0 110.6 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -70.94 -34.43 71.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.682 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -79.31 -25.78 42.34 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.97 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.75 -2.64 47.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.495 -179.22 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 29.5 mm -58.58 -42.36 84.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.728 0.299 . . . . 10.0 111.104 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 17.2 t60 -68.4 -26.62 65.64 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.986 0.422 . . . . 10.0 110.366 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -66.08 -40.8 91.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.685 -0.689 . . . . 10.0 109.803 179.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -71.7 -44.27 64.48 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.408 -0.96 . . . . 10.0 108.408 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -51.84 -53.47 39.95 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.967 -1.015 . . . . 10.0 111.691 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -64.76 -37.18 86.72 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.126 0.417 . . . . 10.0 112.126 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -61.97 -49.72 74.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.019 -0.363 . . . . 10.0 110.019 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 42.1 mt -62.81 -42.15 95.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 10.0 111.018 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -60.29 -32.86 71.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.545 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 49.2 ttp85 -80.69 -40.14 25.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.938 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 18.8 m -69.16 -26.34 31.73 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 112.469 0.544 . . . . 10.0 112.469 -179.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -98.86 -14.09 19.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.761 0.315 . . . . 10.0 110.868 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 11.4 t70 59.47 39.48 21.8 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.146 -178.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 19.6 m -155.16 139.37 16.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.458 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 7.2 mp0 -85.74 -13.07 49.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.651 0.739 . . . . 10.0 109.46 178.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -102.06 86.03 2.79 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.934 -1.03 . . . . 10.0 110.177 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 55.9 t -130.82 131.84 23.53 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.014 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -64.24 112.13 1.81 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.866 2.378 . . . . 10.0 111.824 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 57.5 mtt -130.54 149.61 52.13 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.126 -0.488 . . . . 10.0 109.746 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 99.4 t -130.97 128.03 61.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.772 -0.455 . . . . 10.0 109.772 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 17.1 tp -82.91 119.56 24.57 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.557 -0.535 . . . . 10.0 109.557 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 51.2 t -117.26 117.03 53.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 120.963 0.411 . . . . 10.0 111.48 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -98.79 115.14 5.22 Favored Glycine 0 N--CA 1.45 -0.388 0 N-CA-C 110.304 -1.118 . . . . 10.0 110.304 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -103.04 164.18 11.77 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 117.204 0.502 . . . . 10.0 112.147 -178.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 13.6 mtmt 69.44 41.68 1.26 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.108 -0.951 . . . . 10.0 113.112 178.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 15.4 p -81.04 -12.49 59.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.21 0.529 . . . . 10.0 110.266 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -76.47 -12.19 60.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.388 -0.824 . . . . 10.0 110.945 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 31.6 mt -95.17 136.86 22.35 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.143 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -72.84 3.54 4.33 Favored 'Trans proline' 0 CA--C 1.53 0.295 0 C-N-CA 122.623 2.216 . . . . 10.0 112.904 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.26 32.56 0.69 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.858 0.361 . . . . 10.0 111.147 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 24.6 ttm-85 -64.4 105.1 0.87 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.899 0.381 . . . . 10.0 111.557 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.5 m -94.12 -40.86 9.83 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.297 0.57 . . . . 10.0 109.661 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 45.7 t -86.7 122.84 39.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.566 -0.743 . . . . 10.0 109.577 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.9 150.14 42.85 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.986 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.38 -35.99 77.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.444 -179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -69.47 -33.99 73.71 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.62 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -62.43 -47.53 83.65 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.046 0.45 . . . . 10.0 110.151 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.33 94.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.741 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -63.2 -44.49 95.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.439 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -62.96 -42.22 99.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.987 0.422 . . . . 10.0 111.221 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 37.1 tp -66.2 -43.88 85.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.046 0.451 . . . . 10.0 110.276 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.22 -43.54 97.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.618 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -61.34 -35.53 77.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.683 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.0 m -67.27 -33.95 76.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.875 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -83.41 -19.84 35.25 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.231 0.539 . . . . 10.0 110.194 178.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.21 30.46 25.25 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 111.03 -0.828 . . . . 10.0 111.03 -179.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 48.7 pt -123.37 151.63 63.09 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.763 -0.218 . . . . 10.0 110.74 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.36 156.96 33.07 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.384 2.056 . . . . 10.0 112.059 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -122.73 129.84 52.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.512 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 33.2 mm -125.97 125.59 68.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.142 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -87.32 124.41 33.33 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.208 -1.034 . . . . 10.0 108.208 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 40.2 p -126.82 172.94 9.95 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.577 0.955 . . . . 10.0 113.577 -177.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 26.5 t -159.79 125.16 4.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.245 -1.343 . . . . 10.0 107.615 178.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.47 -27.2 65.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.946 0.403 . . . . 10.0 111.828 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -73.79 -55.74 5.85 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.603 0.594 . . . . 10.0 112.603 -179.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 44.4 p -83.22 -14.81 52.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.641 -0.254 . . . . 10.0 111.591 -178.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 27.0 ttt180 68.32 22.88 7.86 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.622 0.725 . . . . 10.0 109.834 -178.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -62.05 111.45 1.94 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.907 -1.042 . . . . 10.0 111.833 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 67.89 9.38 56.32 Favored Glycine 0 C--O 1.227 -0.303 0 N-CA-C 114.658 0.623 . . . . 10.0 114.658 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.68 -53.34 48.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 117.511 0.655 . . . . 10.0 111.17 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -62.01 -45.1 95.07 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.118 0.485 . . . . 10.0 110.373 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -63.48 -36.13 82.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.852 -0.613 . . . . 10.0 112.53 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.0 -47.85 81.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.908 0.385 . . . . 10.0 110.196 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -66.91 -42.02 86.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.686 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -62.99 -42.34 99.82 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.18 -0.463 . . . . 10.0 110.598 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 66.1 m -60.09 -41.4 92.4 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.807 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 41.0 tp -57.8 -43.65 85.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.495 -0.321 . . . . 10.0 110.222 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 46.4 t -64.78 -36.72 78.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.117 -0.492 . . . . 10.0 109.929 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 67.3 mtt180 -63.25 -44.63 94.62 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.126 179.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -64.39 -38.07 89.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.095 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 96.1 mt -65.02 -43.64 96.05 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.201 179.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -63.16 -40.33 97.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.534 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -65.5 -31.62 72.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.241 0.543 . . . . 10.0 109.653 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 20.8 t-80 -67.23 -35.65 80.03 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.913 178.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -63.26 -48.93 76.09 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.789 -0.641 . . . . 10.0 109.623 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -61.37 -42.81 99.31 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.243 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -58.47 -46.39 86.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.943 -0.572 . . . . 10.0 110.474 179.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 16.8 ttm -67.01 -24.39 66.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.625 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 17.0 m -77.94 -12.76 60.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.018 0.437 . . . . 10.0 110.977 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -111.61 -40.46 4.33 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.244 -0.434 . . . . 10.0 111.619 -179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -98.23 3.94 48.87 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.418 0.525 . . . . 10.0 112.418 -178.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . -109.47 31.38 7.65 Favored Glycine 0 N--CA 1.453 -0.183 0 N-CA-C 111.037 -0.825 . . . . 10.0 111.037 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 19.9 tptt -155.03 131.56 10.52 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 26.8 mmtp -82.93 119.87 24.97 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.995 -0.743 . . . . 10.0 108.995 179.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 16.0 ttmm 75.29 95.15 0.07 Allowed 'General case' 0 C--O 1.234 0.268 0 O-C-N 123.934 0.771 . . . . 10.0 111.301 -178.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . 0.418 ' NZ ' ' N1 ' ' A' ' 40' ' ' 17F . 10.0 mmtt -116.97 144.92 44.01 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.657 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . 0.454 ' NZ ' ' N1 ' ' A' ' 36' ' ' 17F . 0.1 OUTLIER -82.55 -14.94 54.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.806 179.82 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt 72.37 -60.59 0.52 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.76 -0.654 . . . . 10.0 111.693 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 11.6 m -80.49 164.77 22.75 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.505 -0.316 . . . . 10.0 110.252 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -100.19 -53.54 3.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.717 0.294 . . . . 10.0 111.597 -179.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.74 148.73 31.69 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.056 0.455 . . . . 10.0 111.704 -179.055 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 10.8 ptmm? -82.59 170.84 14.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.538 179.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 60.2 m . . . . . 0 C--N 1.32 -0.693 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.721 179.345 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 N-CA-C 111.946 -0.462 . . . . 10.0 111.946 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 1.6 p -126.15 130.11 50.38 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.618 0.247 . . . . 10.0 110.944 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 45.7 t -117.81 128.7 74.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.154 -0.476 . . . . 10.0 109.804 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 13.3 pttp -93.34 119.35 32.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.163 0.506 . . . . 10.0 111.395 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 35.0 t -96.62 129.11 47.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.868 -0.605 . . . . 10.0 109.465 179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -90.71 139.25 30.9 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.062 0.458 . . . . 10.0 111.194 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 68.4 mt -112.4 154.94 44.37 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.507 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.91 55.13 1.71 Allowed 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.038 2.492 . . . . 10.0 112.649 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -151.3 19.65 0.75 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.164 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 67.0 mttm 62.12 31.97 17.59 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.715 -0.675 . . . . 10.0 111.22 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -141.91 173.47 11.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.254 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.48 171.02 18.73 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.793 0.33 . . . . 10.0 111.708 -179.149 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 9.7 t -138.12 141.49 40.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.725 -0.671 . . . . 10.0 109.357 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 47.2 t -92.33 110.84 23.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.973 0.416 . . . . 10.0 111.333 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 17.3 t -102.07 141.5 18.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.247 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.99 135.77 35.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.46 -0.337 . . . . 10.0 110.095 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 57.3 t -75.14 116.3 17.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 110.231 -0.285 . . . . 10.0 110.231 179.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 23.6 mtp180 -129.26 109.5 11.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.995 0.426 . . . . 10.0 111.196 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -70.21 114.54 8.46 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.477 0.656 . . . . 10.0 110.186 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 147.71 -34.75 1.23 Allowed Glycine 0 N--CA 1.446 -0.65 0 N-CA-C 110.118 -1.193 . . . . 10.0 110.118 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 10.7 ptm -98.0 150.29 21.53 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.447 -0.377 . . . . 10.0 110.132 179.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.36 176.73 6.19 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.301 -179.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 92.3 t -59.05 -37.29 67.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 52.9 t80 -58.09 -49.7 76.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.497 -0.774 . . . . 10.0 110.912 179.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -68.42 -38.36 81.15 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.08 -0.509 . . . . 10.0 112.05 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 5.4 m -73.02 -43.45 62.06 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.814 0.672 . . . . 10.0 112.814 -178.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.22 -15.02 58.67 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.454 0.539 . . . . 10.0 112.454 -178.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -56.3 -52.44 64.52 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.056 0.391 . . . . 10.0 112.056 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 5.2 mmmm -59.55 -36.39 76.07 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.062 0.393 . . . . 10.0 112.062 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -71.34 -38.3 71.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.915 0.388 . . . . 10.0 111.294 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 90.4 mt -75.03 -45.22 43.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.275 -0.42 . . . . 10.0 111.184 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -58.91 -37.97 77.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.019 -0.537 . . . . 10.0 112.224 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 3.2 p -71.12 -12.75 16.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 121.073 0.463 . . . . 10.0 111.407 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -110.65 -2.0 16.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.838 0.351 . . . . 10.0 111.061 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 77.65 24.4 65.13 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.999 -0.62 . . . . 10.0 112.443 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 93.3 mt -106.52 143.93 33.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.545 0.212 . . . . 10.0 110.481 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -109.32 159.34 17.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.259 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -78.15 62.57 2.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.791 0.329 . . . . 10.0 110.995 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -134.32 -67.16 0.59 Allowed 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.123 -0.489 . . . . 10.0 112.046 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 1.7 p -87.78 -17.05 32.47 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.229 0.537 . . . . 10.0 110.707 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 4.6 m -83.43 128.59 34.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.982 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 5.0 p -121.35 137.94 53.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.3 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 20.7 t -98.62 127.31 51.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.779 -179.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -108.04 135.92 48.59 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.19 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -87.2 169.88 11.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.002 -0.544 . . . . 10.0 109.564 178.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 853' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.42 78.65 1.45 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.461 0.648 . . . . 10.0 111.049 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 65.8 mt -91.66 94.24 4.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.227 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt 58.58 28.39 17.02 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.51 -0.768 . . . . 10.0 112.157 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 102.25 -19.85 47.13 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 121.042 -0.599 . . . . 10.0 112.13 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.48 111.61 19.21 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.925 0.393 . . . . 10.0 111.3 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 858' ' ' LYS . . . . . 0.403 ' NZ ' ' O2P' ' A' ' 31' ' ' PCW . 86.6 mttt -69.95 112.9 6.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.892 178.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -110.35 134.49 52.24 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.792 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 46.1 t -68.81 123.68 22.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.661 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 1.8 t -105.22 172.8 6.6 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.184 -0.302 . . . . 10.0 110.184 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -114.34 163.59 15.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.985 0.421 . . . . 10.0 110.817 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -82.6 -21.44 35.17 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.539 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.91 -16.58 58.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.668 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 2.9 m -69.49 138.81 53.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.647 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -76.43 151.55 36.48 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.671 -0.492 . . . . 10.0 109.671 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 7.3 tp -82.93 0.59 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 121.104 0.478 . . . . 10.0 112.155 -179.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -61.29 -56.05 37.67 Favored Pre-proline 0 CA--C 1.543 0.707 0 N-CA-C 113.67 0.989 . . . . 10.0 113.67 -179.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.44 3.77 5.03 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 121.984 1.789 . . . . 10.0 113.001 -179.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -85.76 -11.99 52.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.007 0.432 . . . . 10.0 111.402 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -64.09 114.97 4.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.362 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 133.77 -30.18 3.01 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.76 -0.733 . . . . 10.0 112.508 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -119.78 -167.62 1.46 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.59 0.233 . . . . 10.0 110.937 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -131.7 153.71 49.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.114 -0.493 . . . . 10.0 110.286 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 70.6 mt -114.51 144.82 42.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.716 0.294 . . . . 10.0 111.622 -178.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 3.2 mp -123.7 123.7 67.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 17.3 t -103.44 135.77 39.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 120.649 0.261 . . . . 10.0 111.009 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.79 164.89 28.43 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 45.0 t -106.21 127.06 61.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 120.67 0.271 . . . . 10.0 110.57 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 94.7 mt . . . . . 0 C--O 1.252 1.207 0 CA-C-O 118.392 -0.813 . . . . 10.0 111.088 -179.998 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PCW . . . . . 0.403 ' O2P' ' NZ ' ' D' ' 858' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' 17F . . . . . 0.454 ' N1 ' ' NZ ' ' B' ' 179' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' 17F . . . . . 0.418 ' N1 ' ' NZ ' ' B' ' 178' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 201' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 76.7 mt . . . . . 0 C--O 1.222 -0.35 0 N-CA-C 110.031 -0.359 . . . . 10.0 110.031 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -66.27 -50.33 64.06 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -58.29 -45.3 88.21 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.444 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 242' ' ' GLU . . . . . 0.585 ' HB3' ' NH2' ' C' ' 532' ' ' ARG . 31.2 mm-40 -63.87 -44.84 91.88 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.978 -1.01 . . . . 10.0 110.479 179.054 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 243' ' ' MET . . . . . 0.458 ' HG3' ' HG ' ' A' ' 247' ' ' LEU . 0.1 OUTLIER -65.15 -27.48 68.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.908 179.336 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 24.8 m -63.03 -49.16 75.72 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 108.411 -0.959 . . . . 10.0 108.411 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -70.55 -42.42 71.17 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.142 -0.688 . . . . 10.0 109.142 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 246' ' ' ASP . . . . . 0.449 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.6 OUTLIER -53.29 -65.02 0.64 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.277 -0.874 . . . . 10.0 110.934 179.911 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.458 ' HG ' ' HG3' ' A' ' 243' ' ' MET . 45.2 mt -58.5 -45.97 87.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.817 -0.629 . . . . 10.0 111.972 -179.114 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -61.03 -48.25 82.62 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.947 0.351 . . . . 10.0 111.947 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -65.19 -40.83 94.75 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.116 -0.328 . . . . 10.0 110.116 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 250' ' ' VAL . . . . . 0.627 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 24.8 t -63.51 -42.85 97.63 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.441 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.547 179.054 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 251' ' ' LYS . . . . . 0.454 ' O ' HG12 ' A' ' 254' ' ' VAL . 89.6 mttt -72.38 -43.43 63.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.829 0.347 . . . . 10.0 111.398 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.94 -34.73 78.1 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.321 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 45.4 mtpt -88.57 -25.49 22.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.398 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.627 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.5 OUTLIER -65.84 -26.22 38.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.739 0.304 . . . . 10.0 110.548 179.51 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -61.21 -60.93 9.04 Favored Pre-proline 0 CA--C 1.535 0.388 0 CA-C-N 116.188 -0.46 . . . . 10.0 109.809 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 256' ' ' PRO . . . . . 0.421 ' HA ' ' HB3' ' A' ' 259' ' ' ASP . 20.1 Cg_endo -65.39 -24.41 57.34 Favored 'Trans proline' 0 C--N 1.36 1.176 0 C-N-CA 121.725 1.617 . . . . 10.0 111.059 177.218 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 257' ' ' TYR . . . . . 0.517 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 6.7 m-30 -65.53 -52.97 48.6 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 177.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 83.8 mt -66.44 -41.21 89.48 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.556 -0.747 . . . . 10.0 110.007 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 259' ' ' ASP . . . . . 0.447 ' O ' ' HB2' ' A' ' 263' ' ' LYS . 5.6 t70 -60.18 -43.91 95.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.065 0.459 . . . . 10.0 110.391 178.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -65.55 -47.24 76.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.278 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -65.92 -45.94 80.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.782 -0.644 . . . . 10.0 111.646 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 23.1 tt0 -64.9 -34.71 79.05 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-O 120.497 0.189 . . . . 10.0 110.537 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 263' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 259' ' ' ASP . 2.8 ttmp? -60.83 -49.57 76.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.507 0.67 . . . . 10.0 109.283 178.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.437 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 41.7 mttt -70.64 -35.11 72.74 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.342 -0.844 . . . . 10.0 110.199 179.089 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 9.2 t90 -62.44 -35.73 80.19 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.746 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -62.02 -46.05 90.88 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 108.827 -0.805 . . . . 10.0 108.827 178.054 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -62.74 -43.55 98.51 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 268' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 46.3 mt-10 -56.81 -48.9 76.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.68 179.29 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 81.3 mmm -71.64 -43.17 66.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.754 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -61.51 -49.94 74.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.902 -0.135 . . . . 10.0 111.113 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 86.8 mt -64.58 -36.27 83.68 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.867 -0.42 . . . . 10.0 109.867 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 272' ' ' TYR . . . . . 0.474 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 40.6 t80 -61.67 -50.03 74.14 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.479 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 273' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' A' ' 273' ' ' ARG . 50.3 mtt85 -67.05 -36.03 81.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.706 0.288 . . . . 10.0 110.588 179.551 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -61.2 -45.34 94.99 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.797 -0.638 . . . . 10.0 109.923 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.793 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 63.1 mttt -80.52 -31.65 37.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.428 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 1.4 t -53.95 -37.64 34.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 O-C-N 123.123 0.264 . . . . 10.0 111.42 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -58.96 -63.37 4.23 Favored Pre-proline 0 CA--C 1.533 0.296 0 N-CA-C 112.332 0.493 . . . . 10.0 112.332 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 278' ' ' PRO . . . . . 0.472 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 15.5 Cg_endo -60.68 -35.69 88.3 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 122.11 1.873 . . . . 10.0 111.601 178.312 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.979 HD22 ' HG2' ' C' ' 495' ' ' LYS . 16.6 mt -65.19 -41.61 94.38 Favored 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 109.931 -0.396 . . . . 10.0 109.931 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 20.4 ttm180 -67.55 -35.07 78.34 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.399 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -65.82 -44.17 86.43 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.261 178.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 282' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 83.8 mt-10 -60.46 -45.08 95.01 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 108.953 -0.758 . . . . 10.0 108.953 178.376 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 84.3 mt -62.71 -47.14 84.89 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.459 -0.791 . . . . 10.0 109.884 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -62.98 -56.71 14.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.91 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -61.92 -43.97 97.74 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.884 0.374 . . . . 10.0 110.576 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -61.98 -47.2 91.6 Favored Glycine 0 N--CA 1.444 -0.819 0 N-CA-C 110.857 -0.897 . . . . 10.0 110.857 178.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.61 -34.5 78.41 Favored 'General case' 0 C--O 1.218 -0.595 0 N-CA-C 110.187 -0.301 . . . . 10.0 110.187 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 288' ' ' ARG . . . . . 0.417 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 88.4 mtt180 -57.81 -44.92 86.7 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.659 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -68.83 -53.2 22.83 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.655 -0.498 . . . . 10.0 109.655 178.564 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 53.6 mttt -52.82 -49.74 65.07 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.668 -0.696 . . . . 10.0 111.515 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 84.1 mt -68.11 -45.48 73.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.487 -0.324 . . . . 10.0 111.355 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 292' ' ' HIS . . . . . 0.464 ' O ' ' HG3' ' A' ' 296' ' ' GLU . 43.8 t60 -59.84 -47.72 84.61 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.686 -0.234 . . . . 10.0 110.683 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 293' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 297' ' ' LYS . 44.3 mt-10 -63.03 -35.27 79.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.689 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 36.6 mt -70.94 -38.6 72.87 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.066 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -63.57 -35.39 80.34 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 108.65 -0.87 . . . . 10.0 108.65 177.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 296' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 292' ' ' HIS . 56.7 mt-10 -73.2 -7.44 51.45 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.081 -0.963 . . . . 10.0 110.349 178.729 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 297' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 293' ' ' GLU . 2.6 mmpp? -100.87 -44.28 5.82 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.757 -0.831 . . . . 10.0 108.757 178.059 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 90.7 mt -60.82 -22.85 64.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.598 -0.728 . . . . 10.0 111.267 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 299' ' ' SER . . . . . 0.518 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 18.5 m -73.77 -67.09 0.45 Allowed Pre-proline 0 CA--C 1.542 0.642 0 C-N-CA 120.841 -0.344 . . . . 10.0 111.41 178.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 300' ' ' PRO . . . . . 0.518 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 37.3 Cg_endo -65.84 -44.59 7.61 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.04 1.827 . . . . 10.0 112.25 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.542 HD13 ' HG2' ' C' ' 473' ' ' LYS . 85.0 mt -69.89 -22.01 63.27 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.024 0.44 . . . . 10.0 110.007 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -77.99 -45.22 10.62 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 109.169 -1.573 . . . . 10.0 109.169 177.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -61.57 -41.95 98.13 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.6 -0.889 . . . . 10.0 108.6 177.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.07 -36.88 85.07 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.272 -0.876 . . . . 10.0 109.448 178.337 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 11.2 tpt -64.81 -46.13 83.31 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.511 -0.551 . . . . 10.0 109.511 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 27.8 mtt180 -63.52 -43.55 96.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.419 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 307' ' ' ASP . . . . . 0.918 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 5.1 t0 -64.19 -40.04 95.26 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.253 -0.431 . . . . 10.0 110.348 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 308' ' ' ARG . . . . . 1.57 ' CD ' HD11 ' C' ' 469' ' ' LEU . 5.1 mmp_? -69.55 -36.72 76.62 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.912 -0.774 . . . . 10.0 108.912 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 309' ' ' ALA . . . . . 0.529 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -65.39 -35.07 79.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.739 -0.664 . . . . 10.0 109.783 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 310' ' ' ARG . . . . . 0.918 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 86.2 mtt180 -58.37 -55.22 37.86 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 109.026 -0.731 . . . . 10.0 109.026 178.437 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -62.28 -39.89 94.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.613 178.755 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 312' ' ' HIS . . . . . 0.592 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 0.2 OUTLIER -56.29 -54.45 45.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.738 179.246 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 313' ' ' VAL . . . . . 0.449 ' O ' ' HG3' ' A' ' 317' ' ' ARG . 57.7 t -73.75 -41.77 54.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.813 -0.63 . . . . 10.0 112.24 -178.582 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.1 -39.15 93.84 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.998 -0.281 . . . . 10.0 111.309 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -68.21 -28.73 67.5 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 108.569 -0.9 . . . . 10.0 108.569 177.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 16.5 mt -73.86 -37.17 64.84 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-N 115.428 -0.806 . . . . 10.0 108.889 178.194 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 317' ' ' ARG . . . . . 0.449 ' HG3' ' O ' ' A' ' 313' ' ' VAL . 74.9 mtt180 -61.58 -49.37 76.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.933 0.397 . . . . 10.0 110.163 179.23 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -69.18 -10.35 57.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.818 -0.628 . . . . 10.0 112.063 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 17.5 m80 -106.31 -50.49 3.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.652 -0.249 . . . . 10.0 111.372 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 82.8 mt -63.12 -38.57 91.71 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.539 0.57 . . . . 10.0 112.539 -179.116 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.19 -60.24 9.54 Favored Pre-proline 0 CA--C 1.534 0.345 0 C-N-CA 121.206 -0.198 . . . . 10.0 111.292 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -66.43 -32.73 39.72 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 121.444 1.429 . . . . 10.0 111.239 178.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 323' ' ' TYR . . . . . 0.418 ' O ' ' HB2' ' A' ' 327' ' ' LEU . 5.2 m-30 -60.6 -48.66 80.78 Favored 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 110.333 -0.247 . . . . 10.0 110.333 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 324' ' ' SER . . . . . 0.49 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 25.4 p -69.97 -35.05 74.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.859 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 325' ' ' ASP . . . . . 0.643 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 37.0 t70 -67.04 -46.83 73.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.935 0.398 . . . . 10.0 110.161 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -67.77 -30.21 69.61 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.066 -0.716 . . . . 10.0 109.066 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 327' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 323' ' ' TYR . 1.0 OUTLIER -67.66 -29.61 68.95 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 108.952 -0.759 . . . . 10.0 108.952 178.01 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 328' ' ' ARG . . . . . 0.643 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 75.8 mtt180 -64.96 -38.45 91.02 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 108.611 -0.885 . . . . 10.0 108.611 178.041 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -69.12 -40.76 78.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.111 178.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 330' ' ' ARG . . . . . 0.53 ' NH2' ' HB3' ' C' ' 447' ' ' GLU . 13.5 ttm180 -65.17 -44.99 86.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.652 -0.704 . . . . 10.0 109.391 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 48.5 mt -65.12 -34.32 78.12 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.826 -0.624 . . . . 10.0 109.572 178.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -63.93 -43.07 96.99 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -64.2 -42.73 96.52 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.076 -0.713 . . . . 10.0 109.076 178.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 334' ' ' ARG . . . . . 0.558 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 6.7 mmt180 -61.28 -52.35 65.1 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.593 -0.73 . . . . 10.0 109.285 178.613 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 43.7 mt -61.51 -37.74 84.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.543 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -61.17 -48.86 79.61 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.42 -43.12 95.34 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.929 -0.578 . . . . 10.0 109.916 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 338' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 334' ' ' ARG . 69.5 mt -63.09 -32.61 74.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 10.0 111.274 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -76.46 -46.39 27.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.662 0.268 . . . . 10.0 110.507 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -65.48 -48.99 70.71 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.128 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 341' ' ' ASN . . . . . 0.427 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 3.8 m-20 -65.68 -38.04 88.16 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.549 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 342' ' ' GLY . . . . . 0.576 ' HA2' ' HD2' ' A' ' 345' ' ' ARG . . . -60.34 -42.98 99.06 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.472 -0.785 . . . . 10.0 111.544 179.328 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.75 -37.88 93.08 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 110.731 -0.948 . . . . 10.0 110.731 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -73.16 -44.82 59.41 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.446 -0.576 . . . . 10.0 109.446 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 345' ' ' ARG . . . . . 0.576 ' HD2' ' HA2' ' A' ' 342' ' ' GLY . 98.0 mtt180 -53.92 -49.33 68.9 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.969 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 95.3 mt -63.67 -40.56 97.14 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.325 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -64.29 -47.32 79.94 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.157 0.503 . . . . 10.0 109.839 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 348' ' ' GLU . . . . . 0.472 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 22.0 mt-10 -66.67 -41.38 88.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.788 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 349' ' ' TYR . . . . . 0.429 ' HD1' ' HA ' ' A' ' 349' ' ' TYR . 1.8 m-30 -61.22 -39.33 89.86 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.937 -0.394 . . . . 10.0 109.937 178.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -65.64 -39.92 91.96 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.395 -0.594 . . . . 10.0 109.395 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -65.7 -50.82 63.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.676 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 16.4 mttm -60.72 -37.57 82.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.575 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -64.89 -44.59 89.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.023 178.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 32.4 m -61.04 -41.79 97.25 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.832 -0.433 . . . . 10.0 109.832 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -63.19 -40.02 96.31 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 356' ' ' HIS . . . . . 0.554 ' HA ' ' OE1' ' C' ' 418' ' ' GLN . 17.7 m80 -65.79 -45.18 83.37 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.484 -0.78 . . . . 10.0 109.852 179.069 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.406 HD23 HD12 ' A' ' 360' ' ' LEU . 96.5 mt -59.49 -34.98 73.26 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.649 179.339 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 358' ' ' SER . . . . . 0.5 ' O ' ' HG3' ' A' ' 362' ' ' GLU . 29.7 m -63.26 -49.19 75.06 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.057 -0.519 . . . . 10.0 110.258 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 21.0 p -72.63 -28.22 62.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.084 0.468 . . . . 10.0 109.942 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 360' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 356' ' ' HIS . 28.9 mt -64.45 -47.65 78.24 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.164 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 1.4 p -64.69 -34.87 79.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.817 0.341 . . . . 10.0 110.591 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 362' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 358' ' ' SER . 25.5 mt-10 -68.48 -9.02 46.19 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.426 179.312 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.578 ' HD3' HG23 ' C' ' 411' ' ' THR . 7.5 mtmp? -116.88 -29.81 5.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.604 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -73.5 -14.69 61.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.281 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.72 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 95.4 mttt -117.09 -68.86 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 112.401 0.519 . . . . 10.0 112.401 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.72 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 50.2 Cg_exo -57.42 -56.07 2.06 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.141 1.894 . . . . 10.0 112.445 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -64.07 -42.62 96.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.207 -0.452 . . . . 10.0 111.367 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 368' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 368' ' ' LEU . 9.2 mt -65.68 -37.57 86.86 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 120.908 -0.317 . . . . 10.0 111.248 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 369' ' ' GLU . . . . . 0.837 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 9.6 mt-10 -68.77 -32.75 72.72 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.998 -0.371 . . . . 10.0 109.998 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.22 -45.0 78.13 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.413 -0.958 . . . . 10.0 108.413 177.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.51 -47.95 79.61 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.171 -0.922 . . . . 10.0 109.908 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -65.13 -39.9 93.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.933 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.837 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.8 mt-30 -64.32 -34.58 78.47 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.15 -0.477 . . . . 20.0 110.704 178.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -77.43 -34.65 39.61 Favored Glycine 0 C--N 1.332 0.336 0 N-CA-C 109.698 -1.361 . . . . 10.0 109.698 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 18.0 mt -61.26 -28.39 69.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.758 -0.221 . . . . 10.0 111.186 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 376' ' ' LEU . . . . . 0.491 ' HB2' ' HD3' ' A' ' 377' ' ' PRO . 56.3 mt -59.47 -65.07 2.27 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 121.083 -0.247 . . . . 10.0 111.089 179.241 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 377' ' ' PRO . . . . . 0.491 ' HD3' ' HB2' ' A' ' 376' ' ' LEU . 30.6 Cg_endo -65.09 -34.07 47.92 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 121.819 1.68 . . . . 10.0 111.212 178.848 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 16.0 t -62.3 -53.36 48.48 Favored 'Isoleucine or valine' 0 C--O 1.231 0.095 0 CA-C-N 116.702 -0.226 . . . . 10.0 110.433 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 379' ' ' LEU . . . . . 0.4 ' O ' ' HG3' ' A' ' 383' ' ' LYS . 40.4 mt -62.09 -41.47 98.23 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 109.957 -0.386 . . . . 10.0 109.957 179.327 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 380' ' ' GLU . . . . . 0.485 ' O ' HG23 ' A' ' 384' ' ' VAL . 73.8 mt-10 -61.78 -46.65 88.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.765 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 30.0 p -64.45 -34.11 77.43 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.867 0.365 . . . . 10.0 110.346 178.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 382' ' ' PHE . . . . . 0.434 ' HD1' ' HA ' ' A' ' 382' ' ' PHE . 3.3 m-30 -68.55 -41.4 79.88 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.06 -0.718 . . . . 10.0 109.06 178.13 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 383' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 379' ' ' LEU . 83.0 mttt -63.22 -40.28 97.01 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 178.383 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 384' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 380' ' ' GLU . 54.5 t -59.98 -45.86 94.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-N 116.057 -0.52 . . . . 10.0 109.927 178.771 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.26 -43.06 71.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.522 -0.308 . . . . 10.0 111.491 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -63.68 -48.31 77.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.767 0.318 . . . . 10.0 111.38 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 99.2 mt -63.07 -39.76 95.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.432 -0.349 . . . . 10.0 111.363 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 388' ' ' SER . . . . . 0.414 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 31.4 p -72.52 -39.31 67.66 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.856 -0.338 . . . . 10.0 110.896 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -66.01 -31.07 71.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.261 0.553 . . . . 10.0 110.318 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 27.6 mt -61.4 -22.0 64.6 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.752 -0.658 . . . . 10.0 111.113 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -64.02 -50.36 68.81 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.902 -0.777 . . . . 10.0 108.902 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 392' ' ' GLU . . . . . 0.643 ' HA ' ' HG2' ' A' ' 395' ' ' LYS . 20.5 mp0 -61.56 -44.05 97.75 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.32 -0.855 . . . . 10.0 111.658 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -54.04 -42.52 69.27 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 123.683 0.614 . . . . 10.0 112.169 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 30.2 m -82.88 -38.88 22.3 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.396 0.517 . . . . 10.0 112.396 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 395' ' ' LYS . . . . . 0.643 ' HG2' ' HA ' ' A' ' 392' ' ' GLU . 2.1 ptpt . . . . . 0 N--CA 1.466 0.34 0 N-CA-C 112.808 0.67 . . . . 10.0 112.808 -178.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 1.7 mt . . . . . 0 N--CA 1.452 -0.328 0 CA-C-O 120.835 0.35 . . . . 10.0 111.003 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 56.9 mt -64.6 -38.06 89.71 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.156 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.84 -43.55 75.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.617 0.722 . . . . 10.0 109.484 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -66.91 -44.73 80.03 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.391 -0.822 . . . . 10.0 110.667 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -29.19 69.81 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.224 -0.444 . . . . 10.0 111.176 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.23 -37.16 79.49 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 109.406 -0.59 . . . . 10.0 109.406 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 69.6 m -69.8 -28.63 65.89 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.408 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 408' ' ' VAL . . . . . 0.439 ' O ' ' HB ' ' C' ' 411' ' ' THR . 57.6 t -69.93 -38.16 74.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.479 -0.782 . . . . 10.0 108.89 178.408 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 1.6 m -62.54 -41.82 99.13 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.5 -0.926 . . . . 10.0 108.5 177.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 3.8 m -63.82 -33.18 75.09 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.044 -0.725 . . . . 10.0 109.044 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 411' ' ' THR . . . . . 0.578 HG23 ' HD3' ' A' ' 363' ' ' LYS . 95.7 m -65.93 -41.83 90.88 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 108.847 -0.797 . . . . 10.0 108.847 178.246 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -61.87 -42.3 98.89 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.291 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 413' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' C' ' 417' ' ' GLU . 8.5 m -61.17 -44.73 96.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.012 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 414' ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' C' ' 414' ' ' LYS . 35.0 mmtt -61.71 -37.58 84.7 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.127 0.489 . . . . 10.0 110.007 178.513 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 415' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' C' ' 411' ' ' THR . 83.9 mt -68.83 -38.24 79.7 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.663 178.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -65.0 -31.74 73.13 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.431 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 417' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' C' ' 413' ' ' SER . 13.7 mt-10 -65.25 -35.54 81.34 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 418' ' ' GLN . . . . . 0.744 ' O ' ' HB ' ' C' ' 422' ' ' VAL . 26.0 mt-30 -80.56 -33.49 36.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.723 -0.672 . . . . 10.0 109.972 178.596 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 53.2 mt -63.94 -15.88 60.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.636 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -89.0 -95.76 1.05 Allowed Glycine 0 N--CA 1.444 -0.803 0 C-N-CA 120.801 -0.714 . . . . 10.0 111.969 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 421' ' ' PRO . . . . . 0.466 ' O ' ' HB2' ' C' ' 425' ' ' GLU . 12.3 Cg_endo -54.05 -39.96 83.34 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.553 2.835 . . . . 10.0 114.345 -178.729 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 422' ' ' VAL . . . . . 0.744 ' HB ' ' O ' ' C' ' 418' ' ' GLN . 76.0 t -63.61 -48.18 87.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 117.953 0.342 . . . . 10.0 111.062 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 4.9 m -68.59 -39.16 81.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.817 0.342 . . . . 10.0 110.096 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -61.97 -42.28 98.95 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.276 -0.639 . . . . 10.0 109.276 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 425' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' C' ' 421' ' ' PRO . 14.6 tt0 -64.8 -39.74 94.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.205 -0.907 . . . . 10.0 108.676 178.637 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.37 -38.86 88.52 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.048 -0.723 . . . . 10.0 109.048 178.663 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -66.98 -38.16 85.55 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.602 178.384 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -64.7 -36.92 85.83 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 429' ' ' ASN . . . . . 0.472 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 7.2 t30 -68.2 -39.94 82.3 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 177.072 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 43.2 mt -61.21 -34.12 74.59 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.518 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -63.76 -35.61 81.16 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -72.89 -36.83 67.41 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.567 -0.901 . . . . 10.0 108.567 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -63.59 -48.62 76.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.039 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.75 -42.85 97.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.91 -0.587 . . . . 10.0 110.227 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -63.03 -40.92 99.19 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.92 -44.94 96.66 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 110.405 -1.078 . . . . 10.0 110.405 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 98.1 mt -63.39 -31.32 72.44 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 438' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' C' ' 438' ' ' ARG . 50.1 mtt180 -77.07 -3.45 39.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.089 0.471 . . . . 10.0 110.453 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -111.41 -23.68 10.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.684 -0.858 . . . . 10.0 108.684 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 440' ' ' GLU . . . . . 0.558 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 42.1 mt-10 -91.93 -61.0 1.72 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.927 -1.033 . . . . 10.0 110.494 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 97.4 mmm -62.66 -30.83 71.67 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.952 -0.567 . . . . 10.0 112.459 -178.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.5 p -60.17 -46.04 91.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.127 0.489 . . . . 10.0 109.725 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 443' ' ' LYS . . . . . 0.445 ' O ' ' HB2' ' C' ' 447' ' ' GLU . 88.2 mttt -78.83 -40.79 31.78 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.432 -0.804 . . . . 10.0 109.653 179.163 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 444' ' ' ASP . . . . . 0.493 ' CG ' ' HD3' ' A' ' 330' ' ' ARG . 1.0 OUTLIER -58.15 -52.91 63.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.739 -179.398 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 62.2 mt -58.85 -44.16 90.92 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -68.15 -38.17 81.83 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.7 -0.481 . . . . 10.0 109.7 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 447' ' ' GLU . . . . . 0.53 ' HB3' ' NH2' ' A' ' 330' ' ' ARG . 2.4 mm-40 -61.99 -38.68 89.53 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 178.137 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 32.2 t -66.4 -51.2 60.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-N 115.24 -0.891 . . . . 10.0 109.354 178.33 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -58.09 -48.53 79.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.767 0.318 . . . . 10.0 111.413 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -67.27 -11.78 58.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.184 -0.462 . . . . 10.0 112.031 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 451' ' ' LYS . . . . . 0.488 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 43.3 mttp -108.19 -33.1 7.24 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.025 0.38 . . . . 10.0 112.025 179.357 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 18.9 t -66.21 -37.93 80.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 O-C-N 123.158 0.286 . . . . 10.0 110.653 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -57.38 -60.57 9.33 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 121.011 -0.275 . . . . 10.0 110.742 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 454' ' ' PRO . . . . . 0.4 ' HA ' ' HB3' ' C' ' 457' ' ' ASP . 29.4 Cg_endo -67.06 -24.37 45.13 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 121.679 1.586 . . . . 10.0 111.674 178.38 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 455' ' ' TYR . . . . . 0.553 ' O ' ' HB2' ' C' ' 459' ' ' PHE . 46.3 t80 -69.02 -48.08 63.85 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 109.35 -0.611 . . . . 10.0 109.35 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 24.6 mt -69.41 -27.18 65.06 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.755 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 457' ' ' ASP . . . . . 0.4 ' HB3' ' HA ' ' C' ' 454' ' ' PRO . 6.2 t70 -71.78 -48.89 43.57 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.352 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 458' ' ' ASP . . . . . 0.596 ' HA ' ' HD2' ' C' ' 461' ' ' LYS . 12.2 t70 -65.5 -37.42 86.74 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 459' ' ' PHE . . . . . 0.553 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 0.3 OUTLIER -67.19 -36.56 82.0 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.371 -0.831 . . . . 10.0 109.348 178.256 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -64.8 -39.42 93.56 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.031 -0.729 . . . . 10.0 109.031 178.057 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 461' ' ' LYS . . . . . 0.596 ' HD2' ' HA ' ' C' ' 458' ' ' ASP . 40.6 mttp -60.88 -48.39 82.01 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.699 -0.852 . . . . 10.0 108.699 178.454 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 16.1 mtmm -64.95 -39.24 93.2 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.512 -0.767 . . . . 10.0 110.665 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 463' ' ' TRP . . . . . 0.452 ' HA ' ' CE3' ' C' ' 463' ' ' TRP . 1.3 m95 -62.8 -41.02 99.11 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.102 -0.703 . . . . 10.0 109.102 178.423 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -62.52 -49.89 73.55 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.061 -0.718 . . . . 10.0 109.061 178.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 0.932 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 42.4 mt-10 -55.96 -44.89 78.9 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.356 179.006 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -66.11 -52.78 45.46 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.88 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 88.3 mmm -59.63 -48.07 83.13 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.049 0.388 . . . . 10.0 112.049 -179.291 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -63.96 -46.14 86.0 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.554 -0.536 . . . . 10.0 109.554 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 1.57 HD11 ' CD ' ' A' ' 308' ' ' ARG . 96.4 mt -59.89 -43.23 94.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.623 -0.717 . . . . 20.0 110.659 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 13.0 m-30 -68.49 -36.75 79.38 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.049 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 -63.83 -39.37 94.06 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.329 -0.619 . . . . 10.0 109.329 178.514 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -81.47 10.44 5.8 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.629 -0.714 . . . . 10.0 111.244 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 473' ' ' LYS . . . . . 0.542 ' HG2' HD13 ' A' ' 301' ' ' LEU . 76.8 mttt -124.58 -54.2 1.66 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.281 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 474' ' ' VAL . . . . . 0.437 ' O ' ' HB2' ' C' ' 478' ' ' ARG . 79.2 t -58.15 -43.24 85.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.524 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 475' ' ' GLU . . . . . 0.46 ' HB2' ' CD ' ' C' ' 476' ' ' PRO . 83.1 mt-10 -60.7 -62.18 6.47 Favored Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 120.966 -0.294 . . . . 10.0 111.75 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 476' ' ' PRO . . . . . 0.46 ' CD ' ' HB2' ' C' ' 475' ' ' GLU . 18.2 Cg_endo -60.11 -40.1 63.61 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 121.985 1.79 . . . . 10.0 112.057 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 477' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' C' ' 477' ' ' LEU . 26.0 mt -65.31 -43.91 89.53 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.45 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 478' ' ' ARG . . . . . 0.437 ' HB2' ' O ' ' C' ' 474' ' ' VAL . 38.6 mtt180 -62.38 -39.84 94.5 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 109.665 -0.495 . . . . 10.0 109.665 179.026 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -63.92 -48.54 76.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.039 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -66.53 -39.83 88.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.489 179.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 23.1 mt -67.47 -32.03 72.59 Favored 'General case' 0 C--O 1.219 -0.552 0 N-CA-C 109.585 -0.524 . . . . 10.0 109.585 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 482' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 0.7 OUTLIER -67.72 -46.95 70.72 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.55 -0.537 . . . . 10.0 109.55 178.711 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -65.32 -40.51 93.81 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -66.64 -35.58 90.08 Favored Glycine 0 N--CA 1.445 -0.714 0 N-CA-C 110.646 -0.982 . . . . 10.0 110.646 178.28 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 485' ' ' ALA . . . . . 0.427 ' O ' ' HG ' ' C' ' 489' ' ' LEU . . . -71.77 -36.78 70.47 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 109.071 -0.715 . . . . 10.0 109.071 178.508 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -66.35 -37.4 85.23 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -66.06 -42.65 89.17 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 107.91 -1.144 . . . . 10.0 107.91 176.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 488' ' ' LYS . . . . . 0.471 ' HE2' HD11 ' C' ' 492' ' ' LEU . 76.5 tttt -65.11 -39.43 93.11 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.596 178.377 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 489' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' C' ' 485' ' ' ALA . 58.5 mt -63.38 -46.63 85.59 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.164 -0.68 . . . . 10.0 109.164 178.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -60.92 -41.39 96.09 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 108.968 -0.753 . . . . 10.0 108.968 178.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 491' ' ' GLU . . . . . 0.694 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 30.8 mt-10 -59.65 -53.2 60.8 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 177.64 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 492' ' ' LEU . . . . . 0.471 HD11 ' HE2' ' C' ' 488' ' ' LYS . 84.2 mt -56.27 -43.63 78.97 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.908 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -61.96 -51.47 67.96 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.95 -0.389 . . . . 10.0 109.95 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -70.66 -8.64 53.4 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.949 0.722 . . . . 10.0 112.949 -178.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.979 ' HG2' HD22 ' A' ' 279' ' ' LEU . 13.2 mttm -102.13 -49.97 3.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.96 0.409 . . . . 10.0 110.047 178.58 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 85.3 mt -71.3 -19.75 62.29 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.972 0.73 . . . . 10.0 112.972 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 68.4 m -71.73 -60.9 2.25 Favored Pre-proline 0 C--N 1.329 -0.29 0 C-N-CA 120.563 -0.455 . . . . 10.0 111.113 178.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -63.38 -37.54 48.85 Favored 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 121.835 1.69 . . . . 10.0 110.851 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 40.8 mt -72.04 -29.73 64.45 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 116.345 -0.389 . . . . 10.0 109.994 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -69.71 -46.82 52.17 Favored Glycine 0 N--CA 1.449 -0.47 0 N-CA-C 110.212 -1.155 . . . . 10.0 110.212 178.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -61.45 -42.2 98.4 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.312 -0.996 . . . . 10.0 108.312 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.64 -44.91 92.47 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 114.955 -1.021 . . . . 10.0 109.882 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 503' ' ' MET . . . . . 0.438 ' SD ' ' HD2' ' C' ' 506' ' ' ARG . 47.4 mmm -61.79 -34.31 75.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.706 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -68.97 -38.33 79.32 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.693 -0.484 . . . . 10.0 109.693 178.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.0 -30.14 61.07 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.932 -0.766 . . . . 10.0 108.932 178.027 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.438 ' HD2' ' SD ' ' C' ' 503' ' ' MET . 38.8 mtt180 -64.64 -46.02 84.35 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 107.056 -1.461 . . . . 10.0 107.056 176.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -62.18 -39.07 91.46 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 114.812 -1.085 . . . . 10.0 108.989 178.305 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 508' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' C' ' 512' ' ' ASP . 43.0 mtt180 -61.78 -54.16 46.18 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.849 -0.797 . . . . 10.0 108.849 178.065 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 509' ' ' ALA . . . . . 0.403 ' HB1' ' CD ' ' A' ' 264' ' ' LYS . . . -61.81 -22.42 65.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.349 -0.841 . . . . 10.0 112.766 -179.529 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -95.24 -52.12 4.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.58 0.229 . . . . 10.0 111.389 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 96.6 t -67.18 -44.26 87.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.46 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.521 ' HB2' ' O ' ' C' ' 508' ' ' ARG . 7.3 m-20 -64.87 -33.59 76.37 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.18 -47.29 77.47 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 107.136 -1.431 . . . . 10.0 107.136 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 514' ' ' LEU . . . . . 0.523 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 75.8 mt -61.15 -36.62 80.29 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.177 178.596 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -62.12 -23.35 66.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.963 0.411 . . . . 10.0 109.965 178.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 1.6 m -113.24 8.31 18.1 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.454 0.645 . . . . 10.0 110.236 179.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 517' ' ' HIS . . . . . 0.532 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 44.3 m170 -118.15 -47.2 2.58 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.207 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 76.2 mt -82.45 -29.43 30.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.886 -0.597 . . . . 10.0 111.247 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -60.1 -57.86 23.61 Favored Pre-proline 0 C--N 1.331 -0.216 0 C-N-CA 121.094 -0.243 . . . . 10.0 111.009 179.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -66.83 -27.7 43.69 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 121.242 1.294 . . . . 10.0 110.367 178.129 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 521' ' ' TYR . . . . . 0.532 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 34.7 t80 -65.51 -45.25 84.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.226 179.692 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 4.4 p -70.25 -34.54 72.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.859 0.361 . . . . 10.0 110.06 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 523' ' ' ASP . . . . . 0.421 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 0.4 OUTLIER -67.33 -45.53 76.14 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 178.752 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -61.41 -45.54 93.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.442 -0.947 . . . . 10.0 108.442 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 16.2 mt -61.58 -32.81 72.93 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.506 -0.77 . . . . 10.0 110.726 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 526' ' ' ARG . . . . . 0.421 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 37.7 mtt180 -64.1 -43.06 96.52 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 110.135 -0.32 . . . . 10.0 110.135 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -67.74 -44.35 77.75 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.994 -0.743 . . . . 10.0 108.994 178.575 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 528' ' ' ARG . . . . . 0.645 ' HB3' ' NH2' ' C' ' 532' ' ' ARG . 77.9 mtt180 -61.61 -43.17 99.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.924 -1.034 . . . . 10.0 110.739 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 57.2 mt -69.03 -35.48 76.67 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 116.176 -0.466 . . . . 10.0 110.203 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 530' ' ' ALA . . . . . 0.466 ' O ' ' HG3' ' C' ' 534' ' ' GLU . . . -63.13 -47.88 80.88 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.591 -0.522 . . . . 10.0 109.591 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -61.92 -40.23 94.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.717 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 532' ' ' ARG . . . . . 0.645 ' NH2' ' HB3' ' C' ' 528' ' ' ARG . 1.3 mtm180 -66.73 -40.49 88.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.497 -0.774 . . . . 10.0 110.168 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 17.2 mt -62.46 -40.8 97.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.129 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 534' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' C' ' 530' ' ' ALA . 40.1 mt-10 -63.77 -39.44 94.26 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.845 -0.428 . . . . 10.0 109.845 178.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -66.13 -40.61 90.78 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 97.3 mt -68.67 -33.43 73.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.262 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -77.06 -37.01 55.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.431 -0.349 . . . . 10.0 111.205 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -64.16 -53.35 50.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.114 0.483 . . . . 10.0 109.706 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -72.75 -32.75 65.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.474 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.43 -45.33 86.49 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.863 -0.684 . . . . 10.0 111.426 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -63.31 -35.64 92.33 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 110.72 -0.952 . . . . 10.0 110.72 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -70.49 -46.02 64.52 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.754 -0.832 . . . . 10.0 108.754 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 48.2 mtt85 -59.81 -36.66 77.21 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.73 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 74.1 mt -60.77 -41.82 96.24 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.605 -0.517 . . . . 10.0 109.605 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.98 -46.49 71.19 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 546' ' ' GLU . . . . . 0.646 ' O ' ' HD2' ' C' ' 550' ' ' LYS . 0.2 OUTLIER -58.22 -47.82 82.3 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.503 -0.771 . . . . 10.0 110.151 178.56 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -61.45 -40.91 96.22 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 116.345 -0.388 . . . . 10.0 110.494 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -63.32 -39.48 94.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.909 0.385 . . . . 10.0 110.177 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 549' ' ' ALA . . . . . 0.514 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -66.99 -46.47 74.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.374 178.44 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 550' ' ' LYS . . . . . 0.646 ' HD2' ' O ' ' C' ' 546' ' ' GLU . 0.0 OUTLIER -63.42 -36.71 84.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.144 178.716 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.93 -38.22 90.27 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.588 -0.893 . . . . 10.0 108.588 178.085 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 91.3 m -65.41 -44.55 87.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.474 -0.785 . . . . 10.0 108.895 178.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 553' ' ' GLU . . . . . 0.514 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 29.4 mt-10 -63.43 -41.11 98.68 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.332 -0.618 . . . . 10.0 109.332 178.424 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -63.85 -42.64 97.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.778 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 49.3 mt -65.61 -38.24 88.88 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 18.1 m -67.57 -38.45 84.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.388 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 2.9 p -78.29 -9.56 59.29 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.153 0.502 . . . . 10.0 110.162 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 19.4 mt -90.77 -25.33 20.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.785 -0.643 . . . . 10.0 109.434 178.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.9 m -60.89 -37.89 83.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.047 -0.524 . . . . 10.0 109.948 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 560' ' ' GLU . . . . . 0.42 ' O ' ' HG2' ' C' ' 564' ' ' PRO . 0.5 OUTLIER -74.79 0.52 15.13 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.583 179.638 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 561' ' ' LYS . . . . . 0.491 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 12.5 mptt -117.2 -45.83 2.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.015 0.436 . . . . 10.0 110.521 179.005 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -75.47 -8.76 57.56 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.101 -0.5 . . . . 10.0 112.151 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 563' ' ' LYS . . . . . 0.561 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 61.4 mttm -113.62 -75.73 0.01 OUTLIER Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 113.043 0.757 . . . . 10.0 113.043 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 564' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 30.4 Cg_endo -65.86 -45.16 6.64 Favored 'Trans proline' 0 C--N 1.357 0.989 0 C-N-CA 121.404 1.403 . . . . 10.0 112.355 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 565' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -64.79 -40.98 96.13 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.487 0.184 . . . . 10.0 111.275 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -40.76 96.78 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.863 -0.421 . . . . 10.0 109.863 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 567' ' ' GLU . . . . . 0.584 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 31.7 mm-40 -67.84 -35.52 78.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.998 178.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -66.46 -43.94 84.12 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.749 -0.834 . . . . 10.0 108.749 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.44 -42.97 97.22 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.647 178.192 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 570' ' ' ARG . . . . . 0.414 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 65.0 mtt180 -63.88 -42.52 97.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.052 178.798 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 571' ' ' GLN . . . . . 0.584 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.5 mt-30 -64.93 -21.96 66.91 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.571 -0.741 . . . . 20.0 111.794 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -89.39 -42.15 5.59 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 109.556 -1.418 . . . . 10.0 109.556 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 54.1 mt -59.25 -41.17 88.15 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.068 0.396 . . . . 10.0 112.068 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 574' ' ' LEU . . . . . 0.433 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 87.9 mt -51.61 -64.38 1.47 Allowed Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 112.716 0.635 . . . . 10.0 112.716 -179.477 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 575' ' ' PRO . . . . . 0.433 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 36.2 Cg_endo -65.46 -32.15 50.11 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.773 1.649 . . . . 10.0 111.964 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 12.1 t -64.41 -48.02 86.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.649 -0.25 . . . . 10.0 110.527 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 49.1 mt -62.24 -37.45 85.48 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.461 -0.57 . . . . 10.0 109.461 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 578' ' ' GLU . . . . . 0.447 ' O ' HG23 ' C' ' 582' ' ' VAL . 2.9 mm-40 -62.75 -49.1 76.34 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.758 -0.656 . . . . 10.0 109.919 178.534 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 37.3 m -64.34 -37.39 87.33 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.396 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -66.52 -40.16 89.02 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.223 -0.658 . . . . 10.0 109.223 178.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 78.1 mttt -61.11 -43.88 98.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.157 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 582' ' ' VAL . . . . . 0.447 HG23 ' O ' ' C' ' 578' ' ' GLU . 97.4 t -59.86 -45.1 95.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 121.197 0.522 . . . . 10.0 109.926 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 9.5 m -68.25 -35.61 78.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.417 -0.81 . . . . 10.0 111.109 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 584' ' ' PHE . . . . . 0.464 ' O ' ' HG ' ' C' ' 588' ' ' LEU . 4.6 m-85 -72.24 -47.0 53.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.234 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 52.0 mt -58.94 -45.38 90.55 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.828 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 586' ' ' SER . . . . . 0.562 ' O ' ' HG3' ' C' ' 590' ' ' GLU . 9.4 p -63.24 -46.73 85.57 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.568 -0.53 . . . . 10.0 109.568 178.784 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -56.18 -45.74 79.64 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.89 179.483 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 588' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' C' ' 584' ' ' PHE . 97.2 mt -55.67 -54.14 47.91 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.277 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -62.34 -46.83 86.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 10.0 111.7 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 590' ' ' GLU . . . . . 0.562 ' HG3' ' O ' ' C' ' 586' ' ' SER . 45.7 mt-10 -59.0 -47.95 83.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.463 -179.353 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -66.32 -43.13 87.03 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.296 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 35.9 m -61.47 -35.91 78.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.743 0.306 . . . . 10.0 111.014 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 593' ' ' LYS . . . . . 0.506 ' HE3' ' HA ' ' C' ' 590' ' ' GLU . 42.8 mtmt -64.99 -34.62 78.87 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.952 0.352 . . . . 10.0 111.952 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 594' ' ' LYS . . . . . 0.414 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 89.0 mttt -92.95 -14.17 27.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.966 0.412 . . . . 10.0 111.776 -179.362 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 94.0 mt -106.91 34.93 3.2 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.295 0.569 . . . . 10.0 110.16 179.004 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 60.8 t30 . . . . . 0 C--O 1.246 0.886 0 CA-C-O 118.49 -0.767 . . . . 10.0 110.502 -179.649 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 2.9 m . . . . . 0 N--CA 1.451 -0.404 0 CA-C-O 120.758 0.313 . . . . 10.0 110.421 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 3' ' ' GLU . . . . . 0.402 ' HA ' ' O ' ' B' ' 52' ' ' LEU . 28.7 tt0 -108.18 132.9 53.15 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.748 -179.548 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -117.29 142.89 46.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.658 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.417 ' HD3' ' HB3' ' B' ' 54' ' ' ASP . 50.8 mmtt -101.92 113.43 26.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.518 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.565 HD22 HD23 ' B' ' 159' ' ' LEU . 33.4 mt -112.13 125.97 54.69 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.522 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 59.2 t -110.13 122.81 65.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 120.941 -0.303 . . . . 10.0 110.504 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.594 HG12 ' HD2' ' B' ' 16' ' ' LYS . 59.5 t -102.18 108.86 24.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.357 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 9.6 m -109.57 153.53 11.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.543 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 168.76 168.72 31.23 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 111.227 -0.749 . . . . 10.0 111.227 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.418 ' O ' HG22 ' B' ' 14' ' ' VAL . . . -74.2 155.92 37.83 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.253 0.549 . . . . 10.0 111.545 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -66.13 119.3 12.81 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.672 -0.694 . . . . 10.0 111.788 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 124.43 -20.4 6.98 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.706 -0.759 . . . . 10.0 112.605 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 14' ' ' VAL . . . . . 0.418 HG22 ' O ' ' B' ' 11' ' ' ALA . 35.6 m -65.28 -24.64 35.47 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -179.341 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.34 45.83 3.96 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.569 -0.824 . . . . 10.0 113.568 178.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 16' ' ' LYS . . . . . 0.594 ' HD2' HG12 ' B' ' 8' ' ' VAL . 4.3 mtmp? -65.12 -44.0 90.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.668 0.27 . . . . 10.0 110.79 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.84 -46.91 84.07 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.084 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.83 -47.75 83.75 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.779 -0.646 . . . . 10.0 111.346 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 25.1 mt -57.68 -46.73 83.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.432 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' THR . . . . . 0.487 ' O ' HG12 ' B' ' 24' ' ' ILE . 1.4 m -68.64 -47.75 65.8 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.083 -0.508 . . . . 10.0 112.198 -179.356 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 88.6 mt -62.24 -31.77 52.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-O 120.806 0.336 . . . . 10.0 111.077 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.483 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 60.2 tp60 -66.3 -28.11 68.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.112 0.482 . . . . 10.0 110.581 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 29.4 tp -86.64 -33.86 19.98 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.934 0.397 . . . . 10.0 110.658 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' ILE . . . . . 0.487 HG12 ' O ' ' B' ' 20' ' ' THR . 46.3 mm -73.0 -78.36 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 112.421 0.526 . . . . 10.0 112.421 -179.234 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -98.42 -1.05 42.36 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.058 0.392 . . . . 10.0 112.058 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.483 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 4.0 t30 60.55 55.29 3.45 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.214 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -135.72 123.72 22.8 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.761 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -80.88 133.95 35.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.301 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 23.7 m -85.94 166.98 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.54 -0.3 . . . . 10.0 110.482 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -133.58 -17.19 2.28 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.364 0.602 . . . . 10.0 110.898 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 17.0 pm0 -97.68 165.52 11.93 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.464 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -83.23 96.77 8.56 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 178.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -69.54 112.86 13.41 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.78 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -78.88 54.41 5.12 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.894 2.396 . . . . 10.0 111.919 -179.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -56.75 133.38 54.09 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.057 -0.974 . . . . 10.0 112.098 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.839 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 79.6 mt -126.34 -53.98 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 178.627 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.411 ' HB3' HG23 ' D' ' 821' ' ' VAL . 1.7 tm-20 -154.61 95.01 1.74 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.126 -0.943 . . . . 10.0 108.745 178.711 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -140.21 124.22 17.54 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.693 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.92 150.05 23.91 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.723 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 40' ' ' TYR . . . . . 0.409 ' HB3' HG13 ' B' ' 24' ' ' ILE . 97.9 m-85 -131.42 121.74 25.1 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 41' ' ' ARG . . . . . 0.759 HH11 HD21 ' B' ' 52' ' ' LEU . 28.8 ttp85 -118.14 126.5 52.34 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.727 0.298 . . . . 10.0 111.585 -178.422 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 52.7 tttt -140.92 161.95 36.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.5 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -120.77 127.09 51.64 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 110.11 -0.33 . . . . 10.0 110.11 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 7.3 m -138.83 169.22 18.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.966 0.412 . . . . 10.0 111.021 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 42.2 t -102.66 111.22 31.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 179.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 46' ' ' ILE . . . . . 0.407 HD11 HD11 ' B' ' 53' ' ' LEU . 32.7 mt -111.14 110.73 33.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.919 -178.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 61.65 38.96 14.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.698 -0.683 . . . . 10.0 111.941 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.6 -15.07 56.5 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.832 -0.622 . . . . 10.0 113.816 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -104.36 130.45 52.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 117.118 0.459 . . . . 10.0 111.331 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 1.2 t -75.53 127.68 33.63 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 73.8 m -137.0 139.71 41.62 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-O 121.14 0.495 . . . . 10.0 111.726 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.759 HD21 HH11 ' B' ' 41' ' ' ARG . 46.0 tp -95.27 121.04 36.51 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 107.609 -1.256 . . . . 10.0 107.609 178.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.407 HD11 HD11 ' B' ' 46' ' ' ILE . 88.0 mt -108.31 119.83 40.62 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 112.331 0.493 . . . . 10.0 112.331 -178.326 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.417 ' HB3' ' HD3' ' B' ' 5' ' ' LYS . 30.6 t70 -108.49 98.74 8.22 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.117 -1.068 . . . . 10.0 108.117 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 10.1 mt -90.57 127.12 43.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.477 -0.783 . . . . 10.0 111.369 -178.031 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.4 ' HG ' HG23 ' B' ' 58' ' ' THR . 61.1 tp -102.43 111.74 24.17 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.303 179.473 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -104.5 103.07 12.7 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.861 -0.608 . . . . 10.0 109.507 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 58' ' ' THR . . . . . 0.484 HG21 ' CE1' ' B' ' 71' ' ' TYR . 11.4 p -105.36 171.58 7.25 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.04 -0.527 . . . . 10.0 112.383 -178.796 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 59' ' ' ALA . . . . . 0.839 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -61.96 145.75 52.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 10.0 112.06 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -108.74 25.54 18.83 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.62 -0.718 . . . . 10.0 111.4 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -136.0 34.88 2.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.055 0.455 . . . . 20.0 111.756 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.414 ' OE1' ' HD2' ' B' ' 68' ' ' ARG . 21.0 mt-10 -96.99 143.39 27.89 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.289 179.434 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -84.78 -74.18 0.4 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.387 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -158.38 87.32 0.9 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.167 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -105.55 141.19 37.45 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.866 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.34 -35.36 79.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.031 0.443 . . . . 10.0 110.28 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 50.3 ttp -62.76 -39.44 94.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.846 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.599 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 46.5 ttt85 -65.89 -46.6 77.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.132 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.533 ' O ' ' HG3' ' B' ' 73' ' ' ARG . 13.6 t70 -55.59 -44.46 76.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.717 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -64.34 -48.65 74.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.781 -0.645 . . . . 10.0 112.377 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 71' ' ' TYR . . . . . 0.599 ' CE2' ' HA ' ' B' ' 68' ' ' ARG 0.256 0.5 OUTLIER -70.78 -19.6 62.69 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.527 0.936 . . . . 10.0 113.527 -178.795 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' B' B ' 72' ' ' MET . . . . . 0.417 ' HB3' HG21 ' B' ' 103' ' ' VAL . 40.7 mmm -74.45 -24.24 59.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.181 0.515 . . . . 10.0 110.081 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 73' ' ' ARG . . . . . 0.533 ' HG3' ' O ' ' B' ' 69' ' ' ASP . 89.8 mtt180 -73.47 -30.75 63.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.5 -179.515 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.3 -5.2 43.45 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.979 0.733 . . . . 10.0 112.979 -179.251 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -87.87 130.78 10.26 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.383 -0.913 . . . . 10.0 111.799 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -80.94 -65.02 1.07 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.743 0.306 . . . . 10.0 110.275 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -103.18 147.75 16.96 Favored Glycine 0 N--CA 1.446 -0.7 0 N-CA-C 111.046 -0.822 . . . . 10.0 111.046 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -123.79 136.22 54.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.268 0.556 . . . . 10.0 111.909 -179.163 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.806 ' HG ' HD22 ' B' ' 159' ' ' LEU . 79.8 mt -107.61 120.45 42.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.316 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 18.2 m -92.69 88.7 6.37 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 27.3 t -88.1 116.03 29.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.987 -0.551 . . . . 10.0 112.048 -178.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.679 ' HB3' HD11 ' B' ' 93' ' ' ILE . 15.6 p90 -129.11 159.68 35.22 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.558 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -96.97 132.37 42.83 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 110.129 -0.323 . . . . 10.0 110.129 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 84' ' ' ILE . . . . . 0.549 ' CD1' ' HA ' ' B' ' 118' ' ' CYS . 2.5 pt -68.3 -10.94 13.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.91 0.386 . . . . 10.0 111.442 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 85' ' ' ASN . . . . . 0.409 ' HB3' ' HB2' ' B' ' 122' ' ' SER . 0.0 OUTLIER -104.25 5.47 34.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.434 179.946 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -124.3 104.44 8.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.172 0.511 . . . . 10.0 110.306 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.46 -34.57 78.06 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.579 -0.737 . . . . 10.0 111.875 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -60.55 -41.54 94.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.863 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 89' ' ' SER . . . . . 0.422 ' O ' HG12 ' B' ' 93' ' ' ILE . 11.2 m -63.42 -37.95 89.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.43 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 90' ' ' PHE . . . . . 0.498 ' HE1' ' HA ' ' B' ' 130' ' ' ALA . 65.5 t80 -64.98 -35.43 81.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.022 0.439 . . . . 10.0 110.766 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -80.37 -32.72 37.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.063 0.459 . . . . 10.0 110.574 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -73.91 -7.47 52.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.772 -0.649 . . . . 10.0 112.034 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 93' ' ' ILE . . . . . 0.679 HD11 ' HB3' ' B' ' 82' ' ' PHE . 23.8 mm -58.91 -37.9 69.9 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 CA-C-O 121.148 0.499 . . . . 10.0 109.985 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 16.0 t-80 -64.0 -33.46 75.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.196 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -62.77 -42.65 99.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.802 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 96' ' ' TYR . . . . . 0.416 ' CD2' ' HA ' ' B' ' 93' ' ' ILE . 19.0 m-85 -64.38 -44.79 90.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.084 -0.507 . . . . 10.0 109.695 179.04 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 97' ' ' ARG . . . . . 0.481 ' HD2' ' SD ' ' B' ' 111' ' ' MET . 10.8 tpt180 -56.67 -48.41 77.68 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.309 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -66.39 -41.55 89.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.447 -0.342 . . . . 10.0 111.614 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -60.67 -45.86 92.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.942 0.401 . . . . 10.0 110.691 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 100' ' ' ILE . . . . . 0.465 ' HA ' HG22 ' B' ' 103' ' ' VAL . 54.3 mt -65.79 -40.89 88.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.802 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 101' ' ' LYS . . . . . 0.641 ' HG2' ' HA ' ' B' ' 107' ' ' GLU . 39.3 mtpt -58.15 -37.18 74.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.004 -0.543 . . . . 10.0 111.259 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 59.8 ttp85 -76.98 -47.65 20.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.018 -0.537 . . . . 10.0 112.407 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.465 HG22 ' HA ' ' B' ' 100' ' ' ILE . 32.7 m -66.85 -30.1 48.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 N-CA-C 112.654 0.612 . . . . 10.0 112.654 -178.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.427 ' HA ' ' HD2' ' B' ' 104' ' ' LYS . 10.7 mmmm -91.72 -12.51 33.78 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 121.112 -0.235 . . . . 10.0 111.382 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 28.0 t0 60.0 34.8 21.5 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.696 0.76 . . . . 10.0 110.971 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 42.9 m -156.43 147.16 21.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.736 -0.665 . . . . 10.0 109.858 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 107' ' ' GLU . . . . . 0.641 ' HA ' ' HG2' ' B' ' 101' ' ' LYS . 20.7 mp0 -93.88 -26.67 16.8 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.972 0.415 . . . . 10.0 110.503 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -94.0 77.18 4.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.69 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 57.8 t -120.06 133.38 23.93 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.749 -0.659 . . . . 10.0 110.081 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 110' ' ' PRO . . . . . 0.488 ' HB3' ' HB3' ' B' ' 162' ' ' GLU . 32.4 Cg_exo -59.55 114.97 2.28 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.843 2.362 . . . . 10.0 112.324 179.6 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 111' ' ' MET . . . . . 0.481 ' SD ' ' HD2' ' B' ' 97' ' ' ARG . 41.1 mtt -136.71 156.5 48.45 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.386 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 112' ' ' VAL . . . . . 0.531 ' HB ' HD23 ' B' ' 79' ' ' LEU . 87.0 t -135.38 132.38 52.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 110.049 -0.352 . . . . 10.0 110.049 179.134 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 19.9 tp -84.53 121.89 28.23 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.381 -0.6 . . . . 10.0 109.381 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 47.7 t -117.11 115.13 47.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.031 0.443 . . . . 10.0 111.769 -178.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.69 97.25 1.76 Allowed Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 110.49 -1.044 . . . . 10.0 110.49 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -87.28 161.41 18.0 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.853 0.359 . . . . 10.0 111.925 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 91.4 mttt 69.54 35.18 2.56 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.336 -0.847 . . . . 10.0 112.148 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 118' ' ' CYS . . . . . 0.549 ' HA ' ' CD1' ' B' ' 84' ' ' ILE . 29.1 p -74.33 -12.97 60.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.479 -0.328 . . . . 10.0 111.797 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -81.39 -20.64 40.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.398 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 73.7 mt -67.92 142.42 95.44 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.013 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -61.66 -32.36 86.92 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.914 2.409 . . . . 10.0 111.947 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 122' ' ' SER . . . . . 0.409 ' HB2' ' HB3' ' B' ' 85' ' ' ASN . 0.1 OUTLIER -73.87 118.7 17.14 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.33 179.596 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 18.0 ttt180 -141.93 115.47 9.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.806 0.336 . . . . 10.0 111.094 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.56 -24.78 11.64 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.571 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 38.5 t -104.34 114.29 43.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.56 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 126' ' ' ASP . . . . . 0.526 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 13.8 t70 -75.61 152.42 37.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.676 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.2 m -56.75 -42.29 79.04 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.838 -0.619 . . . . 10.0 112.094 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -64.91 -44.7 88.68 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 121.256 -0.178 . . . . 10.0 111.294 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 129' ' ' GLN . . . . . 0.526 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 38.0 mt-30 -58.16 -45.97 86.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.851 0.357 . . . . 10.0 110.805 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 130' ' ' ALA . . . . . 0.498 ' HA ' ' HE1' ' B' ' 90' ' ' PHE . . . -67.6 -44.94 76.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.307 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -62.7 -39.79 95.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.847 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -61.7 -41.29 97.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.342 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 37.8 tp -64.78 -44.19 90.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.009 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.22 -43.98 97.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.184 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -60.35 -36.5 78.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.803 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 20.6 m -66.65 -30.42 70.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.688 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -85.82 -18.18 33.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.582 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.64 28.94 28.12 Favored Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 111.259 -0.736 . . . . 10.0 111.259 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 139' ' ' ILE . . . . . 0.415 ' HB ' ' HD2' ' B' ' 140' ' ' PRO . 50.4 pt -128.19 159.07 69.04 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.723 -0.238 . . . . 10.0 110.444 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 140' ' ' PRO . . . . . 0.415 ' HD2' ' HB ' ' B' ' 139' ' ' ILE . 90.2 Cg_endo -82.83 158.36 15.98 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 122.569 2.179 . . . . 10.0 112.42 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -119.07 124.38 46.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.398 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 23.0 mm -119.13 121.42 66.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.947 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 143' ' ' GLU . . . . . 0.404 ' HG2' ' CB ' ' B' ' 118' ' ' CYS . 6.7 tt0 -85.24 123.6 30.92 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.676 -1.231 . . . . 10.0 107.676 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 70.1 p -130.09 170.45 14.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.783 0.801 . . . . 10.0 113.073 -176.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 8.7 t -155.44 108.16 2.71 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.672 -1.149 . . . . 10.0 108.495 178.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -66.15 -24.94 66.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.739 0.304 . . . . 10.0 111.611 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 23.1 ttpp -74.85 -35.28 62.38 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.123 0.416 . . . . 10.0 112.123 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 69.6 p -100.68 -7.46 23.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.942 0.401 . . . . 10.0 111.156 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 149' ' ' ARG . . . . . 0.421 HH12 ' CG ' ' B' ' 153' ' ' ASP . 1.8 ttt-85 67.07 23.3 9.71 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 115.588 -0.733 . . . . 10.0 111.781 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -90.08 127.42 36.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.395 -0.366 . . . . 10.0 111.541 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 75.11 -4.85 37.02 Favored Glycine 0 CA--C 1.52 0.362 0 N-CA-C 114.635 0.614 . . . . 10.0 114.635 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 65.6 t -55.61 -60.91 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 117.1 0.45 . . . . 10.0 111.88 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 153' ' ' ASP . . . . . 0.421 ' CG ' HH12 ' B' ' 149' ' ' ARG . 0.1 OUTLIER -66.88 -34.01 76.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.974 0.416 . . . . 10.0 110.597 -179.51 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -59.76 -43.35 94.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.696 -0.684 . . . . 10.0 111.383 -179.066 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -59.64 -45.4 92.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.671 179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 156' ' ' PHE . . . . . 0.4 ' O ' HG23 ' B' ' 160' ' ' VAL . 55.8 m-85 -64.52 -43.99 92.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.806 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -59.88 -40.66 89.46 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.915 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 18.4 m -62.99 -43.07 99.81 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.789 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.806 HD22 ' HG ' ' B' ' 79' ' ' LEU . 39.6 tp -60.66 -44.11 96.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.42 . . . . 10.0 111.128 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 160' ' ' VAL . . . . . 0.4 HG23 ' O ' ' B' ' 156' ' ' PHE . 58.1 t -61.9 -38.53 80.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.181 0.515 . . . . 10.0 110.332 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -67.09 -33.66 75.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.177 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 162' ' ' GLU . . . . . 0.488 ' HB3' ' HB3' ' B' ' 110' ' ' PRO . 42.2 mm-40 -68.07 -40.61 82.68 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 109.763 -0.458 . . . . 10.0 109.763 178.521 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 81.2 mt -62.62 -45.5 98.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.341 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 76.0 mtt180 -61.03 -46.75 89.47 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.671 -0.695 . . . . 10.0 109.709 178.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -54.4 -47.53 72.62 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.674 -0.693 . . . . 10.0 111.42 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -64.65 -45.84 85.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.205 0.446 . . . . 10.0 112.205 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -66.96 -40.31 87.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.264 -0.425 . . . . 10.0 112.098 -179.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -65.6 -43.66 88.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.957 0.408 . . . . 10.0 110.351 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.7 tttm -60.23 -44.58 95.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.024 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 77.0 mtp -66.17 -31.92 73.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.416 -0.356 . . . . 10.0 111.783 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 22.0 m . . . . . 0 C--N 1.326 -0.42 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.679 -179.545 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 111.779 -0.528 . . . . 10.0 111.779 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 9.3 p -123.79 133.68 53.78 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.598 -0.301 . . . . 10.0 110.561 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 8.8 t -123.45 135.44 63.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.282 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 811' ' ' LYS . . . . . 0.818 ' HB3' HG22 ' D' ' 821' ' ' VAL . 13.9 pttp -99.99 116.5 32.17 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.073 0.463 . . . . 10.0 111.112 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 812' ' ' VAL . . . . . 0.767 HG11 HD11 ' D' ' 834' ' ' LEU . 32.2 t -96.11 133.36 37.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.571 -179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.06 134.22 35.33 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.795 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 47.1 mt -99.71 150.28 36.67 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.132 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -67.75 0.64 4.02 Favored 'Trans proline' 0 CA--C 1.534 0.485 0 C-N-CA 122.999 2.466 . . . . 10.0 113.069 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -98.03 17.18 18.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.017 0.437 . . . . 10.0 110.076 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 28.1 tttp 66.89 48.35 1.32 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 115.369 -0.832 . . . . 10.0 110.565 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -150.05 -179.32 7.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.497 -0.774 . . . . 10.0 109.508 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.7 160.76 41.81 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.463 -0.199 . . . . 10.0 110.463 178.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 6.6 t -142.61 132.89 24.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.387 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 821' ' ' VAL . . . . . 0.818 HG22 ' HB3' ' D' ' 811' ' ' LYS . 57.1 t -91.82 117.68 35.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.076 0.465 . . . . 10.0 111.593 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 27.4 m -115.06 164.16 11.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.072 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.26 135.5 34.42 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.78 0.324 . . . . 10.0 110.948 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 824' ' ' VAL . . . . . 0.613 HG11 ' HB2' ' D' ' 871' ' ' ASP . 21.3 t -83.04 125.36 40.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 7.6 mtp180 -121.9 151.45 40.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.867 0.365 . . . . 10.0 110.823 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -91.7 37.38 0.96 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.497 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . -143.78 -66.79 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.449 -0.882 . . . . 10.0 113.047 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 828' ' ' MET . . . . . 0.415 ' HB2' ' HB2' ' D' ' 832' ' ' ASP . 11.5 ptm -58.44 155.62 11.7 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 113.072 0.767 . . . . 10.0 113.072 -179.315 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 829' ' ' SER . . . . . 0.857 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.3 OUTLIER -97.06 178.21 5.34 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.59 -0.732 . . . . 10.0 111.136 -179.222 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 79.3 t -60.12 -43.36 92.75 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 109.765 -0.457 . . . . 10.0 109.765 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 831' ' ' TYR . . . . . 0.642 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 34.1 t80 -55.36 -45.2 76.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.278 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 832' ' ' ASP . . . . . 0.415 ' HB2' ' HB2' ' D' ' 828' ' ' MET . 13.1 m-20 -69.16 -48.13 63.11 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.976 -0.557 . . . . 10.0 111.601 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 4.3 m -63.78 -40.32 96.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.88 -179.2 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 834' ' ' LEU . . . . . 0.767 HD11 HG11 ' D' ' 812' ' ' VAL . 3.2 mm? -82.89 -9.52 59.27 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 111.902 0.334 . . . . 10.0 111.902 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -62.61 -51.89 65.52 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 120.622 0.249 . . . . 10.0 110.552 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 13.3 mmmt -60.45 -29.99 69.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.947 -0.569 . . . . 10.0 111.22 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 837' ' ' ALA . . . . . 0.515 ' O ' HG12 ' D' ' 840' ' ' VAL . . . -75.66 -42.62 50.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.167 -0.469 . . . . 10.0 111.085 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 838' ' ' LEU . . . . . 0.742 HD12 ' HG3' ' D' ' 845' ' ' GLN . 30.8 mt -76.14 -41.08 51.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.724 0.297 . . . . 10.0 111.74 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -63.36 -26.27 68.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.431 -0.35 . . . . 10.0 111.259 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 840' ' ' VAL . . . . . 0.515 HG12 ' O ' ' D' ' 837' ' ' ALA . 0.9 OUTLIER -80.52 -17.66 12.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.114 0.483 . . . . 10.0 111.147 -179.545 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' D' D ' 841' ' ' ARG . . . . . 0.426 ' HD3' ' HA ' ' D' ' 841' ' ' ARG . 4.8 mmt180 -106.54 -0.62 23.77 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.37 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 77.5 32.89 45.23 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.762 -0.733 . . . . 10.0 112.105 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 62.5 mt -115.17 161.11 18.87 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.711 0.291 . . . . 10.0 110.745 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -122.38 152.0 40.63 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.112 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 845' ' ' GLN . . . . . 0.742 ' HG3' HD12 ' D' ' 838' ' ' LEU . 19.0 mp0 -78.42 21.5 0.37 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.906 0.706 . . . . 10.0 112.906 -178.549 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 37.4 p-10 -95.4 -40.68 9.38 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.422 0.527 . . . . 10.0 112.422 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 62.1 m -109.04 6.66 25.25 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.901 0.334 . . . . 10.0 111.901 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 36.2 m -106.61 144.75 32.82 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.91 0.386 . . . . 10.0 111.006 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 7.3 p -132.82 137.99 52.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.922 -0.581 . . . . 10.0 109.733 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 850' ' ' VAL . . . . . 0.407 ' O ' HG22 ' D' ' 861' ' ' THR . 18.1 t -99.83 139.49 21.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 120.768 0.318 . . . . 10.0 110.636 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 851' ' ' TYR . . . . . 0.857 ' HB3' ' HB3' ' D' ' 858' ' ' LYS . 65.7 m-85 -119.23 132.62 55.95 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.987 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 852' ' ' ARG . . . . . 0.594 ' HD3' HD11 ' D' ' 870' ' ' LEU . 8.4 mtm180 -79.21 171.37 15.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.351 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 853' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' D' ' 874' ' ' GLU . 0.2 OUTLIER -116.73 96.23 5.39 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.439 179.775 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 33.6 mt -133.36 115.76 23.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.537 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 3.4 mmpt? 63.78 42.38 6.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.663 -0.699 . . . . 10.0 111.681 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 76.66 -31.32 1.46 Allowed Glycine 0 N--CA 1.452 -0.239 0 CA-C-N 115.796 -0.638 . . . . 10.0 113.742 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 857' ' ' ARG . . . . . 0.453 HH11 ' HD3' ' D' ' 857' ' ' ARG . 20.5 mtp180 -91.53 158.4 16.48 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.281 0.562 . . . . 10.0 112.0 -179.166 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 858' ' ' LYS . . . . . 0.857 ' HB3' ' HB3' ' D' ' 851' ' ' TYR . 44.0 mtpt -87.68 148.95 24.55 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.455 -0.793 . . . . 10.0 111.223 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 1.3 m -127.99 137.21 52.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.453 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 860' ' ' VAL . . . . . 0.631 HG22 ' HE1' ' D' ' 851' ' ' TYR . 8.6 t -66.07 130.35 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.688 0.28 . . . . 10.0 111.421 -179.301 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 861' ' ' THR . . . . . 0.407 HG22 ' O ' ' D' ' 850' ' ' VAL . 2.1 t -127.68 160.79 30.58 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.955 -0.387 . . . . 10.0 109.955 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -103.57 159.45 15.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.865 0.364 . . . . 10.0 111.591 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 863' ' ' TRP . . . . . 0.642 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 96.2 m95 -79.0 -30.8 44.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.038 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.61 -29.76 70.97 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.508 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 2.2 m -64.36 145.51 55.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.417 -179.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 866' ' ' ALA . . . . . 0.857 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -73.5 161.83 29.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.118 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 867' ' ' ILE . . . . . 0.549 ' HA ' HD23 ' D' ' 870' ' ' LEU . 6.2 tp -93.98 -1.84 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.088 0.471 . . . . 10.0 111.097 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 868' ' ' ALA . . . . . 0.501 ' HB3' ' HD3' ' D' ' 869' ' ' PRO . . . -54.29 -51.8 74.65 Favored Pre-proline 0 CA--C 1.539 0.546 0 N-CA-C 113.582 0.956 . . . . 10.0 113.582 -179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 869' ' ' PRO . . . . . 0.501 ' HD3' ' HB3' ' D' ' 868' ' ' ALA . 6.0 Cg_exo -79.83 19.34 1.01 Allowed 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 122.466 2.111 . . . . 10.0 113.04 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 870' ' ' LEU . . . . . 0.594 HD11 ' HD3' ' D' ' 852' ' ' ARG . 2.6 mm? -107.64 22.22 16.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.258 0.551 . . . . 10.0 110.741 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 871' ' ' ASP . . . . . 0.613 ' HB2' HG11 ' D' ' 824' ' ' VAL . 10.3 t70 -87.38 108.12 18.84 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.564 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 127.93 -55.25 0.76 Allowed Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.665 -0.779 . . . . 10.0 112.767 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -85.41 172.06 11.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.833 0.349 . . . . 10.0 111.33 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 874' ' ' GLU . . . . . 0.475 ' O ' ' HB2' ' D' ' 853' ' ' LEU . 29.0 mt-10 -118.37 159.2 23.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.253 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 875' ' ' LEU . . . . . 0.419 ' HB2' HG13 ' D' ' 812' ' ' VAL . 24.8 mt -122.9 154.32 38.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.019 0.438 . . . . 10.0 111.875 -178.311 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 876' ' ' ILE . . . . . 0.641 ' HB ' ' HE3' ' D' ' 858' ' ' LYS . 61.1 mt -126.17 122.29 61.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.222 -0.659 . . . . 10.0 109.222 178.402 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 40.3 t -93.18 131.99 38.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.762 0.315 . . . . 10.0 111.146 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.89 162.78 20.38 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.717 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 50.6 t -114.84 133.16 61.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 120.91 0.386 . . . . 10.0 110.652 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 99.2 mt . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.343 -0.837 . . . . 10.0 110.075 179.626 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 33.6 mt . . . . . 0 N--CA 1.452 -0.374 0 N-CA-C 109.986 -0.376 . . . . 10.0 109.986 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 21.6 mtm180 -65.79 -43.1 89.73 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.13 -0.692 . . . . 10.0 109.13 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 43.0 tt0 -64.98 -41.1 95.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.608 -0.724 . . . . 10.0 109.172 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -65.73 -45.78 81.38 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.298 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 243' ' ' MET . . . . . 0.49 ' O ' ' HB2' ' A' ' 247' ' ' LEU . 48.1 mmm -60.4 -48.25 82.58 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.964 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.9 p -59.53 -37.82 79.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.054 0.454 . . . . 10.0 111.236 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 245' ' ' LYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 93.5 mttt -78.61 -59.44 2.78 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.17 179.434 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -56.23 -50.13 72.18 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.983 0.735 . . . . 10.0 112.983 -178.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 243' ' ' MET . 21.4 mt -56.5 -51.59 67.92 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.582 0.23 . . . . 10.0 111.437 -179.41 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -67.65 -33.01 74.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.531 -0.304 . . . . 10.0 111.355 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 249' ' ' GLU . . . . . 0.449 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 0.2 OUTLIER -68.64 -43.5 76.14 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.604 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 48.4 t -67.91 -41.91 85.2 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.409 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.867 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 44.0 mttm -64.28 -42.96 96.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.712 0.291 . . . . 10.0 110.826 179.243 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -64.43 -40.81 96.47 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.109 -0.496 . . . . 10.0 109.945 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 7.7 mtpt -77.93 -21.81 50.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.811 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.46 ' HA ' ' HB2' ' A' ' 257' ' ' TYR . 0.5 OUTLIER -66.55 -26.26 37.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.413 -0.358 . . . . 10.0 110.057 179.349 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 255' ' ' GLN . . . . . 0.505 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 70.8 mt-30 -62.45 -61.79 6.94 Favored Pre-proline 0 N--CA 1.451 -0.408 0 CA-C-N 115.922 -0.581 . . . . 10.0 109.599 178.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 256' ' ' PRO . . . . . 0.505 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 19.7 Cg_endo -62.61 -27.06 76.01 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 121.741 1.627 . . . . 10.0 110.818 177.375 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 257' ' ' TYR . . . . . 0.494 ' HE1' ' CG ' ' C' ' 517' ' ' HIS . 3.9 m-30 -62.13 -60.61 3.35 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.838 -0.801 . . . . 10.0 108.838 178.114 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 86.5 mt -64.3 -35.01 79.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.915 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -64.55 -55.08 22.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.543 -0.299 . . . . 10.0 110.548 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -64.3 -42.05 96.55 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.325 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 261' ' ' PHE . . . . . 0.481 ' O ' ' HB2' ' A' ' 265' ' ' TRP . 4.7 m-30 -62.04 -38.69 89.68 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.422 -0.354 . . . . 10.0 110.122 178.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -67.81 -43.2 80.19 Favored 'General case' 0 C--O 1.22 -0.471 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -58.99 -49.34 78.26 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.767 ' HE3' ' HB1' ' C' ' 509' ' ' ALA . 14.6 mptt -63.94 -55.28 23.68 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.734 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 265' ' ' TRP . . . . . 0.481 ' HB2' ' O ' ' A' ' 261' ' ' PHE . 0.0 OUTLIER -58.22 -39.97 80.45 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.049 0.388 . . . . 10.0 112.049 -179.324 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 266' ' ' GLN . . . . . 0.46 ' O ' ' HG3' ' A' ' 270' ' ' GLU . 43.0 tt0 -63.47 -47.45 81.72 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -64.44 -44.66 90.44 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.724 -0.473 . . . . 10.0 109.724 178.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 268' ' ' GLU . . . . . 0.506 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 48.3 mt-10 -61.11 -38.05 84.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.653 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 14.9 ttt -70.56 -46.27 63.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.061 179.168 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 270' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 266' ' ' GLN . 40.8 mt-10 -63.84 -45.91 87.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.472 179.269 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 74.3 mt -63.47 -29.99 71.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.004 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 272' ' ' TYR . . . . . 0.506 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 0.1 OUTLIER -73.77 -45.98 48.45 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.103 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -61.62 -37.66 84.76 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.343 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -62.92 -20.4 65.15 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.216 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.584 ' O ' ' HB2' ' A' ' 279' ' ' LEU . 51.5 mttp -99.85 -30.86 11.8 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.952 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 276' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 272' ' ' TYR . 42.6 t -62.04 -42.56 95.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.879 179.444 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 277' ' ' GLU . . . . . 0.417 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 17.5 mt-10 -55.77 -59.25 12.02 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 111.695 0.257 . . . . 10.0 111.695 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 278' ' ' PRO . . . . . 0.417 ' HD3' ' HB2' ' A' ' 277' ' ' GLU . 29.1 Cg_endo -66.67 -36.97 23.01 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 121.639 1.559 . . . . 10.0 111.397 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.584 ' HB2' ' O ' ' A' ' 275' ' ' LYS . 3.0 mt -60.16 -44.76 94.74 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 120.666 0.269 . . . . 10.0 110.722 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 23.2 ttm180 -58.62 -42.14 87.52 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.174 -0.676 . . . . 10.0 109.174 179.106 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -69.73 -47.87 61.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.842 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -58.25 -47.29 84.03 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.016 0.436 . . . . 10.0 110.399 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 61.1 mt -66.93 -41.6 86.73 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.933 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -62.78 -56.4 17.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.495 0.188 . . . . 10.0 111.335 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -66.33 -41.57 89.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.892 0.377 . . . . 10.0 110.695 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -62.03 -49.43 75.29 Favored Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 111.621 -0.592 . . . . 10.0 111.621 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -67.17 -35.57 79.94 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 109.93 -0.396 . . . . 10.0 109.93 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 39.2 ttm180 -60.42 -45.14 94.68 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 178.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -63.1 -54.18 41.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.061 178.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 73.3 mttt -58.14 -46.42 85.68 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.476 -0.784 . . . . 10.0 111.551 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 60.7 mt -68.53 -42.4 78.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.576 -0.284 . . . . 10.0 111.622 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -61.19 -46.91 88.54 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.35 -0.241 . . . . 10.0 110.35 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -65.75 -36.31 83.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.762 0.315 . . . . 10.0 111.006 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 36.9 mt -69.86 -41.86 74.3 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 178.389 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -67.66 -37.46 82.42 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.021 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.3 -30.86 70.83 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.913 -0.585 . . . . 10.0 109.602 178.443 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 297' ' ' LYS . . . . . 0.543 ' HE2' ' HB2' ' C' ' 476' ' ' PRO . 18.6 tttp -82.25 -26.24 33.39 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.381 178.745 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 18.9 mt -67.01 -24.72 66.05 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.719 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 299' ' ' SER . . . . . 0.438 ' HB2' ' CD ' ' A' ' 300' ' ' PRO . 31.4 m -65.85 -63.54 3.19 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.837 178.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 300' ' ' PRO . . . . . 0.438 ' CD ' ' HB2' ' A' ' 299' ' ' SER . 17.7 Cg_endo -61.64 -47.08 12.1 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 121.632 1.555 . . . . 10.0 111.732 178.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.535 HD22 ' HG2' ' C' ' 473' ' ' LYS . 80.2 mt -65.24 -28.62 69.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.726 0.298 . . . . 10.0 111.38 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -81.46 -45.58 7.32 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 110.802 -0.919 . . . . 10.0 110.802 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -62.22 -43.41 98.88 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.852 -0.425 . . . . 10.0 109.852 178.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -66.86 -31.72 72.51 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 109.535 -0.543 . . . . 10.0 109.535 178.131 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 305' ' ' MET . . . . . 0.486 ' HB2' ' O ' ' A' ' 301' ' ' LEU . 12.9 tpt -67.86 -45.45 74.54 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 306' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 306' ' ' ARG . 49.5 mtt85 -66.95 -36.21 81.71 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.896 178.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -64.46 -47.52 78.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.24 178.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 308' ' ' ARG . . . . . 0.892 ' HG3' HD21 ' C' ' 469' ' ' LEU . 13.0 mmt180 -70.76 -33.32 70.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.168 178.674 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -63.62 -36.78 84.94 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 35.2 ttm105 -60.3 -50.89 71.85 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.17 -1.048 . . . . 10.0 108.17 177.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.16 88.45 Favored 'General case' 0 C--N 1.331 -0.203 0 O-C-N 123.702 0.626 . . . . 10.0 110.222 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 312' ' ' HIS . . . . . 0.685 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 5.2 m-70 -56.98 -57.61 11.78 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.958 -0.564 . . . . 10.0 109.886 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 313' ' ' VAL . . . . . 0.418 ' O ' ' HG3' ' A' ' 317' ' ' ARG . 47.8 t -68.56 -39.17 80.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.446 -0.797 . . . . 10.0 112.308 -178.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 314' ' ' ASP . . . . . 0.432 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 7.3 t0 -62.71 -45.69 91.6 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.579 0.228 . . . . 10.0 111.369 -179.253 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -65.46 -32.05 73.46 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.984 -0.747 . . . . 10.0 108.984 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 36.1 mt -71.88 -34.3 69.08 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 115.223 -0.899 . . . . 10.0 109.809 178.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 317' ' ' ARG . . . . . 0.432 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 64.2 mtt180 -62.58 -49.89 73.47 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.636 -0.505 . . . . 10.0 109.636 178.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 2.9 m -66.57 -13.38 60.95 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.482 -0.781 . . . . 10.0 111.23 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -100.99 -43.0 6.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.4 -0.364 . . . . 10.0 110.754 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 320' ' ' LEU . . . . . 0.489 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 64.2 mt -67.65 -30.87 70.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.444 -0.344 . . . . 10.0 111.398 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 321' ' ' ALA . . . . . 0.403 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -57.32 -60.86 8.43 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 121.268 -0.173 . . . . 10.0 110.698 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 322' ' ' PRO . . . . . 0.403 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 27.8 Cg_endo -66.16 -38.02 23.01 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.246 1.297 . . . . 10.0 110.385 177.63 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 323' ' ' TYR . . . . . 0.489 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 4.2 m-30 -55.57 -52.68 62.92 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 111.83 0.307 . . . . 10.0 111.83 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 22.0 p -63.96 -43.68 95.08 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 123.088 0.243 . . . . 10.0 111.603 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 325' ' ' ASP . . . . . 0.466 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 2.6 t70 -65.88 -41.78 91.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.996 0.427 . . . . 10.0 110.819 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 326' ' ' GLU . . . . . 0.46 ' O ' ' HG3' ' A' ' 330' ' ' ARG . 73.0 mt-10 -70.81 -30.11 66.47 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.359 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 327' ' ' LEU . . . . . 0.668 HD23 ' HD3' ' A' ' 330' ' ' ARG . 13.4 mt -66.34 -35.65 80.89 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 108.231 -1.025 . . . . 10.0 108.231 177.299 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 328' ' ' ARG . . . . . 0.466 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 59.8 mtt180 -64.99 -35.56 81.57 Favored 'General case' 0 C--O 1.223 -0.294 0 N-CA-C 108.676 -0.861 . . . . 10.0 108.676 177.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -67.48 -41.55 84.42 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.103 -0.703 . . . . 10.0 109.103 178.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 330' ' ' ARG . . . . . 0.668 ' HD3' HD23 ' A' ' 327' ' ' LEU . 4.6 mtp-105 -65.31 -45.54 83.93 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 108.984 -0.747 . . . . 10.0 108.984 178.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 44.2 mt -64.34 -38.24 90.32 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.89 179.089 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 332' ' ' ALA . . . . . 0.458 ' O ' ' HG2' ' A' ' 336' ' ' GLU . . . -63.55 -45.06 92.23 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.92 -44.76 94.12 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.304 -0.628 . . . . 10.0 109.304 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 334' ' ' ARG . . . . . 0.495 HH21 ' CG ' ' C' ' 444' ' ' ASP . 81.6 mtt180 -63.72 -43.27 97.04 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.989 178.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 55.4 mt -65.18 -44.99 86.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.668 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 336' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 332' ' ' ALA . 34.8 mm-40 -59.21 -42.48 91.05 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.572 -0.529 . . . . 10.0 109.572 178.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 337' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 341' ' ' ASN . . . -69.83 -39.8 76.26 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.246 -0.65 . . . . 10.0 109.246 178.521 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 7.0 tp -62.37 -28.66 69.92 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.402 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -70.43 -44.53 67.68 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.844 -0.428 . . . . 10.0 109.844 178.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -71.52 -49.8 37.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.444 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 341' ' ' ASN . . . . . 0.41 ' HB2' ' O ' ' A' ' 337' ' ' ALA . 1.2 m-20 -61.3 -46.57 89.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.363 -0.835 . . . . 10.0 109.938 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -64.95 -44.25 94.79 Favored Glycine 0 N--CA 1.449 -0.5 0 N-CA-C 111.687 -0.565 . . . . 10.0 111.687 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.87 -43.59 97.87 Favored Glycine 0 C--N 1.332 0.309 0 N-CA-C 110.756 -0.938 . . . . 10.0 110.756 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -66.08 -45.01 82.8 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.281 -0.637 . . . . 10.0 109.281 178.423 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 345' ' ' ARG . . . . . 0.408 ' HE ' ' CD ' ' C' ' 433' ' ' GLU . 59.8 mtt180 -56.48 -48.46 77.1 Favored 'General case' 0 C--O 1.224 -0.257 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 81.9 mt -61.18 -39.73 91.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.979 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -66.63 -48.81 68.25 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.563 -0.532 . . . . 10.0 109.563 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -59.39 -46.83 87.58 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.898 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -62.42 -42.09 99.18 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.092 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 6.4 m80 -62.43 -43.93 97.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.747 0.308 . . . . 10.0 110.377 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.99 -45.16 94.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.932 0.396 . . . . 10.0 109.947 178.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 352' ' ' LYS . . . . . 0.888 ' HG2' HG13 ' C' ' 422' ' ' VAL . 11.0 mttp -67.75 -35.89 79.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.877 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.64 -35.88 81.23 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 52.2 m -61.34 -50.86 71.23 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.771 -0.825 . . . . 10.0 108.771 178.222 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -65.75 -28.14 68.82 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.669 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 356' ' ' HIS . . . . . 0.476 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 2.2 m80 -64.84 -40.2 94.79 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.249 -1.019 . . . . 10.0 108.249 177.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 83.0 mt -72.82 -41.43 64.91 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.413 -0.812 . . . . 10.0 109.573 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 4.9 m -56.01 -53.87 51.69 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.062 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 359' ' ' THR . . . . . 0.505 ' HA ' ' OE1' ' A' ' 362' ' ' GLU . 61.3 p -70.9 -19.65 62.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.004 -0.543 . . . . 10.0 110.789 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 360' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 356' ' ' HIS . 34.8 tp -68.43 -42.85 78.3 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.393 -0.595 . . . . 10.0 109.393 178.638 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.44 -30.32 70.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.271 0.558 . . . . 10.0 109.893 178.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 362' ' ' GLU . . . . . 0.505 ' OE1' ' HA ' ' A' ' 359' ' ' THR . 35.4 mt-10 -78.19 5.8 9.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.441 -0.799 . . . . 10.0 111.311 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.692 ' HD3' HG23 ' C' ' 411' ' ' THR . 27.0 mttp -131.1 -46.38 1.01 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.025 -0.534 . . . . 10.0 109.65 178.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.17 -11.69 61.07 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.964 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.503 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 90.7 mttt -108.79 -72.77 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.43 0 CA-C-O 119.336 -0.364 . . . . 10.0 111.97 178.793 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.503 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 31.5 Cg_endo -64.16 -51.32 2.2 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 121.553 1.502 . . . . 10.0 112.862 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 367' ' ' ALA . . . . . 0.512 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -61.98 -42.32 99.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 10.0 111.384 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 368' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 368' ' ' LEU . 9.3 mt -67.39 -36.82 82.08 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.99 -0.284 . . . . 10.0 110.874 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 369' ' ' GLU . . . . . 0.752 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 68.9 mt-10 -66.66 -35.34 79.93 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.905 -0.776 . . . . 10.0 108.905 177.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -63.94 -47.01 82.17 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.636 -0.876 . . . . 10.0 108.636 178.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 1.5 mt -59.76 -44.48 93.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.309 179.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.458 HH11 ' HD2' ' A' ' 372' ' ' ARG . 58.8 mtt180 -66.79 -42.34 86.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.045 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.752 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.6 mt-30 -60.96 -34.79 75.3 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.686 -0.688 . . . . 20.0 111.413 178.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -79.19 -35.32 30.5 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 109.583 -1.407 . . . . 10.0 109.583 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 18.8 mt -57.64 -35.49 70.56 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.667 0.247 . . . . 10.0 111.667 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 376' ' ' LEU . . . . . 0.566 ' HB2' ' HD3' ' A' ' 377' ' ' PRO . 22.0 mt -56.59 -65.83 1.46 Allowed Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 111.737 0.273 . . . . 10.0 111.737 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 377' ' ' PRO . . . . . 0.566 ' HD3' ' HB2' ' A' ' 376' ' ' LEU . 30.1 Cg_endo -65.22 -33.95 47.23 Favored 'Trans proline' 0 C--N 1.357 1.012 0 C-N-CA 121.72 1.614 . . . . 10.0 111.828 179.118 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 19.2 t -62.68 -50.86 78.05 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 N-CA-C 110.429 -0.211 . . . . 10.0 110.429 179.521 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 56.0 mt -61.84 -35.99 79.87 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 380' ' ' GLU . . . . . 0.455 ' O ' HG23 ' A' ' 384' ' ' VAL . 45.2 mt-10 -62.99 -52.65 62.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.309 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.8 p -61.54 -36.71 81.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.736 0.303 . . . . 10.0 110.482 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -65.92 -43.52 87.87 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 178.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 79.7 mttt -67.04 -39.14 86.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.697 179.202 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 384' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 380' ' ' GLU . 54.1 t -60.72 -45.74 97.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 109.67 -0.493 . . . . 10.0 109.67 178.64 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.0 p -69.34 -41.98 75.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.446 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 386' ' ' PHE . . . . . 0.441 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 5.6 m-30 -63.03 -49.48 74.46 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.597 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 82.8 mt -58.82 -38.39 78.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.968 0.413 . . . . 10.0 111.017 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 14.7 m -72.73 -37.36 67.78 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.12 178.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -70.07 -34.5 73.27 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.931 0.396 . . . . 10.0 110.661 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 390' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 70.0 mt -58.87 -47.07 86.2 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.277 179.325 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 77.0 mt-10 -68.62 -29.67 68.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.195 0.522 . . . . 10.0 110.039 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.42 -36.92 83.88 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.699 179.134 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -68.26 -46.57 70.06 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.149 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.2 -30.27 70.97 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.288 -0.415 . . . . 10.0 111.96 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt . . . . . 0 N--CA 1.464 0.26 0 CA-C-O 121.02 0.438 . . . . 10.0 110.946 179.436 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 401' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' C' ' 405' ' ' TRP . 57.4 mt . . . . . 0 N--CA 1.45 -0.47 0 CA-C-O 120.639 0.257 . . . . 10.0 111.152 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 98.4 mt -71.8 -40.4 69.21 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 120.862 0.363 . . . . 10.0 111.238 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.09 -46.62 77.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.448 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 404' ' ' ASN . . . . . 0.508 ' O ' HG23 ' C' ' 408' ' ' VAL . 1.0 OUTLIER -65.19 -38.29 90.03 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 179.262 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 405' ' ' TRP . . . . . 0.501 ' HB2' ' O ' ' C' ' 401' ' ' LEU . 1.7 t90 -61.1 -34.88 75.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.437 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -64.81 -45.53 85.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.132 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 1.6 m -61.71 -36.33 80.63 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.092 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 408' ' ' VAL . . . . . 0.508 HG23 ' O ' ' C' ' 404' ' ' ASN . 96.9 t -67.01 -37.75 79.99 Favored 'Isoleucine or valine' 0 C--O 1.231 0.107 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 178.758 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 38.6 m -62.93 -42.6 99.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.737 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 14.5 m -62.44 -30.64 71.38 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 411' ' ' THR . . . . . 0.692 HG23 ' HD3' ' A' ' 363' ' ' LYS . 47.1 m -66.81 -33.57 75.91 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.745 178.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -70.52 -38.47 74.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.13 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 2.0 m -63.15 -40.94 99.03 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 414' ' ' LYS . . . . . 0.721 ' HA ' ' HG3' ' C' ' 417' ' ' GLU . 36.9 mmtt -69.25 -31.85 70.67 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.033 179.048 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 46.1 tp -71.06 -37.92 72.51 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 416' ' ' ARG . . . . . 0.578 ' HA ' ' HB2' ' C' ' 419' ' ' LEU . 54.6 mtt180 -66.7 -23.32 66.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.631 -0.713 . . . . 10.0 111.03 179.225 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 417' ' ' GLU . . . . . 0.721 ' HG3' ' HA ' ' C' ' 414' ' ' LYS . 2.3 mt-10 -64.56 -36.08 83.07 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 108.243 -1.021 . . . . 10.0 108.243 177.524 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 418' ' ' GLN . . . . . 0.779 ' O ' ' HB ' ' C' ' 422' ' ' VAL . 18.4 mt-30 -81.66 -30.03 32.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.033 -0.985 . . . . 10.0 109.277 178.323 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 419' ' ' LEU . . . . . 0.578 ' HB2' ' HA ' ' C' ' 416' ' ' ARG . 71.6 mt -69.27 -11.62 60.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.318 179.494 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -97.89 -99.75 2.07 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.159 -0.543 . . . . 10.0 112.038 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -49.44 -43.67 37.6 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.789 2.993 . . . . 10.0 113.769 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 422' ' ' VAL . . . . . 0.888 HG13 ' HG2' ' A' ' 352' ' ' LYS . 55.1 t -59.66 -46.95 92.78 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-O 120.531 0.205 . . . . 10.0 111.085 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 5.0 m -65.97 -39.65 90.56 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.952 -0.388 . . . . 10.0 109.952 178.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -60.54 -45.72 92.82 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -64.3 -30.88 71.91 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.715 -0.675 . . . . 10.0 109.551 178.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -67.6 -38.17 83.6 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.885 -0.783 . . . . 10.0 108.885 178.089 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 427' ' ' TRP . . . . . 0.456 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 44.4 m95 -67.05 -41.66 86.13 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 108.178 -1.045 . . . . 10.0 108.178 177.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -60.56 -40.52 91.93 Favored 'General case' 0 C--N 1.333 -0.11 0 N-CA-C 108.349 -0.982 . . . . 10.0 108.349 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -63.95 -46.53 84.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.447 178.006 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 50.0 mt -61.69 -28.82 69.67 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.106 179.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 431' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 67.6 mm-40 -64.96 -46.43 81.55 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.612 -0.885 . . . . 10.0 108.612 177.809 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -62.64 -40.91 98.5 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 108.405 -0.961 . . . . 10.0 108.405 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 433' ' ' GLU . . . . . 0.408 ' CD ' ' HE ' ' A' ' 345' ' ' ARG . 10.3 mt-10 -60.08 -55.43 34.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.115 -0.948 . . . . 10.0 110.914 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 3.1 p -59.14 -38.3 79.36 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.967 0.358 . . . . 10.0 111.967 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -63.55 -50.6 68.88 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 110.03 -0.359 . . . . 10.0 110.03 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.8 -48.03 76.57 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.677 -0.773 . . . . 10.0 111.358 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 74.5 mt -57.74 -40.04 78.73 Favored 'General case' 0 C--O 1.22 -0.455 0 O-C-N 123.556 0.21 . . . . 10.0 110.986 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -66.47 -33.56 75.97 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.706 -0.398 . . . . 10.0 110.914 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -67.52 -41.38 84.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.839 -0.8 . . . . 10.0 108.839 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 440' ' ' GLU . . . . . 0.464 ' O ' ' HB2' ' C' ' 444' ' ' ASP . 28.0 mt-10 -69.84 -53.48 17.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.328 -0.851 . . . . 10.0 109.77 178.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 80.7 mmm -57.92 -41.04 81.84 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.977 0.732 . . . . 10.0 112.977 -178.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 442' ' ' SER . . . . . 0.482 ' O ' ' HG3' ' C' ' 446' ' ' GLU . 33.4 p -60.91 -49.91 75.56 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.643 -0.423 . . . . 10.0 110.003 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 8.1 tttt -67.71 -37.92 82.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.741 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 444' ' ' ASP . . . . . 0.495 ' CG ' HH21 ' A' ' 334' ' ' ARG . 0.4 OUTLIER -58.32 -51.52 69.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.285 178.951 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 85.2 mt -65.98 -37.33 85.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.917 -0.583 . . . . 10.0 111.119 179.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 446' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' C' ' 442' ' ' SER . 38.1 mt-10 -63.3 -47.13 83.58 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.108 -0.701 . . . . 10.0 109.108 178.43 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 447' ' ' GLU . . . . . 0.531 ' HB3' ' HE ' ' A' ' 330' ' ' ARG . 10.9 mm-40 -65.84 -36.0 82.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.594 -0.73 . . . . 10.0 109.308 178.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.38 -47.12 93.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.871 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 69.7 mttt -66.28 -30.44 70.86 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.962 0.411 . . . . 10.0 110.87 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -86.3 5.29 35.22 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.543 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 451' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 323' ' ' TYR . 37.8 mttp -124.93 -36.67 2.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.703 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.0 -44.52 99.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 110.29 -0.263 . . . . 10.0 110.29 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 453' ' ' GLN . . . . . 0.819 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 41.0 mt-30 -59.31 -58.84 16.49 Favored Pre-proline 0 CA--C 1.535 0.365 0 CA-C-N 116.541 -0.3 . . . . 10.0 111.014 179.147 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 454' ' ' PRO . . . . . 0.819 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 33.0 Cg_exo -60.65 -34.77 91.78 Favored 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 122.035 1.824 . . . . 10.0 112.013 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 455' ' ' TYR . . . . . 0.497 ' O ' ' HB2' ' C' ' 459' ' ' PHE . 16.9 t80 -67.17 -50.14 62.2 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.209 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 28.1 mt -64.8 -39.94 94.41 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 110.203 -0.295 . . . . 10.0 110.203 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.73 -47.03 88.11 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.775 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 458' ' ' ASP . . . . . 0.608 ' HA ' ' HD2' ' C' ' 461' ' ' LYS . 2.2 t70 -72.73 -34.15 66.89 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.445 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 459' ' ' PHE . . . . . 0.497 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 0.7 OUTLIER -70.64 -32.33 69.59 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 178.893 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -62.51 -34.47 76.96 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 178.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 461' ' ' LYS . . . . . 0.608 ' HD2' ' HA ' ' C' ' 458' ' ' ASP . 58.4 mttt -66.09 -43.39 87.47 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.542 -0.91 . . . . 10.0 108.542 177.787 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 462' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' C' ' 458' ' ' ASP . 37.7 mmtm -60.93 -45.46 94.59 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.448 -0.797 . . . . 10.0 108.975 178.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -60.68 -39.53 88.82 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.395 178.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -66.97 -49.09 66.49 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 110.095 -0.335 . . . . 10.0 110.095 178.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 1.26 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 49.0 mt-10 -57.09 -37.5 71.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.816 0.341 . . . . 10.0 110.163 179.206 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.25 -52.56 10.58 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.903 -0.59 . . . . 10.0 111.078 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 74.3 mmm -60.79 -49.0 79.24 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.615 0.245 . . . . 10.0 111.47 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -67.27 -37.28 83.22 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.679 -0.489 . . . . 10.0 109.679 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 1.26 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 96.5 mt -61.96 -44.47 96.68 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 115.803 -0.635 . . . . 20.0 109.513 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 470' ' ' TYR . . . . . 0.496 ' HA ' ' HB2' ' C' ' 473' ' ' LYS . 22.2 m-30 -70.85 -22.95 62.25 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.497 179.187 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 26.9 mtt180 -67.76 -33.85 75.66 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 108.801 -0.814 . . . . 10.0 108.801 178.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -93.04 10.09 32.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.324 -0.853 . . . . 10.0 109.905 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 473' ' ' LYS . . . . . 0.535 ' HG2' HD22 ' A' ' 301' ' ' LEU . 75.9 mttt -121.46 -67.3 0.98 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.755 179.688 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 61.8 t -55.77 -42.2 69.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.01 -0.541 . . . . 10.0 112.229 -178.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -59.93 -62.61 5.55 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 112.293 0.479 . . . . 10.0 112.293 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 476' ' ' PRO . . . . . 0.543 ' HB2' ' HE2' ' A' ' 297' ' ' LYS . 28.8 Cg_endo -64.19 -32.97 62.22 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 121.69 1.594 . . . . 10.0 111.424 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 477' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' C' ' 477' ' ' LEU . 23.6 mt -65.9 -42.72 89.86 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 120.993 -0.283 . . . . 10.0 110.25 178.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 478' ' ' ARG . . . . . 0.439 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 58.4 mtt180 -62.88 -38.22 90.02 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -66.13 -50.73 62.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.892 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.27 -39.48 94.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.785 0.326 . . . . 10.0 110.198 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 17.9 mt -65.57 -33.71 76.54 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 178.44 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 482' ' ' GLN . . . . . 0.439 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 4.5 tt0 -71.93 -38.91 69.78 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 178.523 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -64.64 -43.1 94.76 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.352 -0.981 . . . . 10.0 108.352 177.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -69.25 -33.44 73.44 Favored Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 110.826 -0.91 . . . . 10.0 110.826 178.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.77 -45.58 70.99 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 486' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' C' ' 486' ' ' ARG . 57.0 mtt180 -61.73 -36.68 81.67 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.215 -0.661 . . . . 10.0 109.215 178.652 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -65.74 -49.32 68.83 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 177.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -63.43 -37.09 85.95 Favored 'General case' 0 C--O 1.226 -0.159 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.276 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 489' ' ' LEU . . . . . 0.609 ' O ' ' HB2' ' C' ' 493' ' ' GLN . 60.4 mt -64.95 -32.33 74.0 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 178.381 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 6.3 m80 -73.87 -43.14 59.5 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.26 -1.015 . . . . 10.0 108.26 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 491' ' ' GLU . . . . . 0.436 ' O ' ' HE2' ' C' ' 495' ' ' LYS . 22.5 mt-10 -58.77 -44.1 90.55 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.289 -0.869 . . . . 10.0 109.2 178.566 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 90.1 mt -74.95 -39.95 61.06 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 115.431 -0.804 . . . . 10.0 111.703 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 493' ' ' GLN . . . . . 0.609 ' HB2' ' O ' ' C' ' 489' ' ' LEU . 2.5 tt0 -62.57 -44.48 96.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.792 0.33 . . . . 10.0 110.607 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -75.27 4.65 6.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.412 0.625 . . . . 10.0 110.844 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.543 ' O ' ' HB2' ' C' ' 499' ' ' LEU . 0.6 OUTLIER -114.39 -46.33 2.98 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.18 178.484 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 74.1 mt -63.8 -35.82 81.87 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.992 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 497' ' ' SER . . . . . 0.44 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 22.9 m -62.68 -59.8 11.67 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 120.67 -0.412 . . . . 10.0 111.253 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 498' ' ' PRO . . . . . 0.44 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 30.4 Cg_endo -65.85 -40.78 15.75 Favored 'Trans proline' 0 C--N 1.356 0.936 0 C-N-CA 121.629 1.552 . . . . 10.0 111.721 178.542 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 499' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 12.8 mt -66.81 -37.07 83.81 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 121.237 -0.185 . . . . 10.0 110.837 179.633 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.71 -45.56 92.42 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.06 -1.216 . . . . 10.0 110.06 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -62.69 -42.01 99.41 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.237 -0.653 . . . . 10.0 109.237 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 502' ' ' GLU . . . . . 0.512 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 19.6 tt0 -65.27 -47.67 75.88 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.293 -0.867 . . . . 10.0 109.74 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 503' ' ' MET . . . . . 0.513 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 77.1 mmm -60.98 -36.83 80.47 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.999 -0.371 . . . . 10.0 109.999 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 504' ' ' ARG . . . . . 0.428 ' O ' ' HG3' ' C' ' 508' ' ' ARG . 90.8 mtt180 -62.54 -48.0 81.44 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -65.8 -38.29 88.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.02 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.513 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 56.3 mtt180 -60.93 -47.99 83.87 Favored 'General case' 0 CA--C 1.522 -0.125 0 N-CA-C 108.291 -1.003 . . . . 10.0 108.291 177.46 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.95 -42.89 95.05 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.43 -0.805 . . . . 10.0 109.878 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 508' ' ' ARG . . . . . 0.652 ' O ' ' HB2' ' C' ' 512' ' ' ASP . 57.1 mtt180 -59.65 -51.05 71.46 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 109.612 -0.514 . . . . 10.0 109.612 178.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 509' ' ' ALA . . . . . 0.767 ' HB1' ' HE3' ' A' ' 264' ' ' LYS . . . -59.57 -38.38 80.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.157 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 510' ' ' HIS . . . . . 0.404 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 11.2 m170 -71.27 -56.94 5.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.566 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 511' ' ' VAL . . . . . 0.417 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 75.9 t -61.46 -39.27 82.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.941 -179.288 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.652 ' HB2' ' O ' ' C' ' 508' ' ' ARG . 0.4 OUTLIER -61.75 -41.96 98.35 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.342 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.9 -36.46 82.31 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.968 -0.752 . . . . 10.0 108.968 178.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 514' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 93.1 mt -67.39 -37.78 83.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.258 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 515' ' ' ARG . . . . . 0.52 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 83.9 mtt180 -58.43 -56.01 27.63 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.16 0.505 . . . . 10.0 110.256 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.75 22.74 0.46 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.6 0.593 . . . . 10.0 112.6 -179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 517' ' ' HIS . . . . . 0.494 ' CG ' ' HE1' ' A' ' 257' ' ' TYR . 14.7 m80 -138.95 -43.48 0.47 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 121.87 -0.518 . . . . 10.0 111.562 179.389 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 86.0 mt -73.79 -38.43 64.63 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 519' ' ' ALA . . . . . 0.402 ' N ' ' HD2' ' C' ' 520' ' ' PRO . . . -61.79 -56.39 32.89 Favored Pre-proline 0 CA--C 1.535 0.397 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.373 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 520' ' ' PRO . . . . . 0.402 ' HD2' ' N ' ' C' ' 519' ' ' ALA . 18.1 Cg_endo -62.0 -38.08 60.2 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 121.549 1.499 . . . . 10.0 111.607 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 521' ' ' TYR . . . . . 0.4 ' O ' ' HB2' ' C' ' 524' ' ' GLU . 8.7 t80 -68.24 -39.28 82.33 Favored 'General case' 0 C--N 1.334 -0.091 0 C-N-CA 120.677 -0.409 . . . . 10.0 111.69 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 522' ' ' SER . . . . . 0.452 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 10.2 p -66.36 -34.28 77.62 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 109.119 -0.697 . . . . 10.0 109.119 178.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -68.73 -36.6 78.6 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 177.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 524' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' C' ' 521' ' ' TYR . 47.4 mt-10 -62.79 -44.78 95.29 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 107.64 -1.244 . . . . 10.0 107.64 176.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 93.5 mt -61.89 -43.8 98.1 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 114.962 -1.017 . . . . 10.0 109.69 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 526' ' ' ARG . . . . . 0.452 ' HG3' ' O ' ' C' ' 522' ' ' SER . 66.2 mtt180 -56.98 -45.66 82.76 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.991 -0.374 . . . . 10.0 109.991 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -62.72 -49.39 75.24 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.169 -0.469 . . . . 10.0 111.043 179.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 528' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' C' ' 528' ' ' ARG . 52.9 mtt85 -66.32 -42.4 88.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.162 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 67.2 mt -66.16 -33.48 75.87 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.416 -0.356 . . . . 10.0 110.25 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 530' ' ' ALA . . . . . 0.413 ' O ' ' HG3' ' C' ' 534' ' ' GLU . . . -64.84 -42.82 94.61 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.885 -0.784 . . . . 10.0 108.885 178.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 531' ' ' ALA . . . . . 0.404 ' O ' ' HB2' ' C' ' 534' ' ' GLU . . . -67.67 -40.69 84.43 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.621 178.591 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 532' ' ' ARG . . . . . 0.423 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 24.2 ttm180 -64.38 -42.32 96.22 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.454 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 34.8 mt -64.47 -36.95 85.84 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.959 -0.564 . . . . 10.0 109.566 178.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 534' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' C' ' 530' ' ' ALA . 25.1 mt-10 -58.41 -47.82 82.67 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.713 -0.847 . . . . 10.0 108.713 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.18 -37.99 89.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.557 -0.747 . . . . 10.0 109.769 178.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 536' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 76.7 mt -68.29 -27.03 65.96 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.627 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -81.65 -40.27 23.15 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -68.83 -53.45 21.4 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.517 -0.549 . . . . 10.0 109.517 178.615 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -66.94 -40.56 87.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.562 179.104 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 540' ' ' GLY . . . . . 0.433 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -63.46 -45.85 93.91 Favored Glycine 0 C--O 1.226 -0.348 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.989 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -61.33 -40.35 98.5 Favored Glycine 0 N--CA 1.449 -0.441 0 N-CA-C 110.754 -0.938 . . . . 10.0 110.754 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -66.19 -44.65 83.34 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 178.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 69.9 mtt180 -61.46 -39.5 91.07 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.747 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 544' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 62.6 mt -61.35 -41.8 97.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.717 0.294 . . . . 10.0 110.569 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -70.58 -38.78 74.09 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.4 -0.593 . . . . 10.0 109.4 178.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -63.22 -49.22 75.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.257 -0.883 . . . . 10.0 109.709 178.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -59.14 -42.52 90.85 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 115.694 -0.684 . . . . 10.0 109.913 178.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.3 m170 -60.83 -48.68 80.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.962 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -62.56 -47.82 82.19 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.864 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.65 -31.66 72.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.138 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 551' ' ' ALA . . . . . 0.503 ' O ' ' HG ' ' C' ' 555' ' ' LEU . . . -66.26 -49.98 65.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.251 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.23 -35.24 75.0 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.937 0.399 . . . . 10.0 110.507 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -69.09 -31.46 70.19 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.479 179.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 62.1 m170 -82.74 -26.02 32.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.518 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 555' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' C' ' 551' ' ' ALA . 82.2 mt -64.48 -35.38 80.74 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.636 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.88 -42.57 94.71 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.937 -0.764 . . . . 10.0 108.937 178.432 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.75 -38.39 88.97 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.647 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 51.8 mt -66.32 -34.64 78.45 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 178.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 70.9 m -66.23 -31.4 72.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.582 178.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 560' ' ' GLU . . . . . 0.424 ' O ' ' HD2' ' C' ' 564' ' ' PRO . 3.1 mm-40 -64.63 -25.21 67.86 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 121.515 0.674 . . . . 10.0 109.518 178.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 561' ' ' LYS . . . . . 0.747 ' HA ' ' HB3' ' C' ' 565' ' ' ALA . 0.0 OUTLIER -98.64 -27.36 14.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.532 179.324 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -79.47 -27.2 41.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 10.0 112.087 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 563' ' ' LYS . . . . . 0.953 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 89.1 mttt -105.88 -73.87 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 564' ' ' PRO . . . . . 0.953 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 32.4 Cg_exo -60.3 -52.49 3.99 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.279 1.986 . . . . 10.0 112.876 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 565' ' ' ALA . . . . . 0.747 ' HB3' ' HA ' ' C' ' 561' ' ' LYS . . . -63.15 -45.58 91.22 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.672 0.619 . . . . 10.0 112.672 -179.406 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 566' ' ' LEU . . . . . 0.508 HD23 HD12 ' C' ' 569' ' ' LEU . 12.0 mt -62.57 -36.6 83.19 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.85 -0.34 . . . . 10.0 111.061 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 567' ' ' GLU . . . . . 1.162 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 53.3 tt0 -67.9 -36.14 79.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.974 -0.75 . . . . 10.0 108.974 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -68.57 -44.4 74.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.487 -0.778 . . . . 10.0 109.323 178.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 569' ' ' LEU . . . . . 0.508 HD12 HD23 ' C' ' 566' ' ' LEU . 77.5 mt -61.42 -46.29 90.74 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.534 179.228 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 570' ' ' ARG . . . . . 0.559 ' HA ' ' HB2' ' C' ' 573' ' ' LEU . 45.5 mtt180 -71.09 -29.35 65.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.92 0.391 . . . . 10.0 110.391 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 571' ' ' GLN . . . . . 1.162 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 99.0 mt-30 -65.3 -29.69 70.48 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.667 -0.697 . . . . 20.0 109.98 178.107 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -90.15 -27.0 22.3 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 109.519 -1.432 . . . . 10.0 109.519 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 573' ' ' LEU . . . . . 0.559 ' HB2' ' HA ' ' C' ' 570' ' ' ARG . 14.5 mt -59.12 -43.08 91.92 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.56 0.207 . . . . 10.0 111.56 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 93.8 mt -55.57 -61.04 6.86 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 112.126 0.417 . . . . 10.0 112.126 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -58.85 -35.98 97.72 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 122.092 1.861 . . . . 10.0 111.737 178.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 18.0 t -65.41 -45.21 93.74 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 110.052 -0.351 . . . . 10.0 110.052 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 63.2 mt -63.13 -38.7 92.2 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 578' ' ' GLU . . . . . 0.412 ' O ' HG23 ' C' ' 582' ' ' VAL . 54.8 mt-10 -65.17 -49.32 70.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.887 178.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 2.8 p -62.5 -41.39 98.79 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.025 0.44 . . . . 10.0 110.175 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -64.71 -41.02 96.3 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.805 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -61.33 -47.16 87.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.12 178.767 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 582' ' ' VAL . . . . . 0.412 HG23 ' O ' ' C' ' 578' ' ' GLU . 84.1 t -60.43 -42.24 90.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.869 -0.419 . . . . 10.0 109.869 179.077 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 20.0 m -64.29 -44.27 92.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.319 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 584' ' ' PHE . . . . . 0.445 ' O ' ' HG ' ' C' ' 588' ' ' LEU . 8.2 m-85 -66.06 -46.64 77.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.842 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 29.5 mt -55.65 -48.48 74.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.803 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 586' ' ' SER . . . . . 0.423 ' O ' ' HG3' ' C' ' 590' ' ' GLU . 5.1 m -66.56 -42.14 87.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.175 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -61.65 -42.51 99.01 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.287 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 588' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' C' ' 584' ' ' PHE . 84.7 mt -59.09 -40.82 86.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.06 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 589' ' ' GLU . . . . . 0.449 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 15.8 mt-10 -66.62 -38.4 86.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.961 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 590' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' C' ' 586' ' ' SER . 51.8 mt-10 -72.6 -40.46 66.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.084 0.469 . . . . 10.0 110.853 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 8.4 m-30 -66.25 -44.93 82.3 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.962 -0.563 . . . . 10.0 112.172 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 2.7 p -59.5 -33.48 71.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.81 0.338 . . . . 10.0 111.699 -179.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 593' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 86.8 mttt -69.0 -20.23 64.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.194 0.521 . . . . 10.0 111.349 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.13 -2.93 51.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.891 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 81.9 mt -119.79 16.59 12.7 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.12 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 64.6 t30 . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.616 -0.707 . . . . 10.0 109.664 179.811 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.53 0.193 0 CA-C-O 120.664 0.269 . . . . 10.0 111.446 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -96.22 124.14 40.11 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.458 -0.571 . . . . 10.0 109.458 178.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -114.76 120.97 41.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.785 0.326 . . . . 10.0 110.452 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 23.9 mtmm -91.01 111.05 22.34 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.248 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.462 HD22 HD23 ' B' ' 159' ' ' LEU . 15.0 mt -107.75 119.62 39.95 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.478 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 55.4 t -103.44 124.25 57.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 120.914 0.388 . . . . 10.0 110.632 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 22.9 t -98.8 112.53 31.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.564 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 22.9 m -109.41 161.6 7.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.789 0.328 . . . . 10.0 111.075 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 156.95 -179.67 32.57 Favored Glycine 0 N--CA 1.446 -0.661 0 N-CA-C 111.22 -0.752 . . . . 10.0 111.22 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -83.66 173.87 11.0 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.957 0.408 . . . . 10.0 111.11 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -84.6 118.07 4.64 Favored Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 120.597 -0.811 . . . . 10.0 112.016 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 110.96 -1.94 28.61 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.419 -0.896 . . . . 10.0 112.959 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 27.8 m -73.05 -38.69 56.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 111.996 0.369 . . . . 10.0 111.996 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 113.9 33.72 1.8 Allowed Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.383 -0.913 . . . . 10.0 113.264 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 16' ' ' LYS . . . . . 0.403 ' HB2' ' HE3' ' B' ' 16' ' ' LYS . 38.5 mtmt -62.28 -58.79 6.41 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.835 0.35 . . . . 10.0 111.119 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 17' ' ' SER . . . . . 0.409 ' O ' HG13 ' B' ' 21' ' ' ILE . 0.8 OUTLIER -57.89 -33.22 68.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.519 -0.764 . . . . 10.0 111.616 -179.537 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.54 -41.45 94.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.955 0.407 . . . . 10.0 110.273 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 91.5 mt -67.4 -39.23 85.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.012 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 2.1 m -64.42 -49.28 72.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.879 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' ILE . . . . . 0.409 HG13 ' O ' ' B' ' 17' ' ' SER . 68.8 mt -64.08 -31.11 52.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.107 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.606 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 9.2 tp-100 -68.92 -30.56 69.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.661 0.267 . . . . 10.0 110.906 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.2 tp -87.6 -35.36 18.12 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.182 0.515 . . . . 10.0 111.088 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 43.7 mm -80.83 -55.57 8.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 112.548 0.573 . . . . 10.0 112.548 -178.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 25' ' ' GLN . . . . . 0.434 ' OE1' ' HA ' ' D' ' 840' ' ' VAL . 15.3 mt-30 -96.98 -15.58 21.03 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.735 0.642 . . . . 10.0 112.735 -178.161 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.606 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 86.2 m-20 65.58 29.73 10.88 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.71 0.767 . . . . 10.0 109.208 -178.497 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -128.76 138.09 51.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.858 -1.064 . . . . 10.0 109.479 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -94.61 139.17 31.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.301 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 m -103.39 114.16 42.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.057 -0.519 . . . . 10.0 110.752 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -91.55 6.82 44.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.343 0.592 . . . . 10.0 109.782 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -94.72 158.73 15.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.306 -0.861 . . . . 10.0 110.207 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -105.43 79.96 1.52 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.0 0.428 . . . . 10.0 110.054 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 33' ' ' ASP . . . . . 0.483 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 1.6 t0 -98.64 130.81 27.08 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.383 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 34' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 17.4 Cg_exo -69.16 -172.84 0.55 Allowed 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.196 2.598 . . . . 10.0 112.286 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -169.94 143.48 2.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.389 -0.369 . . . . 10.0 111.121 -179.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.584 ' HB ' ' HB ' ' D' ' 821' ' ' VAL . 11.5 mt -115.99 -62.58 2.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 108.458 -0.942 . . . . 10.0 108.458 178.368 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.472 ' O ' HG23 ' D' ' 821' ' ' VAL . 2.5 tt0 -154.74 92.5 1.48 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.298 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 38' ' ' ASP . . . . . 0.624 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 61.1 m-20 -109.21 160.05 16.42 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.187 179.675 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.6 p -148.24 138.3 22.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 112.274 0.472 . . . . 10.0 112.274 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 40' ' ' TYR . . . . . 0.604 ' CE2' HG22 ' D' ' 840' ' ' VAL . 1.5 m-85 -128.55 151.5 49.38 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.847 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 41' ' ' ARG . . . . . 0.616 ' NH1' ' HB2' ' D' ' 817' ' ' LYS . 5.1 ttp180 -137.25 126.46 24.64 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.521 0.2 . . . . 10.0 110.634 -178.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 8.6 tttm -151.06 141.03 22.02 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.369 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -88.94 135.14 33.7 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.14 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 21.7 m -137.54 167.21 23.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.852 0.358 . . . . 10.0 111.227 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 58.9 t -115.48 114.41 46.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.669 -0.696 . . . . 10.0 109.744 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 46.1 mt -127.27 121.0 56.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.337 -179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 66.25 21.88 10.99 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.432 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.51 -20.39 50.88 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 121.033 -0.604 . . . . 10.0 112.45 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -88.46 150.43 23.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.997 0.427 . . . . 10.0 110.907 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 9.8 t -103.58 137.5 41.57 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 108.505 -0.924 . . . . 10.0 108.505 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 3.6 p -147.84 153.24 38.89 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.954 0.407 . . . . 10.0 111.529 -178.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 26.5 tp -100.93 117.03 34.18 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.619 -0.882 . . . . 10.0 108.619 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.553 ' O ' ' HA ' ' B' ' 41' ' ' ARG . 46.7 mt -92.43 120.52 33.0 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.464 0.542 . . . . 10.0 112.464 -178.771 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -104.77 90.75 3.58 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 106.992 -1.484 . . . . 10.0 106.992 177.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 13.5 mt -84.9 134.56 26.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.729 -0.669 . . . . 10.0 112.055 -177.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.493 HD12 ' O ' ' B' ' 38' ' ' ASP . 63.7 tp -112.36 111.12 21.76 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.582 -0.735 . . . . 10.0 111.348 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.624 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 6.5 t70 -89.95 91.04 8.42 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.34 -0.985 . . . . 10.0 108.34 178.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 81.7 p -78.36 171.7 14.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.87 -178.122 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.04 158.71 27.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.692 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -82.86 -47.83 5.72 Favored Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 110.573 -1.011 . . . . 10.0 110.573 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -127.31 118.99 25.26 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.28 -0.637 . . . . 20.0 109.28 178.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.417 ' OE2' ' HB2' ' B' ' 68' ' ' ARG . 8.9 tt0 -137.71 166.95 22.7 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.502 -179.035 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -115.59 -160.49 0.75 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.053 -0.521 . . . . 10.0 109.969 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -71.38 104.56 3.23 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.75 -0.463 . . . . 10.0 109.75 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 68.4 m -136.99 135.49 37.68 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.974 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.96 -33.55 76.08 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.543 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 63.6 mmm -61.65 -41.52 97.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 10.0 109.984 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.467 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 58.9 ttt85 -64.18 -45.77 86.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.604 -0.726 . . . . 10.0 110.797 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.448 ' OD1' HG12 ' B' ' 103' ' ' VAL . 2.6 t0 -62.05 -38.38 88.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.194 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 18.7 tp60 -69.02 -47.4 65.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.626 -0.716 . . . . 10.0 112.099 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 71' ' ' TYR . . . . . 0.467 ' CE2' ' HA ' ' B' ' 68' ' ' ARG 0.292 0.2 OUTLIER -69.01 -23.18 64.06 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 114.14 1.163 . . . . 10.0 114.14 -178.722 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' B' B ' 72' ' ' MET . . . . . 0.597 ' HB3' HG21 ' B' ' 103' ' ' VAL . 55.4 mtm -87.42 -25.67 23.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.198 0.523 . . . . 10.0 110.3 178.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 73' ' ' ARG . . . . . 0.637 HH21 ' HA ' ' B' ' 103' ' ' VAL . 15.4 ttm180 -67.34 -28.7 68.19 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.914 -0.584 . . . . 10.0 111.363 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -89.63 -1.45 58.02 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.346 0.499 . . . . 10.0 112.346 -179.092 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.27 149.66 34.27 Favored Glycine 0 C--O 1.237 0.305 0 C-N-CA 120.647 -0.787 . . . . 10.0 113.102 -179.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -102.99 -55.35 2.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.061 0.457 . . . . 10.0 109.873 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 77' ' ' GLY . . . . . 0.428 ' HA3' HD11 ' B' ' 163' ' ' ILE . . . -115.01 142.77 17.83 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 110.992 -0.843 . . . . 10.0 110.992 179.433 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 73.8 m-85 -122.35 126.34 47.83 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.121 0.486 . . . . 10.0 112.155 -178.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.889 ' HG ' HD22 ' B' ' 159' ' ' LEU . 56.5 mt -98.79 117.59 33.61 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.864 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 9.6 m -91.21 91.57 8.27 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 50.0 t -90.01 119.96 38.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.08 0.467 . . . . 10.0 112.167 -178.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.767 ' HB3' HD11 ' B' ' 93' ' ' ILE . 15.2 p90 -132.12 140.06 48.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.021 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -82.77 128.03 34.0 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.829 -0.434 . . . . 10.0 109.829 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 84' ' ' ILE . . . . . 0.817 HD11 ' HA ' ' B' ' 118' ' ' CYS . 43.1 pt -72.25 -5.9 6.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 112.083 0.401 . . . . 10.0 112.083 -179.149 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 85' ' ' ASN . . . . . 0.404 ' OD1' ' HD2' ' B' ' 117' ' ' LYS . 2.0 p-10 -98.45 1.14 46.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.942 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -129.23 119.45 24.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.635 -0.712 . . . . 10.0 110.335 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.67 -38.11 76.94 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 -178.585 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 52.3 tttp -59.73 -39.12 83.67 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.906 0.384 . . . . 10.0 111.062 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 49.2 m -59.42 -38.18 79.99 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.701 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -68.62 -36.71 79.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.116 0.484 . . . . 10.0 111.115 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -79.82 -30.72 40.54 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.683 -179.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.36 -16.28 63.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.19 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 93' ' ' ILE . . . . . 0.767 HD11 ' HB3' ' B' ' 82' ' ' PHE . 38.7 mm -56.74 -42.29 76.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.677 179.209 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -66.6 -36.99 83.94 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.912 0.387 . . . . 10.0 110.223 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -62.82 -39.36 94.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.042 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -78.96 -34.09 44.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.385 -0.371 . . . . 10.0 111.061 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -57.68 -50.01 74.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.314 179.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 98' ' ' GLU . . . . . 0.51 ' HA ' ' HD3' ' B' ' 101' ' ' LYS . 33.9 mm-40 -68.2 -32.44 72.66 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.993 -0.548 . . . . 10.0 111.026 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -63.38 -47.43 82.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.002 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 100' ' ' ILE . . . . . 0.574 ' HA ' HG22 ' B' ' 103' ' ' VAL . 55.3 mt -63.13 -35.8 73.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.29 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 101' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' B' ' 98' ' ' GLU . 49.7 mtpt -62.62 -31.4 72.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.513 179.106 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.01 -20.06 33.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.85 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.637 ' HA ' HH21 ' B' ' 73' ' ' ARG . 15.0 m -87.99 -33.72 6.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.599 -0.441 . . . . 10.0 111.586 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -95.95 -15.84 22.1 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.473 179.099 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 63.12 48.11 3.89 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.454 -0.794 . . . . 10.0 112.054 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 9.2 t -166.68 164.88 16.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.659 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -101.58 -20.21 15.15 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -91.91 77.15 5.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.626 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.472 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 39.6 t -123.43 132.83 24.28 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.26 -179.491 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 110' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 21.5 Cg_exo -65.71 106.97 0.98 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.852 2.368 . . . . 10.0 111.881 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 111' ' ' MET . . . . . 0.461 ' HB2' HG21 ' B' ' 139' ' ' ILE . 61.4 mtt -127.81 152.34 47.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.862 -0.608 . . . . 10.0 109.891 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 112' ' ' VAL . . . . . 0.572 ' HB ' HD23 ' B' ' 79' ' ' LEU . 88.6 t -135.67 127.99 46.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.744 -0.465 . . . . 10.0 109.744 179.229 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 18.7 tp -80.43 114.52 19.38 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 45.3 t -111.15 110.23 31.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.518 -178.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -86.35 128.89 9.1 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 109.335 -1.506 . . . . 10.0 109.335 178.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -114.89 155.94 25.92 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 117.42 0.61 . . . . 10.0 112.372 -178.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 117' ' ' LYS . . . . . 0.423 ' HB3' HD12 ' B' ' 120' ' ' LEU . 80.3 mttt 71.99 46.05 0.37 Allowed 'General case' 0 N--CA 1.462 0.146 0 O-C-N 124.174 0.921 . . . . 10.0 112.65 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 118' ' ' CYS . . . . . 0.817 ' HA ' HD11 ' B' ' 84' ' ' ILE . 26.3 p -79.0 -15.31 58.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.032 0.444 . . . . 10.0 110.642 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -86.22 1.29 51.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.165 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 120' ' ' LEU . . . . . 0.423 HD12 ' HB3' ' B' ' 117' ' ' LYS . 24.4 mt -100.27 137.09 19.93 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.568 179.317 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.92 -3.16 13.5 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.914 2.409 . . . . 10.0 112.326 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 13.2 t -85.51 26.47 0.93 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.923 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 -64.52 107.0 1.26 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.052 0.453 . . . . 10.0 111.927 -179.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 2.8 m -97.25 -34.47 11.08 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.762 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 46.5 t -87.41 119.24 34.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.894 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 126' ' ' ASP . . . . . 0.656 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 27.8 t70 -72.78 153.8 40.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.521 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.25 -41.88 85.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.858 -0.61 . . . . 10.0 112.152 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -69.64 -38.03 77.0 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.308 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 129' ' ' GLN . . . . . 0.656 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 75.9 mt-30 -55.39 -45.38 76.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.179 0.514 . . . . 10.0 110.517 179.431 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.97 -41.96 77.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.458 -0.792 . . . . 10.0 110.929 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -60.43 -40.68 91.95 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.959 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -62.5 -45.5 92.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.9 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 32.3 tp -62.85 -45.86 90.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.873 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.67 -45.97 90.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.968 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -61.05 -31.8 71.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.516 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 32.3 m -70.8 -29.81 66.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.459 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -93.5 -6.78 46.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.797 0.332 . . . . 10.0 110.879 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 75.09 29.72 60.13 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.976 -0.631 . . . . 10.0 111.843 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 139' ' ' ILE . . . . . 0.461 HG21 ' HB2' ' B' ' 111' ' ' MET . 49.0 pt -122.02 154.82 61.44 Favored Pre-proline 0 C--N 1.329 -0.306 0 N-CA-C 110.55 -0.167 . . . . 10.0 110.55 -179.427 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -80.51 150.96 19.57 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.922 2.415 . . . . 10.0 112.268 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -113.14 121.51 44.74 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.502 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 11.9 mm -118.12 117.9 56.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.54 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -82.9 123.76 29.7 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.023 -1.103 . . . . 10.0 108.023 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 144' ' ' THR . . . . . 0.537 ' HA ' ' O ' ' B' ' 150' ' ' GLN . 76.3 p -135.89 172.66 12.69 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 113.568 0.951 . . . . 10.0 113.568 -177.419 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -163.8 121.41 1.81 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 113.953 -1.476 . . . . 10.0 107.635 178.142 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -72.61 -25.63 61.38 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.317 0.488 . . . . 10.0 112.317 -178.125 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 22.5 tttt -66.26 -47.96 72.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.848 0.356 . . . . 10.0 111.6 -179.202 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.1 0.82 41.45 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.2 -0.455 . . . . 10.0 111.522 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 18.3 ttt85 54.5 47.81 21.92 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.18 -179.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 150' ' ' GLN . . . . . 0.537 ' O ' ' HA ' ' B' ' 144' ' ' THR . 32.8 tt0 -90.05 111.85 23.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.609 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 66.94 10.19 55.31 Favored Glycine 0 CA--C 1.519 0.286 0 N-CA-C 114.594 0.598 . . . . 10.0 114.594 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 90.6 t -59.68 -49.15 84.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 117.046 0.423 . . . . 10.0 111.119 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -63.75 -45.01 91.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.301 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -61.64 -38.35 87.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.863 -0.608 . . . . 10.0 112.055 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.92 -50.63 72.69 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.838 0.352 . . . . 10.0 110.915 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -65.81 -41.52 91.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.816 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 157' ' ' TYR . . . . . 0.407 ' O ' ' HG3' ' B' ' 161' ' ' ARG . 13.5 m-30 -63.01 -41.67 99.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.682 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 98.8 m -57.89 -41.5 82.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.798 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.889 HD22 ' HG ' ' B' ' 79' ' ' LEU . 30.3 tp -58.06 -50.75 72.38 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.212 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 39.3 t -62.73 -38.88 82.84 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.458 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 161' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' B' ' 161' ' ' ARG . 43.7 mtm-85 -61.76 -34.36 75.71 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.495 179.054 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -76.42 -37.13 57.52 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.194 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 163' ' ' ILE . . . . . 0.529 HG13 ' O ' ' B' ' 159' ' ' LEU . 78.5 mt -64.01 -44.5 97.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.849 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 29.0 ttm180 -59.53 -52.19 66.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.761 0.315 . . . . 10.0 110.646 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -61.19 -33.52 73.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.156 0.503 . . . . 10.0 110.244 179.225 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -65.09 -39.43 93.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.591 -0.731 . . . . 10.0 111.042 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 167' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' B' ' 163' ' ' ILE . 67.7 mttt -70.48 -42.64 71.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.455 -0.338 . . . . 10.0 110.464 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -71.56 -15.46 62.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.265 0.555 . . . . 10.0 110.145 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -80.5 -39.2 28.39 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.957 -0.757 . . . . 10.0 108.957 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 17.0 mmt -67.99 -30.5 69.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.454 -0.794 . . . . 10.0 111.781 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 12.9 m . . . . . 0 C--N 1.33 -0.242 0 CA-C-O 120.782 0.325 . . . . 10.0 111.322 179.469 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.266 0 N-CA-C 111.79 -0.524 . . . . 10.0 111.79 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' D' D ' 809' ' ' THR . . . . . 0.422 HG21 HD11 ' B' ' 36' ' ' ILE . 36.1 p -121.42 118.08 28.49 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.359 -0.238 . . . . 10.0 110.359 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 3.5 t -101.69 134.23 42.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.036 0.446 . . . . 10.0 111.209 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 38.3 mtpt -83.35 114.54 21.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.653 -0.703 . . . . 10.0 110.326 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 44.4 t -100.88 122.61 53.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 813' ' ' TYR . . . . . 0.495 ' HB2' ' HA ' ' D' ' 876' ' ' ILE . 77.4 m-85 -89.86 137.76 32.06 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.462 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 814' ' ' LEU . . . . . 0.652 HD13 ' HD2' ' D' ' 841' ' ' ARG . 19.4 mt -109.35 147.92 37.0 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 115.647 -0.706 . . . . 10.0 110.782 -178.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 815' ' ' PRO . . . . . 0.484 ' HB3' ' HA ' ' D' ' 878' ' ' GLU . 65.2 Cg_endo -73.93 56.76 3.69 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.322 2.681 . . . . 10.0 111.79 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 816' ' ' ASN . . . . . 0.593 ' OD1' ' HB3' ' B' ' 41' ' ' ARG . 0.7 OUTLIER -163.47 33.48 0.09 Allowed 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 107.975 -1.12 . . . . 10.0 107.975 -179.535 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' D' D ' 817' ' ' LYS . . . . . 0.616 ' HB2' ' NH1' ' B' ' 41' ' ' ARG . 31.3 mtpt 52.51 39.79 28.57 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 114.357 -1.292 . . . . 10.0 111.66 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -139.18 -173.94 3.73 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 113.23 0.826 . . . . 10.0 113.23 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.51 172.02 17.81 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.678 -0.692 . . . . 10.0 112.218 -177.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 12.1 t -150.99 139.26 20.28 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.346 -1.353 . . . . 10.0 107.346 177.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 821' ' ' VAL . . . . . 0.584 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 2.3 t -110.03 107.53 23.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 120.331 -0.548 . . . . 10.0 111.295 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 10.6 t -109.49 143.59 19.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.01 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.57 136.37 39.26 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.521 -0.309 . . . . 10.0 110.73 179.626 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 59.1 t -89.02 127.45 41.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.917 0.389 . . . . 10.0 110.418 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 825' ' ' ARG . . . . . 0.443 ' HB2' ' SD ' ' D' ' 828' ' ' MET . 51.3 mtp180 -131.01 155.23 47.2 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.77 154.13 36.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.007 0.432 . . . . 10.0 110.883 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 95.49 -55.59 1.71 Allowed Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.817 -0.706 . . . . 10.0 113.071 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 828' ' ' MET . . . . . 0.443 ' SD ' ' HB2' ' D' ' 825' ' ' ARG . 10.2 ptm -64.67 147.73 52.42 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.406 0.622 . . . . 10.0 112.483 -179.1 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 829' ' ' SER . . . . . 0.661 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.1 OUTLIER -100.05 177.88 4.96 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.429 -0.805 . . . . 10.0 110.777 -179.667 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' D' D ' 830' ' ' VAL . . . . . 0.525 ' O ' ' HB2' ' D' ' 834' ' ' LEU . 69.6 t -59.06 -44.54 91.63 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 179.203 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 831' ' ' TYR . . . . . 0.637 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 27.4 t80 -55.83 -34.23 65.2 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.32 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -68.5 -64.58 0.84 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.675 -178.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 1.2 m -61.69 -38.56 88.29 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.382 0.512 . . . . 10.0 112.382 -179.093 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 834' ' ' LEU . . . . . 0.576 ' HB3' ' HZ3' ' D' ' 863' ' ' TRP . 3.7 mm? -75.4 -17.55 60.17 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.933 0.716 . . . . 10.0 112.933 -178.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 835' ' ' ASP . . . . . 0.416 ' HB2' ' O ' ' D' ' 831' ' ' TYR . 32.1 t70 -62.13 -48.88 78.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.95 0.405 . . . . 10.0 109.939 179.274 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 836' ' ' LYS . . . . . 0.406 ' O ' ' HB ' ' D' ' 840' ' ' VAL . 3.4 mmmm -67.43 -25.93 66.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.362 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -81.67 -18.34 44.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.57 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 838' ' ' LEU . . . . . 0.595 HD12 ' HG3' ' D' ' 845' ' ' GLN . 16.3 mt -99.26 -47.12 5.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.042 0.448 . . . . 10.0 111.007 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 839' ' ' LYS . . . . . 0.442 ' HA ' ' HD3' ' D' ' 839' ' ' LYS . 28.9 mmtp -62.01 -27.49 68.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.898 -0.592 . . . . 10.0 111.061 -179.613 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 840' ' ' VAL . . . . . 0.83 HG13 ' HG3' ' D' ' 841' ' ' ARG . 10.1 p -57.73 -22.84 19.09 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 O-C-N 123.739 0.649 . . . . 10.0 111.208 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 841' ' ' ARG . . . . . 0.83 ' HG3' HG13 ' D' ' 840' ' ' VAL . 2.5 mtp-105 -120.6 10.15 11.0 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.224 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 73.49 33.35 58.59 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.975 -0.631 . . . . 10.0 112.801 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 90.8 mt -104.93 142.69 34.31 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -108.56 153.82 22.83 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.523 -0.308 . . . . 10.0 111.22 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 845' ' ' GLN . . . . . 0.595 ' HG3' HD12 ' D' ' 838' ' ' LEU . 23.8 mp0 -76.49 51.36 0.72 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.245 0.545 . . . . 10.0 111.795 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -118.79 -71.74 0.72 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.85 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -92.73 32.45 1.24 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.817 -0.629 . . . . 10.0 111.597 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 36.2 m -125.0 137.84 54.23 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.74 -0.467 . . . . 10.0 109.74 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 4.7 p -126.9 137.8 56.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.622 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 850' ' ' VAL . . . . . 0.47 HG22 HG22 ' D' ' 877' ' ' VAL . 43.4 t -101.58 126.85 55.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 121.066 0.46 . . . . 10.0 111.05 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -109.32 144.74 37.08 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.9 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 852' ' ' ARG . . . . . 0.785 ' HD3' HD11 ' D' ' 870' ' ' LEU . 27.8 mtm180 -92.13 179.43 5.58 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.252 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 853' ' ' LEU . . . . . 0.473 HD23 HD11 ' D' ' 876' ' ' ILE . 0.2 OUTLIER -123.32 56.76 1.17 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.333 0.587 . . . . 10.0 110.455 -179.583 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 61.4 mt -83.21 100.96 7.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.816 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 855' ' ' LYS . . . . . 0.413 ' HA ' ' HE2' ' D' ' 855' ' ' LYS . 10.7 mmpt? 63.8 14.37 8.23 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.938 -0.573 . . . . 10.0 111.302 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 102.62 -13.26 56.62 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 121.067 -0.587 . . . . 10.0 111.92 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -83.05 130.53 35.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.007 0.432 . . . . 10.0 110.649 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 858' ' ' LYS . . . . . 0.514 ' HD2' HD13 ' D' ' 876' ' ' ILE . 1.6 mppt? -84.07 104.37 14.08 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.102 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.95 136.68 41.36 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.962 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 42.3 t -67.07 126.41 26.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.922 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 5.1 m -119.49 142.85 47.91 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -86.89 162.49 17.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.785 0.326 . . . . 10.0 111.591 -178.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 863' ' ' TRP . . . . . 0.637 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 73.0 m95 -78.97 -25.3 43.49 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.886 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -72.95 -22.94 60.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.705 -0.679 . . . . 10.0 111.319 -179.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 5.3 m -62.96 146.19 53.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.388 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 866' ' ' ALA . . . . . 0.661 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -78.0 149.79 34.0 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.107 -0.331 . . . . 10.0 110.107 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 867' ' ' ILE . . . . . 0.591 HD11 HD11 ' D' ' 875' ' ' LEU . 7.9 tp -92.0 -10.41 9.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.111 0.481 . . . . 10.0 111.498 -179.338 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -55.07 -52.68 69.07 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 113.749 1.018 . . . . 10.0 113.749 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -77.51 9.85 2.73 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 121.864 1.709 . . . . 10.0 113.369 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 870' ' ' LEU . . . . . 0.785 HD11 ' HD3' ' D' ' 852' ' ' ARG . 1.3 mm? -104.25 4.7 34.09 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.045 0.387 . . . . 10.0 112.045 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -69.22 104.14 2.12 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.501 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 145.17 -13.55 1.87 Allowed Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.05 -1.071 . . . . 10.0 113.811 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -128.42 -174.85 3.34 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 117.554 0.677 . . . . 10.0 112.201 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -109.33 153.05 24.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.142 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 875' ' ' LEU . . . . . 0.591 HD11 HD11 ' D' ' 867' ' ' ILE . 47.8 mt -121.18 128.53 52.56 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.178 -0.305 . . . . 10.0 110.178 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 876' ' ' ILE . . . . . 0.514 HD13 ' HD2' ' D' ' 858' ' ' LYS . 2.4 mp -113.65 122.23 67.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.835 0.35 . . . . 10.0 110.806 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 877' ' ' VAL . . . . . 0.48 HG11 HD21 ' D' ' 838' ' ' LEU . 17.6 t -106.42 130.13 58.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 878' ' ' GLU . . . . . 0.484 ' HA ' ' HB3' ' D' ' 815' ' ' PRO . 0.0 OUTLIER -128.1 163.34 24.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.765 0.317 . . . . 10.0 110.962 179.707 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 59.0 t -93.24 130.0 42.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.433 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 49.2 mt . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.551 -0.738 . . . . 10.0 110.46 179.54 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 69.7 mt . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.544 0.211 . . . . 10.0 111.329 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 30.2 ttm180 -66.95 -44.03 81.61 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 178.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -61.07 -44.7 96.97 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 108.362 -0.977 . . . . 10.0 108.362 178.318 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 242' ' ' GLU . . . . . 0.42 ' OE1' ' HB3' ' C' ' 528' ' ' ARG . 20.5 mt-10 -59.11 -55.88 29.36 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.225 -0.898 . . . . 10.0 109.892 178.619 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 243' ' ' MET . . . . . 0.42 ' HA ' ' HB3' ' A' ' 246' ' ' ASP . 81.4 mmm -58.57 -35.18 71.97 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 112.763 0.653 . . . . 10.0 112.763 -179.288 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 244' ' ' SER . . . . . 0.473 ' O ' ' HG3' ' A' ' 248' ' ' GLU . 51.1 m -62.07 -38.02 87.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.168 0.508 . . . . 10.0 109.762 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -84.15 -40.43 18.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.004 -0.543 . . . . 10.0 109.539 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 246' ' ' ASP . . . . . 0.42 ' HB3' ' HA ' ' A' ' 243' ' ' MET . 12.8 t70 -56.61 -51.58 68.13 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.068 179.281 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 52.8 mt -60.02 -41.72 92.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.928 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 248' ' ' GLU . . . . . 0.473 ' HG3' ' O ' ' A' ' 244' ' ' SER . 7.3 mt-10 -66.67 -49.22 66.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.623 -0.262 . . . . 10.0 110.882 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.04 -43.47 98.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.017 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 250' ' ' VAL . . . . . 0.583 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 41.9 t -67.25 -46.95 82.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.577 0 CA-C-N 116.429 -0.35 . . . . 10.0 111.323 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 251' ' ' LYS . . . . . 0.452 ' O ' HG12 ' A' ' 254' ' ' VAL . 53.6 mttm -68.15 -47.46 68.01 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.449 0.537 . . . . 10.0 112.449 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.53 -29.95 71.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.553 0.216 . . . . 10.0 111.285 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -92.8 -26.8 17.54 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 121.142 -0.223 . . . . 10.0 111.563 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.583 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 1.1 p -64.0 -28.5 45.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.573 0.225 . . . . 10.0 110.922 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 255' ' ' GLN . . . . . 0.492 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 61.6 mt-30 -61.33 -62.13 6.54 Favored Pre-proline 0 CA--C 1.533 0.314 0 N-CA-C 109.487 -0.56 . . . . 10.0 109.487 178.122 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 256' ' ' PRO . . . . . 0.492 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 15.5 Cg_endo -62.44 -31.6 80.79 Favored 'Trans proline' 0 C--N 1.359 1.114 0 C-N-CA 121.633 1.555 . . . . 10.0 111.262 177.654 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 257' ' ' TYR . . . . . 0.482 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 5.5 m-30 -62.53 -53.57 52.82 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 178.744 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 49.1 mt -68.99 -34.3 75.07 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.763 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -59.93 -45.19 93.4 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.976 -0.749 . . . . 10.0 108.976 178.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -63.88 -43.92 94.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.359 -0.837 . . . . 10.0 109.625 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -63.81 -39.74 94.96 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.681 179.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -65.25 -40.08 93.53 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 178.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 39.1 mttp -63.73 -47.24 81.87 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.562 -0.903 . . . . 10.0 108.562 178.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.633 ' HE3' ' HB1' ' C' ' 509' ' ' ALA . 13.2 mptt -58.34 -51.33 70.25 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.543 -0.753 . . . . 10.0 109.446 178.14 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -56.06 -38.65 70.92 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.956 179.566 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -63.81 -45.13 91.02 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -61.31 -48.04 83.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.18 -0.464 . . . . 10.0 109.795 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 268' ' ' GLU . . . . . 0.496 ' OE1' ' HD2' ' C' ' 506' ' ' ARG . 1.9 mt-10 -61.49 -52.58 63.91 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.865 -0.607 . . . . 10.0 111.075 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 89.4 mmm -62.13 -47.7 83.43 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.549 0.574 . . . . 10.0 112.549 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -59.71 -44.78 93.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.498 0.19 . . . . 10.0 110.601 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 41.4 mt -67.43 -37.33 82.87 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.843 -0.428 . . . . 10.0 109.843 178.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 272' ' ' TYR . . . . . 0.422 ' O ' HG23 ' A' ' 276' ' ' VAL . 2.5 m-30 -60.42 -50.52 73.25 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.571 -0.529 . . . . 10.0 109.571 178.455 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 273' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 273' ' ' ARG . 0.0 OUTLIER -62.06 -42.24 98.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.244 179.554 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -61.62 -23.54 66.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.458 -0.792 . . . . 10.0 110.694 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.657 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 14.8 mmtp -94.52 -40.6 9.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.673 178.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 276' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 272' ' ' TYR . 26.0 t -50.61 -44.38 25.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 O-C-N 123.175 0.297 . . . . 10.0 111.784 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 277' ' ' GLU . . . . . 0.477 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 1.3 mt-10 -57.18 -62.18 5.71 Favored Pre-proline 0 CA--C 1.536 0.432 0 N-CA-C 113.041 0.756 . . . . 10.0 113.041 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 278' ' ' PRO . . . . . 0.477 ' HD3' ' HB2' ' A' ' 277' ' ' GLU . 32.2 Cg_endo -67.03 -37.94 17.66 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 121.902 1.735 . . . . 10.0 112.344 179.004 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.657 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 33.7 mt -62.77 -42.45 99.69 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.624 0.249 . . . . 10.0 110.423 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 280' ' ' ARG . . . . . 0.496 ' O ' ' HB2' ' A' ' 284' ' ' GLN . 10.5 ttt180 -64.23 -36.46 84.15 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.14 -0.689 . . . . 10.0 109.14 178.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.56 -42.85 95.4 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.976 -0.556 . . . . 10.0 109.786 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -64.98 -46.37 81.76 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.59 -0.522 . . . . 10.0 109.59 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 89.0 mt -63.75 -40.66 97.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.119 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 284' ' ' GLN . . . . . 0.496 ' HB2' ' O ' ' A' ' 280' ' ' ARG . 1.4 mt-30 -65.48 -50.35 65.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.188 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -58.78 -46.17 88.15 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.557 -0.534 . . . . 10.0 109.557 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.75 -43.93 97.03 Favored Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 111.101 -0.8 . . . . 10.0 111.101 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.3 -44.23 92.26 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 110.585 -0.154 . . . . 10.0 110.585 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 -56.0 -45.41 79.04 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.829 0.347 . . . . 10.0 110.105 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -68.68 -56.82 6.89 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.692 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 37.3 mttt -55.45 -39.49 70.38 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.203 -0.453 . . . . 10.0 112.131 -179.216 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 291' ' ' LEU . . . . . 0.597 ' O ' ' HG3' ' A' ' 295' ' ' GLN . 39.4 mt -69.88 -43.51 71.69 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.889 -0.411 . . . . 10.0 109.889 178.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 292' ' ' HIS . . . . . 0.477 ' O ' ' HG3' ' A' ' 296' ' ' GLU . 53.5 t60 -65.9 -39.07 90.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.123 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -61.54 -39.38 90.84 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.739 -0.837 . . . . 10.0 108.739 178.123 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 59.0 mt -69.06 -38.13 78.92 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.218 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 295' ' ' GLN . . . . . 0.597 ' HG3' ' O ' ' A' ' 291' ' ' LEU . 55.7 mt-30 -60.69 -41.47 95.22 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.169 0.509 . . . . 10.0 109.906 178.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 296' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 292' ' ' HIS . 31.7 mt-10 -71.5 -4.68 28.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.269 -0.878 . . . . 10.0 111.276 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 297' ' ' LYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 297' ' ' LYS . 9.4 mmtp -111.2 -43.2 3.77 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 178.702 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 87.8 mt -60.76 -32.16 71.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.021 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 299' ' ' SER . . . . . 0.503 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 13.1 m -69.36 -63.46 2.03 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 112.052 0.39 . . . . 10.0 112.052 179.502 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 300' ' ' PRO . . . . . 0.503 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 43.3 Cg_endo -68.03 -46.81 2.08 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 121.902 1.734 . . . . 10.0 112.942 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.487 HD13 ' HG2' ' C' ' 473' ' ' LYS . 89.5 mt -67.64 -32.6 73.41 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.645 -0.502 . . . . 10.0 109.645 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -69.45 -46.47 55.72 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 109.681 -1.368 . . . . 10.0 109.681 178.21 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -60.15 -42.34 94.69 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -62.36 -44.06 97.36 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.959 178.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 4.1 tpt -64.83 -37.83 88.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.316 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 306' ' ' ARG . . . . . 0.483 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 47.5 mtt180 -69.31 -38.1 78.09 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 178.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 307' ' ' ASP . . . . . 0.516 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 38.1 t70 -65.73 -45.34 83.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.762 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 308' ' ' ARG . . . . . 0.591 ' HG3' ' CD2' ' C' ' 469' ' ' LEU . 13.9 mmt180 -68.45 -28.41 67.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.654 -0.703 . . . . 10.0 109.386 178.537 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 309' ' ' ALA . . . . . 0.531 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -67.47 -34.28 76.84 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.692 -0.855 . . . . 10.0 108.692 177.697 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 310' ' ' ARG . . . . . 0.516 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 74.4 mtt180 -60.83 -49.54 77.08 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 108.432 -0.951 . . . . 10.0 108.432 177.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -66.62 -39.85 88.5 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.69 178.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 312' ' ' HIS . . . . . 0.531 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.2 OUTLIER -54.29 -54.72 36.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.596 -0.729 . . . . 10.0 110.031 178.992 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 61.7 t -73.05 -38.21 55.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.534 -0.757 . . . . 10.0 111.968 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -58.88 -53.18 61.26 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 110.392 -0.225 . . . . 10.0 110.392 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -60.97 -31.04 70.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.289 0.566 . . . . 10.0 109.918 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 316' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 316' ' ' LEU . 13.6 mt -71.42 -40.91 70.14 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.732 178.484 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 84.9 mtt180 -64.22 -43.64 94.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.604 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 2.8 m -65.07 -15.53 62.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.616 179.301 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 12.0 m80 -101.14 -39.76 7.52 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.22 -0.445 . . . . 10.0 110.322 178.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 47.5 mt -60.96 -40.03 91.8 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.593 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.62 -60.59 8.82 Favored Pre-proline 0 CA--C 1.535 0.381 0 O-C-N 123.135 0.272 . . . . 10.0 111.309 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -66.71 -36.3 25.15 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 121.337 1.358 . . . . 10.0 111.517 178.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 -58.68 -48.74 80.06 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.638 0.256 . . . . 10.0 111.035 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 324' ' ' SER . . . . . 0.449 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 49.7 p -67.59 -38.62 84.27 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 325' ' ' ASP . . . . . 0.741 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 7.6 t0 -63.52 -40.93 98.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.194 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -64.36 -40.9 96.76 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 108.276 -1.009 . . . . 10.0 108.276 177.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 68.7 mt -63.25 -33.74 76.14 Favored 'General case' 0 C--O 1.221 -0.412 0 CA-C-N 115.386 -0.824 . . . . 10.0 109.604 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 328' ' ' ARG . . . . . 0.741 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 75.8 mtt180 -62.59 -42.49 99.6 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.382 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -70.43 -47.51 60.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.942 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 330' ' ' ARG . . . . . 0.528 ' O ' ' HG2' ' A' ' 334' ' ' ARG . 4.3 ttm180 -61.55 -48.98 78.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.051 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 49.3 mt -62.35 -34.67 77.11 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 116.539 -0.301 . . . . 10.0 110.477 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.9 -47.26 85.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -63.76 -43.23 97.03 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.03 178.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 334' ' ' ARG . . . . . 0.657 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 3.6 mmt85 -58.97 -52.06 67.38 Favored 'General case' 0 C--O 1.227 -0.108 0 N-CA-C 109.425 -0.583 . . . . 10.0 109.425 178.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 58.1 mt -63.82 -37.38 87.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.36 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -61.5 -45.14 95.49 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.268 -0.271 . . . . 10.0 110.268 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.17 -39.68 86.48 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 82.2 mt -67.53 -19.56 65.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.579 -0.737 . . . . 10.0 111.084 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 33.9 mtpt -91.47 -46.38 8.02 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.633 -0.506 . . . . 10.0 109.633 178.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -58.8 -53.38 59.05 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.983 -0.747 . . . . 10.0 108.983 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 341' ' ' ASN . . . . . 0.407 ' OD1' ' HB3' ' C' ' 432' ' ' LYS . 66.5 m-20 -76.17 -23.6 54.73 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.477 178.385 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -66.71 -46.09 78.55 Favored Glycine 0 CA--C 1.507 -0.455 0 N-CA-C 111.308 -0.717 . . . . 10.0 111.308 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.95 -38.38 95.95 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 110.113 -1.195 . . . . 10.0 110.113 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.13 -43.13 92.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.072 -0.714 . . . . 10.0 109.072 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 345' ' ' ARG . . . . . 0.539 ' HD3' ' OE2' ' C' ' 433' ' ' GLU . 19.2 mtm180 -60.19 -49.96 75.57 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.074 178.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 94.8 mt -60.03 -44.39 94.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.42 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.72 -48.16 80.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.032 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 348' ' ' GLU . . . . . 0.431 ' HB3' ' NZ ' ' A' ' 352' ' ' LYS . 4.7 mt-10 -62.03 -36.6 82.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.295 179.498 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -66.97 -38.66 86.48 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.543 -0.54 . . . . 10.0 109.543 178.338 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 34.5 m-70 -66.02 -39.5 90.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 10.0 109.975 178.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -63.88 -47.12 81.91 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.127 -0.694 . . . . 10.0 109.127 178.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 352' ' ' LYS . . . . . 0.456 ' NZ ' ' HB3' ' C' ' 425' ' ' GLU . 27.7 mttp -66.85 -33.28 75.26 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.762 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.11 -44.61 79.52 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 56.8 m -61.13 -47.32 86.8 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -61.59 -44.53 96.83 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.905 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 356' ' ' HIS . . . . . 0.448 ' HB2' ' O ' ' A' ' 352' ' ' LYS . 0.1 OUTLIER -58.35 -48.28 81.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.154 179.359 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 62.7 mt -61.11 -35.57 77.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.574 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 19.2 m -63.9 -51.98 62.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.015 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.36 -30.88 71.76 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.087 0.47 . . . . 10.0 110.098 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 19.4 mt -68.23 -35.4 77.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.423 178.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 26.6 p -67.22 -27.73 67.48 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.561 -0.533 . . . . 10.0 109.561 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -77.23 -0.85 26.8 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 115.613 -0.722 . . . . 10.0 110.068 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.567 ' HG2' HG22 ' C' ' 411' ' ' THR . 89.7 mttt -116.78 -42.33 2.98 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.396 -0.82 . . . . 10.0 108.823 178.496 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -63.29 -21.14 66.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.538 -0.756 . . . . 10.0 111.573 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.969 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 94.2 mttt -104.98 -69.24 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.457 0 N-CA-C 112.172 0.434 . . . . 10.0 112.172 179.291 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.969 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 23.1 Cg_exo -66.28 -50.33 1.51 Allowed 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.502 2.134 . . . . 10.0 113.319 -178.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 367' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -64.62 -43.37 93.95 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.678 0.275 . . . . 10.0 111.74 -179.214 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 368' ' ' LEU . . . . . 0.465 HD23 ' HA ' ' A' ' 368' ' ' LEU . 13.8 mt -67.11 -35.99 80.96 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.763 -0.375 . . . . 10.0 110.278 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 369' ' ' GLU . . . . . 0.687 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 5.8 tt0 -66.11 -38.2 87.61 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.527 -0.916 . . . . 10.0 108.527 178.211 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.04 -43.06 96.69 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 178.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 371' ' ' LEU . . . . . 0.449 HD12 HD23 ' A' ' 368' ' ' LEU . 19.0 mt -62.28 -45.58 92.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.601 -0.727 . . . . 10.0 110.638 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 372' ' ' ARG . 17.9 mtt180 -67.53 -37.84 83.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.943 0.402 . . . . 10.0 109.941 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.687 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.7 mt-30 -67.27 -16.92 64.56 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 115.569 -0.741 . . . . 20.0 111.34 178.816 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -96.3 -40.36 3.99 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 108.746 -1.742 . . . . 10.0 108.746 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 62.4 mt -58.24 -36.84 73.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.66 -0.27 . . . . 10.0 111.672 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 376' ' ' LEU . . . . . 0.42 ' O ' ' HG2' ' A' ' 380' ' ' GLU . 96.1 mt -59.65 -63.8 3.78 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 120.925 -0.31 . . . . 10.0 111.364 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 377' ' ' PRO . . . . . 0.416 ' CD ' ' HB2' ' A' ' 376' ' ' LEU . 19.7 Cg_endo -61.83 -35.14 80.3 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 121.994 1.796 . . . . 10.0 111.676 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 6.1 t -61.26 -49.5 84.33 Favored 'Isoleucine or valine' 0 C--O 1.231 0.108 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 178.572 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 34.3 mt -63.06 -33.66 75.92 Favored 'General case' 0 C--O 1.224 -0.255 0 N-CA-C 109.759 -0.459 . . . . 10.0 109.759 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 380' ' ' GLU . . . . . 0.442 ' O ' HG23 ' A' ' 384' ' ' VAL . 6.0 mm-40 -61.51 -55.51 30.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.017 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.3 p -63.37 -35.45 80.44 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.006 0.432 . . . . 10.0 110.136 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.9 m-30 -63.76 -47.33 81.39 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.144 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -57.8 -40.5 80.07 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 384' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 380' ' ' GLU . 68.8 t -58.09 -50.82 76.86 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.103 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.844 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -66.45 -34.63 78.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.731 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 386' ' ' PHE . . . . . 0.535 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 22.0 m-30 -69.34 -45.58 69.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.904 0.383 . . . . 10.0 110.109 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.45 -38.02 89.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.223 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 388' ' ' SER . . . . . 0.573 ' HB2' ' HD3' ' C' ' 594' ' ' LYS . 3.4 p -74.71 -31.89 61.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.8 0.333 . . . . 10.0 110.906 179.53 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -71.16 -34.89 71.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.367 179.072 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 390' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 87.3 mt -59.37 -37.19 77.28 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.256 179.248 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -64.43 -45.3 88.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.469 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -61.12 -49.95 75.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.518 -0.765 . . . . 10.0 111.609 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -57.4 -43.87 84.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.708 0.29 . . . . 10.0 111.228 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 27.5 m -63.98 -50.26 69.28 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.277 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.864 -179.47 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 92.7 mt . . . . . 0 CA--C 1.522 -0.1 0 CA-C-O 120.995 0.426 . . . . 10.0 110.277 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 85.2 mt -71.67 -31.51 66.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.395 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -67.32 -45.98 74.85 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.892 -0.781 . . . . 10.0 108.892 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -64.31 -40.32 95.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.439 178.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -35.85 79.6 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.328 179.132 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -60.55 -49.18 78.59 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.008 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 1.1 m -59.27 -42.14 90.51 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.936 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 408' ' ' VAL . . . . . 0.431 ' O ' ' HB2' ' C' ' 412' ' ' PHE . 70.8 t -64.41 -44.22 97.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.316 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 30.0 m -62.4 -45.99 90.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.396 -0.366 . . . . 10.0 110.496 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 25.2 m -63.17 -45.55 91.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.467 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 411' ' ' THR . . . . . 0.567 HG22 ' HG2' ' A' ' 363' ' ' LYS . 12.8 p -67.14 -36.94 82.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.698 0.285 . . . . 10.0 111.11 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 412' ' ' PHE . . . . . 0.431 ' HB2' ' O ' ' C' ' 408' ' ' VAL . 2.7 t80 -67.87 -39.72 83.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.994 179.024 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 47.4 m -64.34 -43.28 95.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.307 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -66.14 -32.42 73.86 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.245 0.545 . . . . 10.0 109.969 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 415' ' ' LEU . . . . . 0.403 ' O ' ' HG ' ' C' ' 419' ' ' LEU . 7.7 mt -65.62 -44.24 87.1 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.067 -0.716 . . . . 10.0 109.067 177.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 416' ' ' ARG . . . . . 0.517 ' HA ' HD12 ' C' ' 419' ' ' LEU . 98.6 mtt180 -65.6 -34.3 77.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.259 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 417' ' ' GLU . . . . . 0.458 ' O ' ' HD2' ' C' ' 421' ' ' PRO . 42.2 mt-10 -65.58 -40.69 93.04 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.362 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -67.56 -33.91 75.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.862 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 419' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' C' ' 416' ' ' ARG . 85.7 mt -62.11 -12.84 21.58 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-N 115.722 -0.672 . . . . 10.0 111.867 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -74.32 -75.72 0.76 Allowed Glycine 0 CA--C 1.522 0.509 0 C-N-CA 120.494 -0.86 . . . . 10.0 111.058 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 421' ' ' PRO . . . . . 0.458 ' HD2' ' O ' ' C' ' 417' ' ' GLU . 16.2 Cg_endo -58.33 -39.6 82.82 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 123.12 2.547 . . . . 10.0 112.612 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 49.0 t -59.89 -43.12 91.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 87.8 m -68.44 -39.19 81.59 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.823 -0.436 . . . . 10.0 109.823 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -61.1 -48.31 82.27 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 425' ' ' GLU . . . . . 0.456 ' HB3' ' NZ ' ' A' ' 352' ' ' LYS . 69.1 mt-10 -62.69 -47.72 82.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.36 -0.837 . . . . 10.0 109.783 178.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -57.59 -41.12 80.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.3 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -67.84 -42.36 81.55 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.175 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 428' ' ' ASP . . . . . 0.489 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 3.9 t70 -63.59 -37.75 88.5 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.321 -0.622 . . . . 10.0 109.321 179.011 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -67.84 -43.39 79.62 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.486 -0.779 . . . . 10.0 108.96 178.004 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 30.5 mt -61.28 -36.57 80.42 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.915 -0.584 . . . . 10.0 109.74 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -67.4 -33.87 76.08 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.241 178.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 432' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 56.9 mttp -67.59 -47.78 68.75 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.028 -1.101 . . . . 10.0 108.028 177.411 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 433' ' ' GLU . . . . . 0.539 ' OE2' ' HD3' ' A' ' 345' ' ' ARG . 42.3 mt-10 -59.72 -47.6 85.01 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 114.951 -1.022 . . . . 10.0 111.106 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 2.8 p -63.41 -37.37 87.02 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.599 0.238 . . . . 10.0 110.825 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -62.98 -49.51 74.41 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.753 -0.832 . . . . 10.0 108.753 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.48 -46.38 93.94 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.885 -0.886 . . . . 10.0 110.885 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 59.2 mt -59.27 -34.12 71.88 Favored 'General case' 0 C--O 1.222 -0.385 0 CA-C-O 120.503 0.192 . . . . 10.0 110.564 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 52.3 mtt85 -69.24 -36.49 77.23 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 178.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -72.11 -33.02 67.51 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.997 -0.742 . . . . 10.0 108.997 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 440' ' ' GLU . . . . . 0.657 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 47.2 mt-10 -71.06 -53.39 14.86 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.182 -0.917 . . . . 10.0 109.197 178.135 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 441' ' ' MET . . . . . 0.564 ' HA ' ' HB3' ' C' ' 444' ' ' ASP . 64.1 mtt -65.58 -29.16 69.73 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.616 0.969 . . . . 10.0 113.616 -178.576 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 1.8 p -61.17 -47.46 86.08 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.018 -0.673 . . . . 10.0 109.442 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -78.07 -39.61 41.11 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.954 -0.567 . . . . 10.0 109.855 178.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 444' ' ' ASP . . . . . 0.564 ' HB3' ' HA ' ' C' ' 441' ' ' MET . 11.8 t70 -56.04 -60.32 3.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.095 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 96.0 mt -60.31 -41.97 94.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.954 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.91 -39.79 90.89 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.851 -0.339 . . . . 10.0 110.91 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.67 -38.08 80.11 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.739 -0.838 . . . . 10.0 108.739 178.362 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 8.9 t -58.98 -43.42 88.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.292 0 CA-C-N 115.753 -0.658 . . . . 10.0 109.232 178.255 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -65.97 -40.77 91.54 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 178.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -74.48 -3.97 33.93 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.491 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 451' ' ' LYS . . . . . 0.677 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 4.1 mttp -106.34 -42.94 4.91 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.412 178.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 31.3 t -61.77 -41.47 90.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.678 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 453' ' ' GLN . . . . . 0.671 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 69.2 mt-30 -55.41 -60.48 8.27 Favored Pre-proline 0 CA--C 1.536 0.433 0 O-C-N 123.164 0.29 . . . . 10.0 111.461 179.173 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 454' ' ' PRO . . . . . 0.671 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 21.4 Cg_exo -67.74 -26.46 38.93 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 122.106 1.871 . . . . 10.0 111.334 178.655 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 455' ' ' TYR . . . . . 0.677 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.1 OUTLIER -64.23 -53.11 54.33 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 179.284 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 68.1 mt -66.31 -38.3 87.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.729 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 457' ' ' ASP . . . . . 0.449 ' HB3' ' HA ' ' C' ' 454' ' ' PRO . 1.5 t70 -59.57 -44.9 93.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.327 178.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 458' ' ' ASP . . . . . 0.518 ' HA ' ' HZ2' ' C' ' 461' ' ' LYS . 2.8 t70 -78.96 -33.6 45.09 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.917 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 459' ' ' PHE . . . . . 0.453 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 0.1 OUTLIER -62.85 -43.4 98.91 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 178.666 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -63.66 -42.18 98.11 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 123.368 0.417 . . . . 10.0 110.051 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 461' ' ' LYS . . . . . 0.518 ' HZ2' ' HA ' ' C' ' 458' ' ' ASP . 4.3 mttp -58.8 -43.09 90.42 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.213 0.53 . . . . 10.0 109.621 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -72.72 -40.6 65.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.306 -0.861 . . . . 10.0 110.436 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 1.2 m95 -62.49 -38.81 91.35 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.337 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -67.72 -42.97 81.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.161 178.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 0.595 ' HB3' HD11 ' C' ' 469' ' ' LEU . 38.7 mt-10 -62.61 -35.53 79.85 Favored 'General case' 0 C--N 1.333 -0.117 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 178.651 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -76.73 -48.21 19.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.148 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 9.8 ttt -61.4 -57.06 13.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.001 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -65.56 -38.67 90.25 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.252 -0.647 . . . . 10.0 109.252 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 0.595 HD11 ' HB3' ' C' ' 465' ' ' GLU . 96.4 mt -59.34 -36.27 75.39 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.358 -0.837 . . . . 20.0 109.925 178.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -77.19 -39.38 48.99 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.62 178.246 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -60.98 -38.65 86.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.996 0.427 . . . . 10.0 110.189 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -81.4 6.74 13.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.536 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 473' ' ' LYS . . . . . 0.487 ' HG2' HD13 ' A' ' 301' ' ' LEU . 51.3 mttp -123.0 -50.29 1.93 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.277 178.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 78.0 t -61.12 -36.89 75.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.691 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.28 -59.49 10.84 Favored Pre-proline 0 CA--C 1.534 0.327 0 N-CA-C 111.758 0.281 . . . . 10.0 111.758 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -60.96 -37.39 77.24 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 121.584 1.523 . . . . 10.0 111.051 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 38.5 mt -67.06 -33.85 76.4 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.006 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 24.9 mtt180 -63.55 -38.61 91.78 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 178.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -64.98 -45.76 84.27 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 178.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.68 -44.18 94.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.716 178.762 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 63.3 mt -65.92 -41.82 90.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.922 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -63.72 -49.68 72.11 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -65.06 -42.13 94.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.928 0.394 . . . . 10.0 110.278 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.54 -36.42 93.33 Favored Glycine 0 N--CA 1.447 -0.615 0 N-CA-C 111.011 -0.835 . . . . 10.0 111.011 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 485' ' ' ALA . . . . . 0.441 ' O ' ' HG ' ' C' ' 489' ' ' LEU . . . -76.12 -39.84 54.19 Favored 'General case' 0 C--O 1.219 -0.511 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 63.2 mtt180 -61.89 -43.78 98.16 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.978 -0.749 . . . . 10.0 108.978 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -65.74 -40.06 91.76 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 108.812 -0.81 . . . . 10.0 108.812 178.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -65.77 -34.81 79.04 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 109.614 -0.514 . . . . 10.0 109.614 178.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 489' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' C' ' 485' ' ' ALA . 57.9 mt -65.48 -41.44 93.29 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.728 -0.841 . . . . 10.0 108.728 178.461 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -68.55 -40.44 80.65 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.722 -0.844 . . . . 10.0 108.722 178.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -60.29 -44.26 95.52 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 108.521 -0.918 . . . . 10.0 108.521 177.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 46.7 mt -69.87 -33.06 71.73 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.854 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -61.09 -40.14 92.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.924 0.393 . . . . 10.0 110.56 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -79.57 11.66 2.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.586 0.708 . . . . 10.0 110.36 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.58 ' O ' ' HB2' ' C' ' 499' ' ' LEU . 54.7 mttp -125.59 -57.6 1.45 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.628 -0.715 . . . . 10.0 109.806 178.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 90.2 mt -60.71 -35.22 75.77 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.443 0.534 . . . . 10.0 112.443 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 497' ' ' SER . . . . . 0.812 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 6.8 m -76.13 -62.84 0.67 Allowed Pre-proline 0 CA--C 1.538 0.517 0 C-N-CA 121.052 -0.259 . . . . 10.0 111.457 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 498' ' ' PRO . . . . . 0.812 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 52.1 Cg_exo -58.73 -54.54 2.76 Favored 'Trans proline' 0 C--N 1.357 1.015 0 C-N-CA 122.077 1.851 . . . . 10.0 111.787 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 499' ' ' LEU . . . . . 0.58 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 48.1 mt -65.92 -27.58 68.3 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 109.926 -0.398 . . . . 10.0 109.926 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -65.86 -47.12 77.89 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 110.127 -1.189 . . . . 10.0 110.127 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -64.8 -39.46 93.62 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.879 -0.785 . . . . 10.0 108.879 178.227 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -61.72 -52.39 64.46 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.64 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 88.0 mmm -58.87 -38.16 78.15 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.359 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -63.79 -45.57 89.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.853 0.359 . . . . 10.0 110.262 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 505' ' ' ASP . . . . . 0.441 ' O ' ' HB3' ' C' ' 508' ' ' ARG . 26.0 t70 -68.17 -45.52 73.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.696 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.496 ' HD2' ' OE1' ' A' ' 268' ' ' GLU . 13.4 mtt180 -63.73 -43.1 97.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.243 179.42 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -65.14 -33.42 75.97 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 177.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 508' ' ' ARG . . . . . 0.441 ' HB3' ' O ' ' C' ' 505' ' ' ASP . 37.5 ttm180 -62.94 -43.92 97.48 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 108.685 -0.858 . . . . 10.0 108.685 178.077 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 509' ' ' ALA . . . . . 0.633 ' HB1' ' HE3' ' A' ' 264' ' ' LYS . . . -65.74 -33.45 75.9 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.657 -0.702 . . . . 10.0 109.36 178.25 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 510' ' ' HIS . . . . . 0.543 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 6.2 m-70 -66.76 -51.12 59.55 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.103 -0.703 . . . . 10.0 109.103 178.472 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 511' ' ' VAL . . . . . 0.418 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 95.9 t -64.25 -42.33 95.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.659 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.52 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 34.9 t70 -61.95 -39.01 90.64 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 179.059 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -64.98 -40.22 94.65 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.332 -0.988 . . . . 10.0 108.332 177.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 514' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 87.6 mt -62.29 -29.71 70.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.472 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 515' ' ' ARG . . . . . 0.52 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 75.5 mtt180 -66.11 -30.68 71.22 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.396 -0.594 . . . . 10.0 109.396 178.404 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.4 10.94 33.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.605 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 517' ' ' HIS . . . . . 0.468 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 1.8 m-70 -122.82 -49.64 1.98 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.332 -0.395 . . . . 10.0 111.435 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 89.8 mt -86.62 -42.77 13.18 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 519' ' ' ALA . . . . . 0.425 ' N ' ' HD2' ' C' ' 520' ' ' PRO . . . -56.18 -56.3 32.66 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 111.793 0.294 . . . . 10.0 111.793 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 520' ' ' PRO . . . . . 0.425 ' HD2' ' N ' ' C' ' 519' ' ' ALA . 25.6 Cg_endo -62.99 -29.89 76.05 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 121.857 1.704 . . . . 10.0 110.627 178.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 521' ' ' TYR . . . . . 0.407 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 0.0 OUTLIER -64.28 -39.63 94.32 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.886 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 15.8 m -62.52 -40.56 97.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.669 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 523' ' ' ASP . . . . . 0.479 ' O ' ' HG3' ' C' ' 527' ' ' GLN . 0.3 OUTLIER -65.68 -47.58 74.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.392 179.328 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -65.01 -37.08 86.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.615 -0.72 . . . . 10.0 110.804 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 23.8 mt -64.11 -38.41 90.95 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.117 -0.698 . . . . 10.0 109.117 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 50.6 mtt85 -62.94 -37.5 87.28 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.069 178.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 527' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' C' ' 523' ' ' ASP . 88.3 mt-30 -59.87 -42.92 94.78 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 179.274 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 528' ' ' ARG . . . . . 0.42 ' HB3' ' OE1' ' A' ' 242' ' ' GLU . 10.0 mtt180 -74.0 -44.44 54.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.103 179.268 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 68.0 mt -58.38 -38.82 78.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.031 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 530' ' ' ALA . . . . . 0.469 ' O ' ' HG2' ' C' ' 534' ' ' GLU . . . -62.6 -40.15 96.03 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.407 -0.361 . . . . 10.0 110.331 179.166 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.75 -41.33 79.08 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.127 -0.694 . . . . 10.0 109.127 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 532' ' ' ARG . . . . . 0.438 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 19.1 ttm180 -60.18 -42.29 94.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.357 -0.838 . . . . 10.0 109.108 178.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.68 -32.39 73.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.626 -0.716 . . . . 10.0 110.48 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 534' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' C' ' 538' ' ' GLU . 9.6 mm-40 -67.38 -44.65 78.39 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.567 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.57 -39.67 94.98 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.226 178.446 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 536' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 93.8 mt -68.7 -22.73 64.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.748 179.243 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -83.15 -47.25 11.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.289 -0.414 . . . . 10.0 109.972 179.027 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 538' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' C' ' 534' ' ' GLU . 9.3 mm-40 -64.69 -53.73 42.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.184 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -68.13 -43.28 78.72 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.311 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -58.49 -51.12 60.66 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.964 -0.636 . . . . 10.0 111.821 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.43 -41.88 99.74 Favored Glycine 0 N--CA 1.451 -0.361 0 N-CA-C 111.677 -0.569 . . . . 10.0 111.677 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -64.14 -50.35 68.56 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.982 -0.377 . . . . 10.0 109.982 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 543' ' ' ARG . . . . . 0.455 HH11 ' HD2' ' C' ' 543' ' ' ARG . 50.9 mtt180 -58.3 -35.55 72.0 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.624 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 33.2 mt -62.19 -47.09 86.03 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.696 -0.483 . . . . 10.0 109.696 178.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -64.45 -39.53 93.99 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.89 -0.596 . . . . 10.0 109.635 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 78.9 mt-10 -65.46 -47.69 75.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.777 178.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 15.7 m-30 -60.03 -40.86 90.8 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.323 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 29.8 m-70 -62.63 -46.14 89.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.827 0.346 . . . . 10.0 110.378 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.06 -47.5 77.11 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.354 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.39 -32.24 73.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.636 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.22 -37.1 80.5 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.299 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 23.1 m -66.2 -47.44 73.87 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.398 -0.964 . . . . 10.0 108.398 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -61.85 -33.98 75.16 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.717 -0.674 . . . . 10.0 109.521 178.566 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -74.0 -33.62 63.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.141 179.087 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 44.0 mt -69.34 -44.02 72.47 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.78 -0.452 . . . . 10.0 109.78 178.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 10.1 m -61.97 -40.73 96.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.471 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 557' ' ' THR . . . . . 0.534 ' HA ' ' HG2' ' C' ' 560' ' ' GLU . 4.6 p -72.87 -17.57 61.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.247 0.546 . . . . 10.0 110.526 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 558' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' C' ' 558' ' ' LEU . 15.6 mt -87.09 -40.2 14.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.858 -0.61 . . . . 10.0 109.513 178.342 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.5 p -67.26 -28.03 67.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.217 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 560' ' ' GLU . . . . . 0.534 ' HG2' ' HA ' ' C' ' 557' ' ' THR . 2.7 pt-20 -72.75 -5.49 38.16 Favored 'General case' 0 C--N 1.339 0.12 0 CA-C-O 121.405 0.621 . . . . 10.0 110.106 178.809 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 561' ' ' LYS . . . . . 0.564 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 12.4 mptt -116.79 -39.3 3.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.241 177.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -65.87 -16.58 63.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.856 -0.611 . . . . 10.0 111.179 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 563' ' ' LYS . . . . . 0.944 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 95.9 mttt -103.59 -70.29 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.409 0 CA-C-O 119.311 -0.376 . . . . 10.0 111.199 178.744 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 564' ' ' PRO . . . . . 0.944 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 26.2 Cg_exo -64.04 -49.75 3.58 Favored 'Trans proline' 0 C--N 1.36 1.154 0 C-N-CA 122.405 2.07 . . . . 10.0 113.263 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 565' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -64.58 -38.95 92.78 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 121.14 -0.224 . . . . 10.0 111.54 -179.493 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 566' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' C' ' 566' ' ' LEU . 7.1 mt -66.64 -38.62 87.26 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.29 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -66.63 -36.87 83.62 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 178.071 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.62 -47.28 84.45 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.742 -0.836 . . . . 10.0 108.742 177.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 569' ' ' LEU . . . . . 0.447 HD12 HD23 ' C' ' 566' ' ' LEU . 89.4 mt -61.59 -40.89 96.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.455 178.851 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 570' ' ' ARG . . . . . 0.429 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 65.6 mtt180 -65.62 -46.93 77.41 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.015 -0.365 . . . . 10.0 110.015 178.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 571' ' ' GLN . . . . . 0.532 ' HA ' HD12 ' C' ' 574' ' ' LEU . 98.5 mt-30 -65.86 -22.74 66.55 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 115.788 -0.642 . . . . 20.0 111.983 179.433 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -86.15 -40.09 7.64 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 109.189 -1.564 . . . . 10.0 109.189 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 29.8 mt -64.88 -32.13 73.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.579 -0.31 . . . . 10.0 111.624 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 574' ' ' LEU . . . . . 0.532 HD12 ' HA ' ' C' ' 571' ' ' GLN . 35.7 mt -54.35 -62.28 4.22 Favored Pre-proline 0 CA--C 1.54 0.581 0 N-CA-C 112.357 0.502 . . . . 10.0 112.357 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -66.05 -31.09 46.72 Favored 'Trans proline' 0 C--N 1.357 0.974 0 C-N-CA 121.966 1.777 . . . . 10.0 111.001 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 11.6 t -64.65 -46.37 92.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.058 -0.519 . . . . 10.0 109.828 179.034 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 46.3 mt -64.71 -38.6 91.54 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 578' ' ' GLU . . . . . 0.46 ' O ' HG23 ' C' ' 582' ' ' VAL . 28.7 mt-10 -60.17 -50.84 72.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.55 178.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 2.7 p -68.27 -38.13 81.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.678 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -60.21 -44.44 95.14 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.246 178.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 581' ' ' LYS . . . . . 0.462 ' O ' ' HG ' ' C' ' 585' ' ' LEU . 68.5 mttm -62.1 -36.89 83.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.654 178.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 582' ' ' VAL . . . . . 0.46 HG23 ' O ' ' C' ' 578' ' ' GLU . 53.2 t -62.29 -46.3 96.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 178.648 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.63 -34.29 77.88 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.352 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -69.38 -44.44 71.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.287 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 585' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' C' ' 581' ' ' LYS . 88.0 mt -57.29 -47.2 82.06 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.538 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 1.9 p -68.81 -46.15 69.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.613 179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -57.8 -54.0 51.88 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.441 -0.345 . . . . 10.0 111.743 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 88.9 mt -57.66 -41.06 80.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.804 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -71.4 -51.59 23.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.583 -0.28 . . . . 10.0 111.725 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -62.24 -40.69 97.0 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.944 0.35 . . . . 10.0 111.944 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 591' ' ' TYR . . . . . 0.477 ' O ' ' HG ' ' C' ' 595' ' ' LEU . 8.7 m-85 -64.46 -48.74 74.14 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.919 0.34 . . . . 10.0 111.919 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 11.8 p -63.18 -36.48 83.76 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 111.949 0.352 . . . . 10.0 111.949 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -63.8 -28.55 69.94 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.453 -0.34 . . . . 10.0 111.092 179.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 594' ' ' LYS . . . . . 0.573 ' HD3' ' HB2' ' A' ' 388' ' ' SER . 96.4 mttt -95.15 -15.49 23.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.428 -0.351 . . . . 10.0 111.504 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 595' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' C' ' 591' ' ' TYR . 60.9 mt -80.19 -25.07 39.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.293 -0.412 . . . . 10.0 111.381 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 40.5 t30 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.793 -0.623 . . . . 10.0 109.759 179.989 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 121.027 0.441 . . . . 10.0 111.317 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 3' ' ' GLU . . . . . 0.438 ' HG2' ' HB2' ' B' ' 52' ' ' LEU . 9.3 mt-10 -115.32 130.61 56.95 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.047 -0.723 . . . . 10.0 109.047 178.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -122.26 136.38 54.89 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.851 0.357 . . . . 10.0 110.91 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.525 ' HD3' ' HB2' ' B' ' 54' ' ' ASP . 27.1 mmtt -107.52 114.37 28.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.372 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.48 HD22 HD23 ' B' ' 159' ' ' LEU . 14.2 mt -109.47 132.1 54.45 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.389 -179.12 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.429 HG22 ' HB3' ' B' ' 56' ' ' LEU . 67.2 t -121.44 125.92 74.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.965 0.412 . . . . 10.0 110.916 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 3.6 t -93.19 113.14 27.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.555 HG21 HD11 ' B' ' 100' ' ' ILE . 20.9 m -96.72 168.43 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.993 0.425 . . . . 10.0 111.801 -179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 10' ' ' GLY . . . . . 0.483 ' HA2' ' CZ ' ' B' ' 96' ' ' TYR . . . 131.65 161.0 9.99 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 110.873 -0.891 . . . . 10.0 110.873 -179.463 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.12 -140.55 0.07 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.891 0.376 . . . . 10.0 110.89 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -101.69 159.51 18.33 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.69 -0.767 . . . . 10.0 111.684 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.97 -24.54 15.13 Favored Glycine 0 CA--C 1.519 0.311 0 C-N-CA 121.048 -0.596 . . . . 10.0 113.004 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 14' ' ' VAL . . . . . 0.447 HG23 ' HG3' ' B' ' 16' ' ' LYS . 3.3 m -60.65 -50.74 79.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 112.317 0.488 . . . . 10.0 112.317 -179.476 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 105.23 35.84 3.04 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.783 -0.722 . . . . 10.0 113.351 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' LYS . . . . . 0.447 ' HG3' HG23 ' B' ' 14' ' ' VAL . 50.6 mtmt -59.49 -54.06 50.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.166 0.508 . . . . 10.0 111.255 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.62 -37.65 76.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.593 -0.731 . . . . 10.0 111.863 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.72 -44.79 92.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.339 -0.392 . . . . 10.0 110.997 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 99.1 mt -66.98 -33.26 75.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.055 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' THR . . . . . 0.4 ' O ' HG12 ' B' ' 24' ' ' ILE . 7.1 m -71.15 -49.55 42.81 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.991 -0.549 . . . . 10.0 111.357 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 85.2 mt -63.31 -29.97 48.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.184 0.516 . . . . 10.0 110.43 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.597 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 6.3 tp-100 -66.75 -16.78 64.49 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.623 -0.717 . . . . 10.0 111.107 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 18.7 tp -106.5 -31.45 8.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.07 0.462 . . . . 10.0 110.901 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 24' ' ' ILE . . . . . 0.4 HG12 ' O ' ' B' ' 20' ' ' THR . 51.1 mm -76.04 -49.6 25.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.704 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -115.35 -8.97 12.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.764 0.316 . . . . 10.0 111.201 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.597 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 20.8 m120 65.83 41.53 3.8 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.317 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -133.75 142.79 48.09 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.018 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -99.97 137.23 38.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.491 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 19.1 m -89.87 159.55 2.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.906 0.384 . . . . 10.0 111.558 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -121.73 -19.92 6.63 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.351 0.596 . . . . 10.0 110.256 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -93.47 156.9 16.49 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.271 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -86.28 104.83 16.18 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 110.111 -0.329 . . . . 10.0 110.111 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 31.9 t70 -77.54 115.77 52.43 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.757 179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 34' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 3.8 Cg_exo -78.31 62.59 8.16 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 123.24 2.626 . . . . 10.0 110.47 179.378 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 35' ' ' THR . . . . . 0.513 HG22 ' HA ' ' B' ' 59' ' ' ALA . 0.8 OUTLIER -61.01 130.97 49.08 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.291 -0.868 . . . . 10.0 112.118 -179.628 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.438 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 74.3 mt -121.42 -53.12 3.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.106 -0.952 . . . . 10.0 108.566 178.418 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.28 104.79 3.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.514 -0.767 . . . . 10.0 109.345 179.493 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -159.0 137.5 10.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.423 -0.353 . . . . 10.0 111.269 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 15.4 m -135.76 149.63 49.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.812 0.339 . . . . 10.0 111.137 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -126.07 142.31 51.57 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 41' ' ' ARG . . . . . 0.528 ' HD3' ' OD2' ' B' ' 54' ' ' ASP . 30.2 ttp180 -129.06 133.05 47.54 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 111.838 0.31 . . . . 10.0 111.838 -178.368 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 30.1 mtpt -143.56 175.0 10.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.872 -0.604 . . . . 10.0 110.417 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -115.11 120.27 39.23 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 39.2 t -131.01 132.93 63.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.67 0.272 . . . . 10.0 110.651 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 38.9 t -78.61 111.66 15.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 108.635 -0.876 . . . . 10.0 108.635 178.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 46' ' ' ILE . . . . . 0.772 HD11 HD11 ' B' ' 53' ' ' LEU . 38.3 mt -114.28 117.7 56.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 120.883 0.373 . . . . 10.0 111.17 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.627 ' HB2' HH22 ' B' ' 164' ' ' ARG . 35.9 m-20 59.85 32.08 21.08 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.476 -0.783 . . . . 10.0 111.076 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.07 -29.93 7.13 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.69 -0.687 . . . . 10.0 113.004 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -84.8 146.59 27.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.906 0.384 . . . . 10.0 111.286 -179.308 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 14.8 t -102.86 139.19 38.75 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.899 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 3.0 p -154.12 158.45 40.44 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.316 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.438 ' HB2' ' HG2' ' B' ' 3' ' ' GLU . 96.6 mt -93.67 120.56 34.1 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.235 -0.654 . . . . 10.0 109.235 179.282 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.772 HD11 HD11 ' B' ' 46' ' ' ILE . 63.7 mt -105.86 124.19 49.18 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.533 0.568 . . . . 10.0 112.533 -178.361 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.528 ' OD2' ' HD3' ' B' ' 41' ' ' ARG . 0.5 OUTLIER -107.77 110.49 22.32 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 107.591 -1.262 . . . . 10.0 107.591 177.84 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 22.8 mt -99.94 114.92 39.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 120.836 0.35 . . . . 10.0 111.489 -178.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.429 ' HB3' HG22 ' B' ' 7' ' ' VAL . 26.4 tp -94.49 112.13 23.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.931 -0.577 . . . . 10.0 111.147 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -93.67 94.83 8.81 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 178.658 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 37.6 p -67.51 161.74 24.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.174 -0.921 . . . . 10.0 113.157 -177.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 59' ' ' ALA . . . . . 0.513 ' HA ' HG22 ' B' ' 35' ' ' THR . . . -65.61 165.24 12.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.578 -0.737 . . . . 10.0 111.112 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -84.28 -80.72 1.05 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.832 -0.699 . . . . 10.0 111.957 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -92.35 114.42 26.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.841 0.353 . . . . 20.0 110.718 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -150.05 160.93 43.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.493 -0.321 . . . . 10.0 110.22 -179.546 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 55.7 mm-40 -106.45 -170.61 1.75 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.009 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -80.12 76.75 6.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.201 0.524 . . . . 10.0 111.195 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.39 147.72 23.91 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.821 179.273 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.29 -35.63 77.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.9 0.381 . . . . 10.0 110.997 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 27.7 ttt -62.42 -37.02 84.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.794 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.65 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 55.8 ttt85 -60.95 -51.8 67.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.815 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.05 -35.35 78.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.776 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -61.17 -41.14 96.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.595 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 71' ' ' TYR . . . . . 0.65 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 2.5 p90 -84.09 -24.71 30.23 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 112.837 0.68 . . . . 10.0 112.837 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 53.1 mmm -76.36 -24.56 54.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.069 0.461 . . . . 10.0 111.242 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -79.73 -0.3 33.61 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.675 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.58 2.05 44.31 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.735 0.643 . . . . 10.0 112.735 -179.2 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -107.06 152.57 16.89 Favored Glycine 0 N--CA 1.454 -0.154 0 C-N-CA 120.248 -0.977 . . . . 10.0 113.108 -179.287 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -99.86 -60.6 1.5 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.964 0.411 . . . . 10.0 110.19 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -99.79 139.59 14.5 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.654 -0.703 . . . . 10.0 111.993 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -125.26 131.08 53.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.925 0.393 . . . . 10.0 111.082 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.776 ' HG ' HD22 ' B' ' 159' ' ' LEU . 77.6 mt -99.88 122.46 42.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.977 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 32.5 m -95.37 86.24 4.46 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.816 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.608 ' HA ' ' HB ' ' B' ' 114' ' ' VAL . 22.0 t -87.29 122.82 39.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.243 -178.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.825 ' HB3' HD11 ' B' ' 93' ' ' ILE . 38.9 p90 -130.04 169.3 15.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.41 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -104.94 123.16 47.28 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.504 179.566 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 2.3 pp -68.29 -10.97 13.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 112.01 0.374 . . . . 10.0 112.01 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 85' ' ' ASN . . . . . 0.566 ' HB3' ' O ' ' B' ' 122' ' ' SER . 0.9 OUTLIER -102.95 10.96 37.97 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.373 -0.376 . . . . 10.0 111.46 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -136.83 104.29 5.45 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.93 -38.21 75.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.791 -0.64 . . . . 10.0 112.008 -178.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -63.0 -39.48 94.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.702 0.287 . . . . 10.0 110.992 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 24.0 t -60.19 -37.56 80.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.969 -0.559 . . . . 10.0 110.644 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -71.21 -39.28 71.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.395 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -66.86 -33.38 75.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.003 0.43 . . . . 10.0 111.145 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.24 -8.23 53.66 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.283 0.475 . . . . 10.0 112.283 -178.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 93' ' ' ILE . . . . . 0.825 HD11 ' HB3' ' B' ' 82' ' ' PHE . 25.8 mm -60.84 -35.83 67.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.109 0.48 . . . . 10.0 110.04 178.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 94' ' ' HIS . . . . . 0.441 ' O ' ' HG2' ' B' ' 98' ' ' GLU . 6.6 t-80 -68.63 -29.95 68.55 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 179.052 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -68.86 -44.12 74.01 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.091 -0.707 . . . . 10.0 109.091 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 96' ' ' TYR . . . . . 0.483 ' CZ ' ' HA2' ' B' ' 10' ' ' GLY . 22.5 m-85 -64.41 -43.87 93.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.6 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -54.87 -51.78 64.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.268 -0.878 . . . . 10.0 111.181 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 98' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' B' ' 94' ' ' HIS . 8.6 mm-40 -66.93 -37.39 84.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.354 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 99' ' ' GLN . . . . . 0.475 ' O ' HG13 ' B' ' 103' ' ' VAL . 32.5 tt0 -60.35 -46.94 88.13 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.484 -0.325 . . . . 10.0 110.213 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 100' ' ' ILE . . . . . 0.555 HD11 HG21 ' B' ' 9' ' ' VAL . 52.6 mt -66.69 -43.34 90.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.815 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 101' ' ' LYS . . . . . 0.539 ' HG2' ' HA ' ' B' ' 107' ' ' GLU . 33.7 mtpt -59.0 -35.98 74.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.856 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 45.9 ttp85 -77.05 -46.38 23.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.872 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.532 HG22 ' HA ' ' B' ' 100' ' ' ILE . 21.1 m -63.39 -28.17 44.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -95.03 -11.53 28.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.53 -0.305 . . . . 10.0 111.004 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 16.9 t70 60.73 21.06 11.09 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.383 0.611 . . . . 10.0 111.099 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 14.0 m -144.74 140.38 28.49 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.268 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 107' ' ' GLU . . . . . 0.539 ' HA ' ' HG2' ' B' ' 101' ' ' LYS . 26.9 mp0 -84.95 -20.0 31.29 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.317 0.58 . . . . 10.0 109.849 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -89.16 78.01 7.44 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.233 -0.894 . . . . 10.0 110.322 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.416 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 89.5 t -127.07 130.63 23.73 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.529 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 110' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 24.1 Cg_exo -64.74 112.36 1.96 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.967 2.445 . . . . 10.0 111.607 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 111' ' ' MET . . . . . 0.586 ' HB2' HG21 ' B' ' 139' ' ' ILE . 54.1 mtt -130.21 158.27 40.19 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.598 -0.519 . . . . 10.0 109.598 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 112' ' ' VAL . . . . . 0.617 ' HB ' HD23 ' B' ' 79' ' ' LEU . 84.3 t -137.31 129.72 42.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 113' ' ' LEU . . . . . 0.495 ' HG ' ' HE1' ' B' ' 82' ' ' PHE . 15.2 tp -82.44 117.74 22.7 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.808 -0.812 . . . . 10.0 108.808 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 114' ' ' VAL . . . . . 0.608 ' HB ' ' HA ' ' B' ' 81' ' ' VAL . 38.7 t -109.75 111.49 36.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 120.94 0.4 . . . . 10.0 111.984 -178.04 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -91.86 88.08 1.33 Allowed Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 110.375 -1.09 . . . . 10.0 110.375 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 116' ' ' ASN . . . . . 0.426 ' HA ' ' O ' ' B' ' 144' ' ' THR . 61.8 t30 -87.46 162.9 17.01 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 -178.028 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 28.3 mttm 67.72 32.84 5.2 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.242 -0.89 . . . . 10.0 111.731 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 28.0 p -85.8 6.71 26.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.288 0.566 . . . . 10.0 110.32 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.69 -21.73 26.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.987 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 82.3 mt -77.61 142.17 65.91 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.429 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.35 -19.91 55.43 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.945 2.43 . . . . 10.0 112.151 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 122' ' ' SER . . . . . 0.566 ' O ' ' HB3' ' B' ' 85' ' ' ASN . 1.7 m -83.04 105.19 13.82 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 179.25 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -127.72 109.91 12.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.968 0.413 . . . . 10.0 111.657 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.05 -42.08 9.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.053 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 30.2 t -87.36 115.44 27.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.685 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -80.16 154.29 28.09 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.289 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 127' ' ' THR . . . . . 0.488 HG23 ' HE2' ' B' ' 141' ' ' PHE . 5.9 m -60.23 -33.92 72.95 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.694 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -61.88 -37.72 85.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.061 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -68.18 -41.63 81.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.179 0.514 . . . . 10.0 110.084 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.99 -48.11 69.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.286 -0.87 . . . . 10.0 111.482 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.472 ' HG3' ' O ' ' B' ' 127' ' ' THR . 92.4 mt-30 -61.81 -38.03 86.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.956 0.408 . . . . 10.0 110.53 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -62.06 -51.5 67.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.744 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 55.6 tp -64.59 -41.77 96.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.003 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.76 -41.21 95.01 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.686 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -63.39 -40.23 96.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.41 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 12.9 m -66.03 -37.76 86.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.646 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 7.3 m-30 -73.87 -29.63 62.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.701 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 88.71 28.39 21.7 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 110.643 -0.983 . . . . 10.0 110.643 -178.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 139' ' ' ILE . . . . . 0.586 HG21 ' HB2' ' B' ' 111' ' ' MET . 46.0 pt -126.41 154.55 74.95 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.439 -0.38 . . . . 10.0 110.461 -179.107 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.21 157.05 29.85 Favored 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.448 2.098 . . . . 10.0 111.756 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.488 ' HE2' HG23 ' B' ' 127' ' ' THR . 37.9 t80 -119.57 126.89 52.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.606 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 36.6 mm -124.41 128.24 73.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.361 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -87.87 125.94 34.76 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.37 -0.974 . . . . 10.0 108.37 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 144' ' ' THR . . . . . 0.426 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 40.6 p -123.3 138.13 54.69 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 113.323 0.86 . . . . 10.0 113.323 -177.634 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 7.7 t -107.47 125.17 50.92 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.094 -1.076 . . . . 10.0 108.094 178.145 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.24 -26.44 52.6 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.233 0.54 . . . . 10.0 110.41 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 46.5 tttp -77.26 -48.29 17.89 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.504 -0.771 . . . . 10.0 112.787 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 148' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' B' ' 149' ' ' ARG . 72.3 p -98.2 -10.99 23.21 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.629 0.603 . . . . 10.0 112.629 -178.383 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 149' ' ' ARG . . . . . 0.4 ' HB2' ' O ' ' B' ' 148' ' ' THR . 15.2 mtp-105 70.95 13.87 6.95 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 122.823 0.449 . . . . 10.0 111.329 -178.614 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 150' ' ' GLN . . . . . 0.403 ' O ' ' HA ' ' B' ' 144' ' ' THR . 36.9 tt0 -62.93 123.52 18.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.306 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 81.06 -13.78 30.29 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.938 -0.574 . . . . 10.0 113.97 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 86.9 t -61.71 -42.84 95.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.436 0.532 . . . . 10.0 112.436 -178.6 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -66.75 -48.26 69.67 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.852 0.316 . . . . 10.0 111.852 -179.035 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -66.77 -26.34 66.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.433 -0.349 . . . . 10.0 111.606 -179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.8 -47.69 85.19 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.966 0.413 . . . . 10.0 110.034 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -66.57 -40.14 88.82 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.958 178.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 19.3 m-30 -63.45 -45.39 91.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.065 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 69.8 m -57.79 -41.92 83.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.81 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.776 HD22 ' HG ' ' B' ' 79' ' ' LEU . 41.5 tp -57.66 -47.59 81.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.448 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.31 -36.42 76.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.232 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 77.7 mtt180 -66.8 -38.0 85.64 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.509 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 162' ' ' GLU . . . . . 0.539 ' HA ' ' HE3' ' B' ' 165' ' ' LYS . 76.0 mm-40 -65.05 -40.85 95.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.834 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 163' ' ' ILE . . . . . 0.49 HG13 ' O ' ' B' ' 159' ' ' LEU . 70.7 mt -61.25 -40.99 87.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.98 179.102 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 164' ' ' ARG . . . . . 0.627 HH22 ' HB2' ' B' ' 47' ' ' ASP . 0.5 OUTLIER -63.93 -40.0 95.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.038 179.465 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 165' ' ' LYS . . . . . 0.539 ' HE3' ' HA ' ' B' ' 162' ' ' GLU . 28.5 mtmt -61.34 -33.62 73.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.097 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 24.3 t-80 -65.0 -39.11 92.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.066 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -69.01 -45.61 70.08 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.963 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -65.86 -47.03 76.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.963 -0.562 . . . . 10.0 111.938 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 54.5 tttm -56.66 -45.16 81.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.671 0.272 . . . . 10.0 111.533 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -65.85 -26.18 67.54 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 111.899 0.333 . . . . 10.0 111.899 -179.639 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 14.7 m . . . . . 0 C--N 1.326 -0.444 0 CA-C-O 120.808 0.337 . . . . 10.0 111.794 -179.47 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.44 0 N-CA-C 111.955 -0.458 . . . . 10.0 111.955 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' D' D ' 809' ' ' THR . . . . . 0.472 ' HB ' ' CG1' ' D' ' 821' ' ' VAL . 6.7 p -123.59 135.47 53.99 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.709 0.29 . . . . 10.0 110.972 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 6.8 t -118.5 133.85 64.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 110.206 -0.294 . . . . 10.0 110.206 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 811' ' ' LYS . . . . . 0.464 ' HE3' ' HB2' ' D' ' 811' ' ' LYS . 14.9 mtmt -87.69 112.92 22.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.485 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 39.1 t -91.52 124.78 44.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 109.736 -0.468 . . . . 10.0 109.736 179.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -88.97 115.01 26.22 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.765 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 83.0 mt -88.86 143.01 30.94 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.272 -179.084 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 815' ' ' PRO . . . . . 0.435 ' HB3' ' HA ' ' D' ' 878' ' ' GLU . 49.3 Cg_endo -68.44 -9.26 25.45 Favored 'Trans proline' 0 N--CA 1.476 0.451 0 C-N-CA 123.213 2.609 . . . . 10.0 112.666 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -88.39 18.59 4.37 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.735 -0.468 . . . . 10.0 109.735 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 26.4 mttt 61.87 47.29 6.14 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.547 0.689 . . . . 10.0 110.838 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -146.1 -177.19 5.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.758 -1.11 . . . . 10.0 108.639 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.92 165.23 37.35 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.952 -0.299 . . . . 10.0 111.351 -179.458 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 9.7 t -151.21 152.29 33.07 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.584 179.042 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 821' ' ' VAL . . . . . 0.472 ' CG1' ' HB ' ' D' ' 809' ' ' THR . 90.1 t -112.82 120.34 62.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 120.971 0.415 . . . . 10.0 110.934 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 31.3 m -113.13 157.51 13.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.612 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.21 133.09 35.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.621 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 13.1 t -86.98 109.29 18.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.556 -0.293 . . . . 10.0 110.328 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 -127.47 150.38 49.68 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -79.76 164.19 23.88 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 120.886 0.374 . . . . 10.0 110.696 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 89.25 -56.73 3.95 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 121.041 -0.599 . . . . 10.0 112.591 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 16.4 ptm -65.36 139.92 58.61 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.11 0.481 . . . . 10.0 111.268 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 829' ' ' SER . . . . . 0.914 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.0 OUTLIER -92.3 172.99 8.04 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.611 -179.374 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' D' D ' 830' ' ' VAL . . . . . 0.455 ' O ' ' HB2' ' D' ' 834' ' ' LEU . 90.5 t -60.83 -35.52 65.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.119 -0.697 . . . . 10.0 109.119 179.081 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 831' ' ' TYR . . . . . 0.629 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 87.0 t80 -58.68 -38.37 78.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.514 -0.766 . . . . 10.0 110.255 178.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -67.04 -58.49 4.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.958 -0.564 . . . . 10.0 111.444 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 1.3 m -61.27 -42.62 98.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.705 -0.68 . . . . 10.0 112.747 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 834' ' ' LEU . . . . . 0.674 HD11 HG21 ' D' ' 877' ' ' VAL . 0.5 OUTLIER -73.68 -24.14 59.92 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.96 0.356 . . . . 10.0 111.96 -179.273 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' D' D ' 835' ' ' ASP . . . . . 0.544 ' HB2' ' O ' ' D' ' 831' ' ' TYR . 35.1 t70 -59.45 -49.67 76.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.978 0.418 . . . . 10.0 110.605 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -60.69 -32.96 72.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.532 -0.758 . . . . 10.0 111.523 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -78.89 -33.4 45.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.774 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 90.1 mt -81.82 -43.79 17.8 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -179.571 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 5.3 mmtp -61.79 -36.71 81.88 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 -179.146 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 3.4 p -72.49 -14.19 16.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.063 0.459 . . . . 10.0 111.459 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 841' ' ' ARG . . . . . 0.423 HH22 ' HB3' ' B' ' 41' ' ' ARG . 1.2 mmt180 -105.02 -6.58 19.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.215 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 83.9 26.59 40.86 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.803 -0.713 . . . . 10.0 112.478 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 8.1 mp -117.5 158.5 24.42 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.101 -0.333 . . . . 10.0 110.101 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -123.99 164.27 19.69 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -79.32 50.07 1.05 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.897 0.38 . . . . 10.0 110.562 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -102.8 -74.57 0.63 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.462 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 75.3 m -87.03 -16.96 34.09 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.793 -0.639 . . . . 10.0 111.237 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 29.3 m -66.85 134.31 51.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.207 -0.452 . . . . 10.0 111.355 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 7.0 p -130.81 140.42 48.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.452 -0.573 . . . . 10.0 109.452 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 15.4 t -109.67 131.82 59.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.098 0.475 . . . . 10.0 111.584 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 851' ' ' TYR . . . . . 0.462 ' CE1' HG22 ' D' ' 860' ' ' VAL . 95.5 m-85 -117.48 157.21 26.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.356 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -110.35 153.79 24.44 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.021 -0.733 . . . . 10.0 109.021 178.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 853' ' ' LEU . . . . . 0.633 HD12 ' HB2' ' D' ' 874' ' ' GLU . 27.3 mt -105.04 51.86 0.75 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.853 0.359 . . . . 10.0 111.856 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 18.1 mt -72.29 86.95 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.398 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 855' ' ' LYS . . . . . 0.427 ' HA ' ' HD3' ' D' ' 855' ' ' LYS . 65.1 mmtt 67.29 41.16 2.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.963 -1.017 . . . . 10.0 112.377 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 86.42 -33.17 3.71 Favored Glycine 0 C--N 1.332 0.312 0 CA-C-N 115.914 -0.584 . . . . 10.0 113.852 178.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 23.1 mmt-85 -70.58 114.34 8.58 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.783 0.325 . . . . 10.0 111.376 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.94 100.14 0.7 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.804 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 1.4 m -97.38 112.73 24.43 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.105 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 860' ' ' VAL . . . . . 0.462 HG22 ' CE1' ' D' ' 851' ' ' TYR . 2.0 t -58.17 150.88 4.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.989 -0.551 . . . . 10.0 110.799 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 4.3 t -137.53 166.72 23.22 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.34 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -106.67 160.25 15.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.681 0.277 . . . . 10.0 110.701 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 863' ' ' TRP . . . . . 0.629 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 73.3 m95 -76.86 -27.65 55.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.014 0.435 . . . . 10.0 110.688 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.33 -36.44 82.19 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.385 -0.825 . . . . 10.0 111.688 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.52 142.16 40.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.928 -0.578 . . . . 10.0 111.53 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 866' ' ' ALA . . . . . 0.914 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -78.16 162.12 26.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.831 -0.433 . . . . 10.0 109.831 179.174 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 867' ' ' ILE . . . . . 0.617 ' HA ' HD23 ' D' ' 870' ' ' LEU . 8.3 tp -87.7 1.66 6.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.118 0.485 . . . . 10.0 111.242 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -60.17 -53.21 67.21 Favored Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 113.688 0.995 . . . . 10.0 113.688 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.68 18.29 1.0 Allowed 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.222 1.948 . . . . 10.0 112.974 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 870' ' ' LEU . . . . . 0.703 HD12 ' HG2' ' D' ' 873' ' ' GLU . 2.9 mm? -106.99 20.57 18.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.386 0.612 . . . . 10.0 110.585 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -67.0 107.68 2.34 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.902 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 89.96 15.13 58.29 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.877 -0.677 . . . . 10.0 112.214 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 873' ' ' GLU . . . . . 0.703 ' HG2' HD12 ' D' ' 870' ' ' LEU . 10.0 tp10 -102.11 148.91 24.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.511 0.196 . . . . 10.0 110.544 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 874' ' ' GLU . . . . . 0.633 ' HB2' HD12 ' D' ' 853' ' ' LEU . 24.8 mt-10 -105.88 109.38 21.31 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 62.3 mt -87.26 118.21 26.53 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.286 0.476 . . . . 10.0 112.286 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 32.3 mt -103.18 114.59 43.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.499 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 877' ' ' VAL . . . . . 0.674 HG21 HD11 ' D' ' 834' ' ' LEU . 18.6 t -102.83 126.31 57.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.978 -0.379 . . . . 10.0 109.978 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 878' ' ' GLU . . . . . 0.435 ' HA ' ' HB3' ' D' ' 815' ' ' PRO . 16.8 mm-40 -123.66 164.86 18.24 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.162 179.446 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 48.5 t -112.13 108.63 26.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.856 0.36 . . . . 10.0 110.182 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 68.3 mt . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.266 -0.873 . . . . 10.0 109.798 179.288 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 28.6 mt . . . . . 0 C--O 1.219 -0.517 0 CA-C-O 120.282 0.086 . . . . 10.0 110.96 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 59.5 mtt180 -66.96 -42.14 85.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.934 0.397 . . . . 10.0 110.141 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -67.47 -43.25 81.45 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.108 -0.701 . . . . 10.0 109.108 178.374 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -64.42 -44.95 89.62 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 115.441 -0.799 . . . . 10.0 109.965 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 243' ' ' MET . . . . . 0.515 ' HA ' ' HB2' ' A' ' 246' ' ' ASP . 27.6 mmm -61.7 -30.48 70.78 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.337 179.1 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 70.7 m -63.91 -48.66 75.74 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 108.272 -1.01 . . . . 10.0 108.272 178.104 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -66.09 -44.55 84.07 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.168 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 246' ' ' ASP . . . . . 0.515 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.3 OUTLIER -54.07 -60.17 3.69 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 115.398 -0.819 . . . . 10.0 110.076 179.523 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 82.7 mt -61.64 -50.54 72.13 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.077 -0.51 . . . . 10.0 112.193 -179.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -57.28 -52.23 66.17 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.038 0.385 . . . . 10.0 112.038 -178.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -67.11 -42.19 84.94 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.63 0.233 . . . . 10.0 111.63 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 250' ' ' VAL . . . . . 0.511 HG22 ' HE1' ' C' ' 521' ' ' TYR . 24.5 t -65.37 -43.03 94.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.365 0 C-N-CA 121.156 -0.218 . . . . 10.0 111.215 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -66.6 -48.53 69.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.772 0.32 . . . . 10.0 110.806 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -60.28 -42.9 96.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.647 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -75.63 -29.06 59.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.41 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.459 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.8 OUTLIER -57.82 -31.85 41.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.593 179.623 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -60.75 -66.45 1.53 Allowed Pre-proline 0 N--CA 1.448 -0.525 0 CA-C-O 119.036 -0.506 . . . . 10.0 111.132 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.05 -31.95 83.79 Favored 'Trans proline' 0 C--N 1.357 0.998 0 C-N-CA 121.637 1.558 . . . . 10.0 112.053 178.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 257' ' ' TYR . . . . . 0.429 ' O ' ' HB2' ' A' ' 261' ' ' PHE . 5.5 m-30 -61.16 -50.3 73.74 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 120.741 0.305 . . . . 10.0 110.421 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 97.5 mt -80.63 -33.66 35.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.482 . . . . 10.0 111.179 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 259' ' ' ASP . . . . . 0.413 ' O ' ' HG3' ' A' ' 263' ' ' LYS . 15.1 t70 -64.31 -49.43 71.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.58 -0.282 . . . . 10.0 111.104 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -66.85 -39.19 87.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.06 0.457 . . . . 10.0 109.864 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 261' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' A' ' 257' ' ' TYR . 0.3 OUTLIER -64.35 -31.33 72.49 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.066 -0.716 . . . . 10.0 109.066 178.169 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -69.0 -40.81 78.48 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.006 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 263' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 259' ' ' ASP . 82.4 mttt -56.09 -48.05 76.87 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.093 -1.077 . . . . 10.0 108.093 178.246 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.413 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 14.5 mptt -63.86 -47.78 79.36 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.564 -1.198 . . . . 10.0 110.157 179.422 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -37.22 75.53 Favored 'General case' 0 N--CA 1.464 0.239 0 O-C-N 123.314 0.384 . . . . 10.0 111.204 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -62.99 -49.64 73.87 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.995 -0.743 . . . . 10.0 108.995 178.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -63.47 -38.35 90.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 10.0 109.667 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 268' ' ' GLU . . . . . 0.526 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 22.5 mt-10 -60.47 -52.93 63.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.522 179.114 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 81.0 mmm -66.18 -42.69 88.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.473 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -65.15 -48.73 72.5 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.549 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 45.5 mt -64.59 -35.85 82.31 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 272' ' ' TYR . . . . . 0.526 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 15.1 t80 -62.13 -49.93 73.9 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.636 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 54.8 mtt85 -65.34 -41.21 94.14 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.709 0.29 . . . . 10.0 110.415 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.39 -31.67 67.89 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.488 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.722 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 56.4 mttp -90.5 -42.25 10.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.021 178.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 276' ' ' VAL . . . . . 0.441 ' O ' ' HB2' ' A' ' 280' ' ' ARG . 5.6 t -53.53 -44.73 57.5 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.404 0 N-CA-C 112.255 0.465 . . . . 10.0 112.255 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -53.66 -62.0 4.34 Favored Pre-proline 0 CA--C 1.542 0.646 0 N-CA-C 112.556 0.576 . . . . 10.0 112.556 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 278' ' ' PRO . . . . . 0.506 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 29.3 Cg_endo -65.56 -36.84 31.93 Favored 'Trans proline' 0 C--N 1.353 0.816 0 C-N-CA 121.906 1.737 . . . . 10.0 112.287 178.39 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.868 HD22 ' HG2' ' C' ' 495' ' ' LYS . 58.1 mt -65.14 -34.22 77.87 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.098 0.475 . . . . 10.0 109.969 179.51 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 280' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 26.2 ttt180 -70.21 -35.13 73.69 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 108.065 -1.087 . . . . 10.0 108.065 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.75 -40.77 95.85 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.189 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 282' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 74.0 mt-10 -62.96 -43.04 99.89 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.704 -0.85 . . . . 10.0 108.704 178.056 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 63.9 mt -63.36 -37.62 87.99 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.429 -0.805 . . . . 10.0 109.918 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -68.3 -50.69 51.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.442 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -60.98 -43.53 98.67 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.37 -44.63 96.56 Favored Glycine 0 N--CA 1.438 -1.176 0 N-CA-C 110.486 -1.046 . . . . 10.0 110.486 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.82 -37.98 86.43 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 110.545 -0.169 . . . . 10.0 110.545 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -60.66 -42.26 96.66 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.765 -0.457 . . . . 10.0 109.765 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 11.1 tm0? -70.89 -49.82 41.72 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.751 -0.658 . . . . 10.0 109.713 178.19 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 46.8 mttt -56.68 -41.24 76.98 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.836 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 17.6 mt -70.52 -39.28 74.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.399 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.07 -41.23 99.4 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.4 -34.44 75.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.664 178.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 86.5 mt -75.51 -42.15 53.5 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.441 -0.799 . . . . 10.0 109.55 178.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -62.12 -39.19 91.7 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.393 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -77.5 14.98 0.86 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.745 178.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 297' ' ' LYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 23.8 mttp -133.07 -42.14 0.89 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.49 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 298' ' ' LEU . . . . . 0.41 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 93.3 mt -58.05 -32.67 68.23 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.361 179.606 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 299' ' ' SER . . . . . 0.434 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 3.1 m -82.57 -62.32 0.31 Allowed Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 300' ' ' PRO . . . . . 0.434 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 18.1 Cg_endo -60.46 -49.92 8.02 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 121.832 1.688 . . . . 10.0 112.597 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.5 HD13 ' HG2' ' C' ' 473' ' ' LYS . 98.2 mt -75.8 -13.12 60.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.006 0.431 . . . . 10.0 110.271 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 302' ' ' GLY . . . . . 0.41 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -83.63 -47.92 5.46 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 109.815 -1.314 . . . . 10.0 109.815 178.164 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 57.5 mt-10 -61.1 -44.94 96.59 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 304' ' ' GLU . . . . . 0.518 ' O ' ' HG3' ' A' ' 308' ' ' ARG . 1.9 mt-10 -64.4 -39.15 93.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.366 179.243 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 305' ' ' MET . . . . . 0.461 ' SD ' ' HE3' ' C' ' 473' ' ' LYS . 16.2 tpt -64.28 -39.3 93.65 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.228 -0.656 . . . . 10.0 109.228 178.477 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 306' ' ' ARG . . . . . 0.434 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 91.9 mtt180 -70.29 -39.83 74.62 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.284 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 307' ' ' ASP . . . . . 0.666 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 28.2 t70 -65.07 -43.71 91.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.958 0.408 . . . . 10.0 110.432 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 308' ' ' ARG . . . . . 1.13 ' CD ' HD21 ' C' ' 469' ' ' LEU . 11.7 mtp180 -69.92 -28.67 65.79 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.255 -0.646 . . . . 10.0 109.255 178.132 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 309' ' ' ALA . . . . . 0.629 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -71.81 -29.82 64.84 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 177.608 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 310' ' ' ARG . . . . . 0.666 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 77.9 mtt180 -62.58 -52.96 61.35 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.437 -0.949 . . . . 10.0 108.437 178.152 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -64.18 -35.36 80.53 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 312' ' ' HIS . . . . . 0.629 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.1 OUTLIER -57.08 -56.77 17.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.452 -0.794 . . . . 10.0 110.243 179.01 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 47.6 t -75.65 -39.69 39.76 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 CA-C-N 115.731 -0.668 . . . . 10.0 112.15 -179.114 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 314' ' ' ASP . . . . . 0.624 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 0.2 OUTLIER -59.96 -51.0 71.56 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 122.419 -0.176 . . . . 10.0 111.111 179.99 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -64.23 -26.43 68.5 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.351 -0.611 . . . . 10.0 109.351 178.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 316' ' ' LEU . . . . . 0.859 ' HG ' ' HE3' ' C' ' 462' ' ' LYS . 5.2 mt -71.79 -37.75 70.38 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 317' ' ' ARG . . . . . 0.624 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 79.7 mtt180 -63.27 -49.94 72.12 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.32 -11.83 45.74 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.779 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -98.34 -41.58 7.77 Favored 'General case' 0 C--O 1.223 -0.331 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 178.196 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 320' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 316' ' ' LEU . 86.4 mt -65.6 -34.24 77.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.973 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 321' ' ' ALA . . . . . 0.412 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -55.31 -61.66 5.67 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.498 -0.319 . . . . 10.0 111.587 179.435 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 322' ' ' PRO . . . . . 0.412 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 33.8 Cg_endo -66.86 -30.06 40.85 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.597 1.531 . . . . 10.0 111.541 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -63.79 -50.35 69.33 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 110.023 -0.362 . . . . 10.0 110.023 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 324' ' ' SER . . . . . 0.497 ' HA ' ' HB2' ' A' ' 327' ' ' LEU . 18.7 p -70.64 -34.54 72.17 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 110.181 -0.304 . . . . 10.0 110.181 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -59.05 -53.84 53.82 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -70.09 -29.41 66.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.69 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 327' ' ' LEU . . . . . 0.497 ' HB2' ' HA ' ' A' ' 324' ' ' SER . 9.3 mt -63.2 -39.13 93.74 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.422 -0.585 . . . . 10.0 109.422 178.224 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 38.3 mtt180 -64.56 -35.26 80.4 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 109.492 -0.559 . . . . 10.0 109.492 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -69.84 -45.63 67.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.832 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 330' ' ' ARG . . . . . 0.537 ' HD3' ' OD2' ' C' ' 444' ' ' ASP . 9.6 ttm180 -63.5 -44.54 94.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.785 -0.643 . . . . 10.0 109.879 179.34 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 60.2 mt -65.31 -36.93 85.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.046 178.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -64.43 -44.84 89.91 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.22 -0.659 . . . . 10.0 109.22 178.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -60.45 -44.42 95.84 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.944 178.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 334' ' ' ARG . . . . . 0.488 ' HA ' ' HG2' ' C' ' 440' ' ' GLU . 3.6 mtt180 -63.33 -52.14 63.09 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-N 115.773 -0.648 . . . . 10.0 110.335 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 79.5 mt -60.25 -36.73 78.43 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.853 0.358 . . . . 10.0 111.054 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 336' ' ' GLU . . . . . 0.683 ' HA ' ' HE3' ' A' ' 339' ' ' LYS . 36.0 tt0 -67.39 -44.39 78.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.243 179.303 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.51 -46.66 72.22 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 338' ' ' LEU . . . . . 0.534 ' HA ' ' HB3' ' A' ' 341' ' ' ASN . 82.8 mt -63.99 -19.54 65.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.16 179.333 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 339' ' ' LYS . . . . . 0.683 ' HE3' ' HA ' ' A' ' 336' ' ' GLU . 12.9 ttmt -67.56 -48.15 67.77 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.671 -0.863 . . . . 10.0 108.671 178.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -77.87 -41.99 34.94 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 341' ' ' ASN . . . . . 0.664 HD21 ' HA ' ' C' ' 433' ' ' GLU . 27.7 t-20 -56.93 -48.97 77.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.804 -1.089 . . . . 10.0 109.629 179.282 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -76.77 -35.79 39.04 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.496 -0.775 . . . . 10.0 111.693 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.25 -47.94 88.6 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.761 -0.733 . . . . 10.0 111.329 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 344' ' ' ALA . . . . . 0.532 ' O ' ' HG2' ' A' ' 348' ' ' GLU . . . -66.97 -38.78 86.71 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 -61.43 -41.71 97.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.116 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 75.6 mt -63.4 -40.9 98.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.905 -0.589 . . . . 10.0 109.725 179.242 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -65.47 -41.08 93.72 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 348' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 344' ' ' ALA . 75.5 mm-40 -60.48 -53.28 59.4 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.575 -0.739 . . . . 10.0 109.537 178.617 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -63.92 -28.92 70.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.444 -0.798 . . . . 10.0 111.636 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.91 -50.42 29.29 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.112 -0.329 . . . . 10.0 110.112 179.05 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.99 98.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.957 0.408 . . . . 10.0 110.09 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 352' ' ' LYS . . . . . 0.595 ' HG2' HG22 ' C' ' 422' ' ' VAL . 8.1 mtmm -70.13 -23.55 63.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.066 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -70.09 -39.69 75.4 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -38.3 90.58 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.04 -0.726 . . . . 10.0 109.04 178.563 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -66.87 -38.0 85.5 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.18 -0.674 . . . . 10.0 109.18 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -62.68 -49.49 74.93 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 115.623 -0.717 . . . . 10.0 109.494 178.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 84.5 mt -61.13 -39.65 90.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.343 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 358' ' ' SER . . . . . 0.415 ' O ' ' HG3' ' A' ' 362' ' ' GLU . 50.3 m -63.46 -52.87 59.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.534 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 359' ' ' THR . . . . . 0.43 ' HA ' ' OE1' ' A' ' 362' ' ' GLU . 3.2 p -67.15 -26.0 66.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.206 0.527 . . . . 10.0 110.751 179.564 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 20.6 tp -74.11 -37.63 64.07 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 72.6 m -64.63 -29.88 70.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.11 0.481 . . . . 10.0 109.982 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 362' ' ' GLU . . . . . 0.43 ' OE1' ' HA ' ' A' ' 359' ' ' THR . 46.4 mt-10 -70.05 -7.54 42.02 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.122 178.722 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.476 ' HD3' HG23 ' C' ' 411' ' ' THR . 34.0 mttp -115.92 -32.87 5.29 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.709 -0.678 . . . . 10.0 109.356 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.38 -24.78 63.01 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.664 -0.698 . . . . 10.0 111.105 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.905 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 94.9 mttt -106.79 -71.72 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 112.134 0.42 . . . . 10.0 112.134 179.078 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.905 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 39.4 Cg_exo -59.11 -53.87 3.22 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 122.194 1.93 . . . . 10.0 113.028 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 367' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -62.77 -48.16 80.36 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.824 0.305 . . . . 10.0 111.824 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 368' ' ' LEU . . . . . 0.546 HD23 HD12 ' A' ' 371' ' ' LEU . 9.9 mt -62.04 -37.29 84.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.804 0.335 . . . . 10.0 110.731 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 369' ' ' GLU . . . . . 0.643 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 41.9 tt0 -65.35 -44.62 87.11 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 178.478 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.51 -37.61 88.15 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 371' ' ' LEU . . . . . 0.546 HD12 HD23 ' A' ' 368' ' ' LEU . 42.0 mt -63.32 -43.6 97.34 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.195 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 57.7 mtt180 -64.93 -38.21 90.22 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 108.359 -0.978 . . . . 10.0 108.359 178.251 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.643 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.5 mt-30 -65.61 -21.57 66.59 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.205 -0.907 . . . . 20.0 112.157 179.155 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -93.15 -37.35 5.69 Favored Glycine 0 CA--C 1.523 0.594 0 N-CA-C 108.75 -1.74 . . . . 10.0 108.75 178.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 49.1 mt -59.45 -37.8 79.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.811 -0.195 . . . . 10.0 111.433 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 75.8 mt -56.09 -62.43 4.75 Favored Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 112.038 0.384 . . . . 10.0 112.038 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -64.1 -34.81 56.44 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 121.983 1.789 . . . . 10.0 112.037 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 25.3 t -63.66 -54.57 30.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.517 0.199 . . . . 10.0 110.811 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 36.3 mt -63.35 -35.84 81.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.637 0.256 . . . . 10.0 110.921 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 380' ' ' GLU . . . . . 0.467 ' O ' HG23 ' A' ' 384' ' ' VAL . 14.1 tt0 -64.5 -51.01 65.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.554 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 12.6 p -65.28 -36.95 85.68 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.768 0.318 . . . . 10.0 110.879 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -68.31 -36.24 79.02 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.69 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 49.6 mttt -65.8 -37.2 85.63 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.682 -0.488 . . . . 10.0 109.682 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 384' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 380' ' ' GLU . 87.2 t -63.49 -44.24 98.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.084 178.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.35 -37.91 71.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.086 -0.507 . . . . 10.0 110.907 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 386' ' ' PHE . . . . . 0.459 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 1.6 m-85 -67.68 -45.9 73.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.516 -0.311 . . . . 10.0 111.139 179.515 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 34.6 mt -59.97 -45.38 92.88 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.998 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 77.4 p -70.76 -28.86 65.0 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.715 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -69.2 -38.45 78.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.087 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 390' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 95.8 mt -57.51 -40.98 79.92 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.478 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -60.63 -46.02 91.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.667 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 392' ' ' GLU . . . . . 0.681 ' HA ' ' HD2' ' A' ' 395' ' ' LYS . 0.0 OUTLIER -61.68 -41.51 97.67 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.341 -0.845 . . . . 10.0 111.666 -179.58 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -60.85 -44.29 97.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.063 0.459 . . . . 10.0 109.788 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 8.9 m -60.46 -39.3 87.08 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.487 -0.779 . . . . 10.0 111.45 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 395' ' ' LYS . . . . . 0.681 ' HD2' ' HA ' ' A' ' 392' ' ' GLU . 87.2 mttt . . . . . 0 N--CA 1.465 0.278 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.738 -179.558 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 11.3 mt . . . . . 0 CA--C 1.521 -0.144 0 CA-C-O 120.757 0.313 . . . . 10.0 110.799 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 77.0 mt -62.61 -42.09 99.38 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -71.03 -31.75 68.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.962 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 404' ' ' ASN . . . . . 0.489 ' O ' HG23 ' C' ' 408' ' ' VAL . 14.5 t-20 -64.88 -48.23 75.0 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.637 -0.875 . . . . 10.0 108.637 178.076 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 47.4 m0 -63.72 -37.01 85.75 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.522 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.18 -45.61 87.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.551 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 31.0 m -63.81 -36.63 84.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.738 -0.664 . . . . 10.0 109.997 178.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 408' ' ' VAL . . . . . 0.489 HG23 ' O ' ' C' ' 404' ' ' ASN . 89.3 t -67.46 -33.74 64.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 24.2 m -66.17 -40.17 90.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.736 -0.665 . . . . 10.0 109.215 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 410' ' ' SER . . . . . 0.446 ' O ' ' HG2' ' C' ' 414' ' ' LYS . 7.4 m -66.78 -37.17 84.04 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.494 -0.928 . . . . 10.0 108.494 177.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 411' ' ' THR . . . . . 0.476 HG23 ' HD3' ' A' ' 363' ' ' LYS . 76.6 m -63.18 -44.32 95.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.158 -0.928 . . . . 10.0 109.671 178.333 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 412' ' ' PHE . . . . . 0.438 ' HA ' HD12 ' C' ' 415' ' ' LEU . 1.1 m-85 -61.26 -38.35 86.41 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.306 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 32.2 m -62.33 -41.84 98.89 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.802 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 414' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' C' ' 410' ' ' SER . 73.4 mmtt -66.11 -31.86 72.97 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.778 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 415' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' C' ' 411' ' ' THR . 95.4 mt -69.16 -40.23 78.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.059 -0.519 . . . . 10.0 109.688 178.643 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -66.55 -44.85 81.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.338 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -64.92 -25.61 67.95 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.956 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 418' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' C' ' 414' ' ' LYS . 0.0 OUTLIER -79.22 -51.86 8.91 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.69 179.213 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 84.4 mt -52.69 -40.0 62.51 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.637 -0.711 . . . . 10.0 112.523 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -48.24 -79.3 0.07 OUTLIER Glycine 0 CA--C 1.523 0.543 0 O-C-N 123.6 0.563 . . . . 10.0 113.679 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -60.14 -35.87 90.8 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.621 2.214 . . . . 10.0 112.212 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 422' ' ' VAL . . . . . 0.595 HG22 ' HG2' ' A' ' 352' ' ' LYS . 35.9 t -60.56 -49.49 84.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 N-CA-C 112.132 0.419 . . . . 10.0 112.132 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 51.5 p -70.39 -34.58 72.74 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 121.097 -0.241 . . . . 10.0 111.118 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -60.13 -50.6 73.03 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -74.09 -24.72 59.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.511 179.195 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 426' ' ' PHE . . . . . 0.431 ' HB2' ' O ' ' C' ' 422' ' ' VAL . 48.8 t80 -68.59 -46.14 70.16 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.276 -0.639 . . . . 10.0 109.276 178.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -37.35 87.09 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 108.72 -0.844 . . . . 10.0 108.72 178.464 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -64.5 -44.45 90.91 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.63 -0.878 . . . . 10.0 108.63 177.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.88 -37.06 86.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.495 178.08 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 44.7 mt -63.13 -41.06 99.25 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 431' ' ' GLU . . . . . 0.539 ' HA ' ' OG1' ' C' ' 434' ' ' THR . 4.7 mm-40 -68.18 -35.06 77.42 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.969 -0.559 . . . . 10.0 110.403 178.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 38.0 mttp -62.56 -36.65 83.32 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.861 -1.163 . . . . 10.0 107.861 177.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 433' ' ' GLU . . . . . 0.664 ' HA ' HD21 ' A' ' 341' ' ' ASN . 38.2 tt0 -69.66 -48.75 58.71 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 114.96 -1.018 . . . . 10.0 110.172 179.115 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 434' ' ' THR . . . . . 0.539 ' OG1' ' HA ' ' C' ' 431' ' ' GLU . 0.3 OUTLIER -64.2 -36.01 82.67 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 116.792 -0.185 . . . . 10.0 110.736 179.727 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -63.93 -35.12 79.62 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.686 -0.487 . . . . 10.0 109.686 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -69.38 -45.39 60.75 Favored Glycine 0 N--CA 1.445 -0.748 0 N-CA-C 108.807 -1.717 . . . . 10.0 108.807 177.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 87.5 mt -64.32 -24.6 67.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.373 -0.413 . . . . 10.0 110.796 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 39.8 mtt180 -74.77 -3.49 31.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.24 0.543 . . . . 10.0 110.341 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -118.04 -38.37 3.23 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.112 -1.069 . . . . 10.0 108.112 177.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 440' ' ' GLU . . . . . 0.488 ' HG2' ' HA ' ' A' ' 334' ' ' ARG . 40.3 mt-10 -72.22 -59.8 2.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.092 -0.958 . . . . 10.0 110.73 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 441' ' ' MET . . . . . 0.46 ' HA ' ' HB3' ' C' ' 444' ' ' ASP . 93.3 mmm -66.43 -31.35 72.05 Favored 'General case' 0 C--O 1.225 -0.236 0 N-CA-C 112.908 0.706 . . . . 10.0 112.908 -178.269 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.3 p -62.66 -52.08 64.73 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 179.195 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -66.73 -40.23 88.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.996 -0.742 . . . . 10.0 108.996 178.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 444' ' ' ASP . . . . . 0.537 ' OD2' ' HD3' ' A' ' 330' ' ' ARG . 15.5 t70 -55.07 -53.83 50.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.705 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 445' ' ' LEU . . . . . 0.505 ' HA ' HG12 ' C' ' 448' ' ' VAL . 96.6 mt -63.88 -47.09 82.01 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.552 0.575 . . . . 10.0 112.552 -179.445 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -65.31 -38.46 90.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.903 0.382 . . . . 10.0 110.999 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 447' ' ' GLU . . . . . 0.486 ' O ' ' HG2' ' C' ' 451' ' ' LYS . 0.8 OUTLIER -72.79 -42.56 63.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.447 179.295 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 448' ' ' VAL . . . . . 0.505 HG12 ' HA ' ' C' ' 445' ' ' LEU . 2.3 p -65.55 -35.59 75.62 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.189 0 CA-C-N 116.656 -0.247 . . . . 10.0 110.981 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -66.0 -37.76 86.74 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.779 -0.823 . . . . 10.0 108.779 178.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -72.98 -11.46 60.58 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.322 -0.854 . . . . 10.0 110.033 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 451' ' ' LYS . . . . . 0.486 ' HG2' ' O ' ' C' ' 447' ' ' GLU . 35.9 mmtm -94.66 -40.16 9.96 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.214 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 452' ' ' VAL . . . . . 0.478 HG23 ' O ' ' C' ' 448' ' ' VAL . 59.5 t -59.62 -42.25 87.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.727 -0.67 . . . . 10.0 111.654 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 453' ' ' GLN . . . . . 0.892 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 18.5 mt-30 -54.32 -61.54 5.35 Favored Pre-proline 0 CA--C 1.537 0.468 0 O-C-N 122.97 0.169 . . . . 10.0 111.403 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 454' ' ' PRO . . . . . 0.892 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 23.9 Cg_exo -66.78 -28.99 42.99 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 122.171 1.914 . . . . 10.0 111.605 178.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -64.49 -52.02 60.01 Favored 'General case' 0 C--O 1.222 -0.367 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 43.3 mt -65.64 -43.52 89.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.358 179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -58.72 -51.45 69.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.99 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -71.97 -32.17 67.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.766 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -67.7 -48.03 67.7 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 178.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -68.04 -29.58 68.6 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 461' ' ' LYS . . . . . 0.406 ' HB2' ' HE3' ' C' ' 461' ' ' LYS . 5.0 ttmt -65.23 -46.69 79.6 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.539 -0.911 . . . . 10.0 108.539 177.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 462' ' ' LYS . . . . . 0.859 ' HE3' ' HG ' ' A' ' 316' ' ' LEU . 19.2 mttm -69.37 -38.75 78.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.432 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 463' ' ' TRP . . . . . 0.426 ' O ' ' HB2' ' C' ' 467' ' ' MET . 0.0 OUTLIER -62.75 -31.8 72.82 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 178.628 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -69.77 -45.59 67.69 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 0.832 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 59.2 mt-10 -55.66 -43.55 76.39 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.208 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 466' ' ' GLU . . . . . 0.458 ' HA ' HD12 ' C' ' 469' ' ' LEU . 19.3 mt-10 -73.47 -34.1 65.19 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 115.275 -0.875 . . . . 10.0 110.884 179.36 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 467' ' ' MET . . . . . 0.426 ' HB2' ' O ' ' C' ' 463' ' ' TRP . 0.0 OUTLIER -62.45 -42.32 99.38 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.553 -0.906 . . . . 10.0 108.553 178.619 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -66.1 -47.21 74.97 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 107.894 -1.15 . . . . 10.0 107.894 177.507 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 1.13 HD21 ' CD ' ' A' ' 308' ' ' ARG . 96.2 mt -55.82 -44.62 78.05 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 115.217 -0.901 . . . . 20.0 111.489 178.83 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -62.6 -41.44 98.97 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 116.361 -0.381 . . . . 10.0 110.135 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 27.0 mtm180 -69.84 -36.93 75.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.964 0.412 . . . . 10.0 110.528 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -79.97 2.76 22.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.092 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 473' ' ' LYS . . . . . 0.5 ' HG2' HD13 ' A' ' 301' ' ' LEU . 29.3 mttm -120.51 -57.71 1.89 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.367 -0.378 . . . . 10.0 110.55 178.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 84.0 t -62.47 -42.77 97.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 112.752 0.649 . . . . 10.0 112.752 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -61.28 -58.19 20.57 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 112.378 0.51 . . . . 10.0 112.378 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -60.48 -33.86 93.48 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 121.663 1.575 . . . . 10.0 110.51 178.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 12.2 mt -66.61 -44.11 82.96 Favored 'General case' 0 C--O 1.213 -0.828 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.315 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 478' ' ' ARG . . . . . 0.474 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 65.4 mtt180 -54.89 -41.39 70.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.886 0.374 . . . . 10.0 110.177 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -67.48 -56.78 8.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.523 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 480' ' ' GLU . . . . . 0.421 ' CD ' ' HZ1' ' A' ' 297' ' ' LYS . 0.1 OUTLIER -67.64 -34.61 77.32 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.148 0.796 . . . . 10.0 113.148 -179.211 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 30.5 mt -68.6 -35.26 77.09 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.331 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 482' ' ' GLN . . . . . 0.474 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 8.1 mt-30 -69.95 -36.84 75.59 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 177.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -67.8 -41.26 83.41 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.609 -0.886 . . . . 10.0 108.609 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -67.58 -35.04 85.62 Favored Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 110.061 -1.215 . . . . 10.0 110.061 177.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -70.32 -38.41 74.92 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 45.8 mtt180 -64.57 -39.4 93.68 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 108.484 -0.932 . . . . 10.0 108.484 177.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 487' ' ' GLN . . . . . 0.463 ' O ' ' HG3' ' C' ' 491' ' ' GLU . 10.9 mm-40 -63.81 -48.65 75.98 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.801 -0.815 . . . . 10.0 108.801 177.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -64.8 -35.83 82.37 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.583 179.243 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 17.4 mt -68.37 -43.27 77.73 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 178.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -62.04 -40.82 97.05 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 107.496 -1.298 . . . . 10.0 107.496 178.149 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 491' ' ' GLU . . . . . 0.725 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 30.6 mt-10 -60.59 -59.63 5.09 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.448 -0.945 . . . . 10.0 108.448 177.26 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 80.8 mt -52.04 -50.95 60.45 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 115.52 -0.764 . . . . 10.0 112.468 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -61.57 -41.77 97.87 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.689 0.255 . . . . 10.0 111.689 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -75.05 -12.98 60.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.674 0.273 . . . . 10.0 111.429 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.868 ' HG2' HD22 ' A' ' 279' ' ' LEU . 13.5 mttm -97.09 -44.09 7.12 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 178.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 95.1 mt -71.11 -29.66 65.54 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.937 0.717 . . . . 10.0 112.937 -179.096 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 49.3 m -61.21 -60.4 10.69 Favored Pre-proline 0 CA--C 1.537 0.462 0 C-N-CA 120.422 -0.511 . . . . 10.0 111.327 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -65.0 -35.38 43.32 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 121.717 1.611 . . . . 10.0 111.074 178.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 16.2 mt -67.91 -35.35 78.31 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 116.334 -0.393 . . . . 10.0 110.461 179.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -65.43 -45.3 90.95 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.212 -1.155 . . . . 10.0 110.212 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -64.41 -42.88 95.82 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 502' ' ' GLU . . . . . 0.497 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 23.2 tt0 -62.31 -43.83 97.91 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.586 178.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 503' ' ' MET . . . . . 0.524 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 65.8 mmm -62.29 -38.04 87.84 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.135 -0.484 . . . . 10.0 109.826 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 89.9 mtt180 -63.99 -42.46 97.19 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.45 -41.64 88.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.711 -0.677 . . . . 10.0 109.763 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.524 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 46.5 mtt180 -62.23 -43.49 98.71 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 108.586 -0.894 . . . . 10.0 108.586 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -61.53 -44.22 97.45 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.236 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 508' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' C' ' 508' ' ' ARG . 50.6 mtt180 -63.65 -42.02 98.17 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -75.9 10.91 1.59 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.192 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 510' ' ' HIS . . . . . 0.41 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 2.5 m-70 -128.97 -55.68 1.2 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.718 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 79.9 t -69.17 -46.41 77.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.826 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.646 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 13.6 t70 -66.81 -35.64 80.52 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 179.044 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.81 -39.2 90.67 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.052 -1.092 . . . . 10.0 108.052 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 514' ' ' LEU . . . . . 0.729 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 32.3 mt -68.67 -23.2 64.37 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.314 178.516 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 515' ' ' ARG . . . . . 0.646 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 68.2 mtt180 -64.68 -39.82 94.33 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.641 -0.874 . . . . 10.0 108.641 178.015 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -93.19 7.9 42.39 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.474 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 517' ' ' HIS . . . . . 0.729 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 32.3 m170 -113.74 -53.07 2.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.037 -0.528 . . . . 10.0 111.011 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 95.8 mt -77.42 -34.56 54.66 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.7 0.63 . . . . 10.0 112.7 -178.395 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -57.27 -57.18 26.66 Favored Pre-proline 0 CA--C 1.532 0.26 0 C-N-CA 120.52 -0.472 . . . . 10.0 110.945 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -67.48 -28.84 38.22 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 121.403 1.402 . . . . 10.0 110.628 178.168 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 521' ' ' TYR . . . . . 0.581 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 19.9 t80 -63.76 -48.38 77.22 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.004 179.588 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 9.1 p -71.01 -29.97 66.07 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.625 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -68.08 -44.0 77.26 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.958 -0.756 . . . . 10.0 108.958 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -66.15 -44.13 85.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.089 177.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 37.7 mt -61.64 -38.36 87.42 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 115.852 -0.613 . . . . 10.0 109.836 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -61.81 -38.99 90.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.141 -0.481 . . . . 10.0 109.911 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -67.81 -39.66 83.93 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 178.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 62.6 mtt180 -68.6 -37.2 79.6 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 178.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 75.0 mt -69.49 -34.98 75.12 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.124 -0.695 . . . . 10.0 109.124 178.02 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 530' ' ' ALA . . . . . 0.47 ' O ' ' HG2' ' C' ' 534' ' ' GLU . . . -64.04 -45.5 88.58 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 178.357 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.33 -40.88 98.54 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 178.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 8.2 ttm180 -60.97 -40.67 94.28 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.273 -0.876 . . . . 10.0 108.884 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 74.7 mt -68.53 -36.15 78.45 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.114 178.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 534' ' ' GLU . . . . . 0.483 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 5.6 mm-40 -59.38 -44.02 92.82 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 178.525 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -68.25 -46.56 70.13 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.356 -0.838 . . . . 10.0 109.445 178.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 58.6 mt -58.57 -30.05 66.87 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.393 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 537' ' ' LYS . . . . . 0.483 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 49.1 mtmt -74.89 -49.85 18.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.66 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -67.02 -49.57 64.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.861 0.362 . . . . 10.0 110.943 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -66.0 -36.6 83.74 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -67.52 -41.8 89.69 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 110.853 -0.899 . . . . 10.0 110.853 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -63.94 -37.65 94.93 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 110.215 -1.154 . . . . 10.0 110.215 178.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -67.89 -44.9 75.93 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.614 -0.884 . . . . 10.0 108.614 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 34.3 mtt180 -56.77 -39.98 75.01 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 115.522 -0.763 . . . . 10.0 110.542 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 544' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' C' ' 548' ' ' HIS . 81.7 mt -62.61 -41.29 98.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.408 179.14 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -69.47 -45.08 69.86 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.457 -0.571 . . . . 10.0 109.457 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -59.84 -49.33 78.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.097 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -64.0 -39.21 93.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.985 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 548' ' ' HIS . . . . . 0.49 ' HB2' ' O ' ' C' ' 544' ' ' LEU . 1.7 t-80 -65.68 -42.96 90.66 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.172 0.511 . . . . 10.0 110.314 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -64.52 -51.82 60.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.616 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -33.77 74.57 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.373 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.41 -45.94 88.69 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.392 -0.595 . . . . 10.0 109.392 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 4.4 m -66.49 -38.1 86.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.726 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -68.96 -25.97 64.81 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.605 -0.725 . . . . 10.0 110.649 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 554' ' ' HIS . . . . . 0.466 ' HA ' ' OG1' ' C' ' 557' ' ' THR . 3.2 m-70 -87.5 -34.24 18.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.766 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 49.0 mt -63.6 -32.45 73.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.856 0.36 . . . . 10.0 110.413 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 1.1 p -76.4 -41.32 48.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.117 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 557' ' ' THR . . . . . 0.466 ' OG1' ' HA ' ' C' ' 554' ' ' HIS . 2.1 p -73.88 -12.75 60.76 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.336 0.588 . . . . 10.0 110.853 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 28.8 mt -91.31 -39.61 11.95 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.056 -0.72 . . . . 10.0 109.056 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 559' ' ' SER . . . . . 0.469 ' HA ' ' HB3' ' C' ' 562' ' ' ALA . 2.5 p -69.46 -24.88 63.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.784 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 560' ' ' GLU . . . . . 0.513 ' HG3' ' HD3' ' C' ' 561' ' ' LYS . 7.6 pt-20 -64.11 -19.97 65.64 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.337 0.589 . . . . 10.0 109.967 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 561' ' ' LYS . . . . . 0.513 ' HD3' ' HG3' ' C' ' 560' ' ' GLU . 13.2 mptt -114.53 -29.77 6.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.222 178.801 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 562' ' ' ALA . . . . . 0.469 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -73.8 -5.7 42.45 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.143 0.423 . . . . 10.0 112.143 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 563' ' ' LYS . . . . . 0.922 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 87.8 mttt -119.87 -70.11 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.583 0 CA-C-O 119.446 -0.312 . . . . 10.0 111.323 178.693 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 564' ' ' PRO . . . . . 0.922 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 32.4 Cg_exo -61.6 -51.72 3.83 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.08 1.853 . . . . 10.0 112.242 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 565' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -63.6 -40.73 97.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.463 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 566' ' ' LEU . . . . . 0.514 HD23 HD12 ' C' ' 569' ' ' LEU . 6.9 mt -63.96 -41.79 97.47 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 110.063 -0.347 . . . . 10.0 110.063 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 567' ' ' GLU . . . . . 0.706 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 36.9 mt-10 -63.56 -38.55 91.54 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 178.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.31 -38.77 81.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.153 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 569' ' ' LEU . . . . . 0.514 HD12 HD23 ' C' ' 566' ' ' LEU . 36.4 mt -62.55 -41.01 98.63 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -68.84 -30.92 69.56 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.468 -0.567 . . . . 10.0 109.468 178.458 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 571' ' ' GLN . . . . . 0.706 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.9 mt-30 -70.63 -14.42 62.47 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.337 -0.847 . . . . 20.0 110.47 178.303 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -98.6 -37.6 4.19 Favored Glycine 0 CA--C 1.523 0.568 0 N-CA-C 108.659 -1.776 . . . . 10.0 108.659 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 73.5 mt -56.34 -45.03 80.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.529 -0.335 . . . . 10.0 111.602 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 86.8 mt -56.97 -62.0 5.96 Favored Pre-proline 0 CA--C 1.537 0.448 0 N-CA-C 112.508 0.559 . . . . 10.0 112.508 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -61.22 -36.97 77.52 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 121.964 1.776 . . . . 10.0 111.948 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 9.6 t -64.38 -45.34 96.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.637 0.256 . . . . 10.0 110.372 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 29.8 mt -62.75 -38.0 88.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.777 0.322 . . . . 10.0 110.145 179.011 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 578' ' ' GLU . . . . . 0.426 ' O ' HG23 ' C' ' 582' ' ' VAL . 62.4 mt-10 -65.72 -48.55 71.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.176 178.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 26.9 m -63.41 -39.91 95.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.152 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -65.91 -38.31 88.37 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 178.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 581' ' ' LYS . . . . . 0.445 ' O ' ' HG ' ' C' ' 585' ' ' LEU . 64.6 mttt -61.73 -39.49 91.72 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.858 -0.61 . . . . 10.0 109.744 178.683 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 582' ' ' VAL . . . . . 0.426 HG23 ' O ' ' C' ' 578' ' ' GLU . 69.6 t -59.8 -48.83 86.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 108.82 -0.808 . . . . 10.0 108.82 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 12.0 m -61.47 -41.98 98.07 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.386 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -63.47 -47.37 82.08 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.082 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 585' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' C' ' 581' ' ' LYS . 80.1 mt -57.9 -46.28 85.17 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.306 -0.407 . . . . 10.0 110.406 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 14.7 m -65.33 -44.53 87.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.216 179.125 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -58.03 -50.5 73.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.285 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.5 mt -56.63 -44.65 81.44 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 116.185 -0.462 . . . . 10.0 110.816 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -63.61 -52.55 60.39 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.065 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 590' ' ' GLU . . . . . 0.431 ' HA ' ' HE2' ' C' ' 593' ' ' LYS . 55.9 mt-10 -58.78 -39.33 80.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.897 -0.592 . . . . 10.0 112.234 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -73.26 -44.13 59.87 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.001 0.371 . . . . 10.0 112.001 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 14.2 p -64.75 -27.98 69.27 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.507 0.558 . . . . 10.0 112.507 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 593' ' ' LYS . . . . . 0.431 ' HE2' ' HA ' ' C' ' 590' ' ' GLU . 45.0 mtmt -65.61 -33.18 75.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.894 0.378 . . . . 10.0 110.924 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 24.0 mttt -85.48 -34.85 21.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.348 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 91.3 mt -85.77 49.46 1.77 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.456 0.646 . . . . 10.0 109.604 178.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.246 0.915 0 CA-C-N 115.487 -0.778 . . . . 10.0 110.123 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.26 0 CA-C-O 120.606 0.241 . . . . 10.0 111.165 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -115.96 125.25 52.28 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 179.005 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -119.05 101.01 7.71 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.027 0.441 . . . . 10.0 111.165 -179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.448 ' HA ' ' O ' ' B' ' 54' ' ' ASP . 5.5 mtpp -81.95 102.71 11.1 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.305 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 21.2 mt -100.92 138.41 38.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.553 -178.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 46.0 t -112.55 126.73 69.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.794 0.33 . . . . 10.0 110.742 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.534 HG12 ' HD2' ' B' ' 16' ' ' LYS . 57.1 t -95.87 118.3 41.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.724 -0.473 . . . . 10.0 109.724 179.189 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.418 ' HB ' ' CD1' ' B' ' 96' ' ' TYR . 35.9 m -112.33 163.21 9.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.773 0.32 . . . . 10.0 110.802 -179.528 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 148.99 167.49 13.91 Favored Glycine 0 N--CA 1.447 -0.632 0 N-CA-C 111.378 -0.689 . . . . 10.0 111.378 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.59 158.32 35.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.924 0.392 . . . . 10.0 111.724 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.65 92.4 1.0 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 121.019 -0.61 . . . . 10.0 111.867 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 151.12 -10.98 0.77 Allowed Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 111.645 -0.582 . . . . 10.0 111.645 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 17.5 m -73.42 -18.91 17.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.857 0.36 . . . . 10.0 111.666 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 89.59 44.7 4.83 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.82 -0.705 . . . . 10.0 112.927 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 16' ' ' LYS . . . . . 0.534 ' HD2' HG12 ' B' ' 8' ' ' VAL . 53.8 mtmt -62.26 -49.73 74.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.544 0.211 . . . . 10.0 111.226 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.0 p -62.43 -31.23 71.91 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.686 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.38 98.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.286 -0.415 . . . . 10.0 110.312 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 94.2 mt -68.37 -35.75 78.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.98 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.87 -47.42 53.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.84 0.352 . . . . 10.0 110.953 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 97.5 mt -63.93 -35.75 74.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.766 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.576 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 6.4 tp-100 -69.58 -14.83 63.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.081 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 15.0 tp -102.23 -34.81 9.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.869 0.366 . . . . 10.0 110.659 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' ILE . . . . . 0.453 HG13 ' CD2' ' B' ' 40' ' ' TYR . 49.3 mm -79.73 -64.21 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.905 -179.461 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 25' ' ' GLN . . . . . 0.582 ' OE1' ' HA ' ' D' ' 840' ' ' VAL . 5.2 mt-30 -93.21 -13.56 28.2 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.724 -178.562 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 95.3 m-20 64.48 40.66 6.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.654 -179.14 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -130.65 136.2 48.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.047 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -88.21 137.61 32.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.779 0.323 . . . . 10.0 110.774 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 1.7 m -99.69 151.96 4.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.361 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -121.17 -21.94 6.24 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.183 0.516 . . . . 10.0 111.363 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -77.0 157.22 31.33 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.358 0.599 . . . . 10.0 111.243 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.51 68.23 5.68 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.035 179.252 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.3 134.62 70.21 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.747 -0.66 . . . . 10.0 110.753 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -80.11 -164.72 0.29 Allowed 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.857 2.371 . . . . 10.0 111.783 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -173.33 141.47 0.92 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.279 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.902 HD11 HG21 ' D' ' 809' ' ' THR . 63.8 mt -121.92 -66.56 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 108.217 -1.031 . . . . 10.0 108.217 178.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.502 ' O ' HG23 ' D' ' 821' ' ' VAL . 1.8 tm-20 -148.11 93.43 2.17 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.702 -0.851 . . . . 10.0 108.702 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 38' ' ' ASP . . . . . 0.623 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 52.0 m-20 -114.61 160.56 19.16 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.551 -179.469 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.1 p -147.28 142.83 27.59 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.715 0.293 . . . . 10.0 111.608 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 40' ' ' TYR . . . . . 0.661 ' CE2' HG22 ' D' ' 840' ' ' VAL . 40.7 m-85 -131.56 141.06 49.62 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.245 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 41' ' ' ARG . . . . . 0.605 ' NH1' ' HB2' ' D' ' 817' ' ' LYS . 0.4 OUTLIER -120.34 131.04 54.68 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.573 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 58.1 tttp -139.93 144.15 36.95 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.23 -0.441 . . . . 10.0 109.962 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -113.44 118.23 33.94 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.971 -0.381 . . . . 10.0 109.971 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -143.65 169.09 11.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.012 0.434 . . . . 10.0 111.271 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 19.1 t -107.09 112.85 41.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 179.194 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 46' ' ' ILE . . . . . 0.41 HD13 HG21 ' B' ' 160' ' ' VAL . 50.3 mt -109.92 112.37 40.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.824 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 61.27 34.52 18.59 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.304 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.88 -8.73 78.91 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.927 -0.654 . . . . 10.0 112.791 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -100.52 113.43 26.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.833 0.349 . . . . 10.0 111.267 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 5.3 t -78.83 121.28 24.61 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.489 -0.93 . . . . 10.0 108.489 178.338 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -140.39 166.68 24.05 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.286 0.565 . . . . 10.0 112.47 -178.109 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 25.5 tp -107.02 122.1 45.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.256 -0.884 . . . . 10.0 109.112 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.449 ' O ' ' HA ' ' B' ' 41' ' ' ARG . 77.7 mt -99.98 117.35 34.08 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.284 -0.416 . . . . 10.0 111.561 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.448 ' O ' ' HA ' ' B' ' 5' ' ' LYS . 4.8 t70 -104.53 89.55 3.25 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.354 -1.35 . . . . 10.0 107.354 178.195 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 14.8 mt -82.69 136.58 22.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.641 -0.709 . . . . 10.0 112.306 -177.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.435 HD12 ' O ' ' B' ' 38' ' ' ASP . 47.3 tp -110.3 120.89 43.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.606 -0.725 . . . . 10.0 111.124 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.623 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 6.0 t0 -99.36 96.76 7.94 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.072 -0.714 . . . . 10.0 109.072 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 58' ' ' THR . . . . . 0.445 HG22 ' CE1' ' B' ' 71' ' ' TYR . 32.0 p -81.02 162.41 23.82 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.373 -0.83 . . . . 10.0 112.342 -178.359 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 59' ' ' ALA . . . . . 0.493 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -76.51 156.47 32.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.905 178.598 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -84.31 -67.49 1.43 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.436 -0.888 . . . . 10.0 111.767 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -83.15 102.43 11.86 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.328 0.585 . . . . 20.0 111.257 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.418 ' OE1' ' HD2' ' B' ' 68' ' ' ARG . 0.4 OUTLIER -142.59 163.83 31.76 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.374 179.509 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -118.67 -161.46 0.84 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.698 -0.683 . . . . 10.0 109.312 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -80.44 110.27 15.74 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.982 0.42 . . . . 10.0 110.173 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 44.2 t -135.56 137.4 41.97 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.028 -0.533 . . . . 10.0 109.933 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.85 -38.46 78.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.055 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 90.4 mmm -60.81 -40.74 93.87 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.407 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.676 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 56.3 ttt85 -66.58 -48.43 69.61 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.482 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.479 ' O ' ' HG3' ' B' ' 73' ' ' ARG . 0.1 OUTLIER -59.88 -32.6 70.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.582 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -61.35 -56.3 21.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.98 -0.554 . . . . 10.0 111.523 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 71' ' ' TYR . . . . . 0.676 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 5.4 p90 -72.55 -27.83 62.46 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.436 0.902 . . . . 10.0 113.436 -178.502 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 72' ' ' MET . . . . . 0.462 ' HB3' HG21 ' B' ' 103' ' ' VAL . 59.7 mtp -68.57 -21.27 64.54 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.939 0.348 . . . . 10.0 111.939 -179.478 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 73' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' B' ' 69' ' ' ASP . 66.9 mtt-85 -95.6 11.74 32.11 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.859 0.318 . . . . 10.0 111.859 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.3 m -113.01 18.16 18.29 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.408 0.623 . . . . 10.0 110.749 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -115.94 144.26 18.37 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.521 -0.847 . . . . 10.0 112.693 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -84.99 -67.9 0.76 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.214 -0.291 . . . . 10.0 110.214 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -105.19 152.4 17.27 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 111.149 -0.78 . . . . 10.0 111.149 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -124.75 127.46 47.26 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.116 0.484 . . . . 10.0 111.677 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.754 ' HG ' HD22 ' B' ' 159' ' ' LEU . 55.5 mt -95.33 113.43 25.1 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.883 -0.598 . . . . 10.0 110.03 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 3.2 m -87.37 86.31 7.23 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.934 -0.395 . . . . 10.0 109.934 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.462 ' HA ' ' HB ' ' B' ' 114' ' ' VAL . 28.6 t -88.31 126.3 41.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.138 0.494 . . . . 10.0 111.837 -178.9 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.644 ' HB3' HD11 ' B' ' 93' ' ' ILE . 29.4 p90 -133.14 157.9 44.17 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.114 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -94.16 121.71 35.94 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 84' ' ' ILE . . . . . 0.471 ' CD1' ' HA ' ' B' ' 118' ' ' CYS . 12.6 pt -68.46 -11.23 14.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 112.129 0.418 . . . . 10.0 112.129 -179.511 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -100.97 12.06 38.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.911 0.386 . . . . 10.0 110.963 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -137.6 113.13 9.45 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.0 0.428 . . . . 10.0 110.861 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.39 -37.71 88.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.908 -0.587 . . . . 10.0 112.321 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 17.3 tptp -63.79 -30.68 71.75 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.987 0.422 . . . . 10.0 110.878 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 15.2 t -66.42 -40.37 89.5 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.791 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -65.62 -35.67 81.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.356 0.598 . . . . 10.0 110.195 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -80.93 -1.72 44.75 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.679 -0.692 . . . . 10.0 111.574 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.19 -12.1 33.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.146 0.498 . . . . 10.0 110.024 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 93' ' ' ILE . . . . . 0.644 HD11 ' HB3' ' B' ' 82' ' ' PHE . 43.8 mm -60.26 -42.74 91.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.398 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -64.4 -37.79 88.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.26 -0.427 . . . . 10.0 109.871 179.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -59.03 -43.83 91.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.414 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 96' ' ' TYR . . . . . 0.418 ' CD1' ' HB ' ' B' ' 9' ' ' VAL . 2.9 m-85 -77.6 -34.92 53.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.95 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -55.17 -50.58 68.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.406 -0.361 . . . . 10.0 111.335 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -69.46 -35.79 75.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.081 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -63.9 -48.33 77.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.658 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 100' ' ' ILE . . . . . 0.502 ' HA ' HG22 ' B' ' 103' ' ' VAL . 65.2 mt -66.92 -38.05 80.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.273 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.84 -37.34 78.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.097 0.475 . . . . 10.0 110.422 179.185 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 64.3 ttp85 -71.43 -42.9 67.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.664 -0.698 . . . . 10.0 111.918 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' B' ' 100' ' ' ILE . 28.3 m -72.83 -30.0 31.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 N-CA-C 112.288 0.477 . . . . 10.0 112.288 -179.252 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 19.8 mmmt -88.0 -22.29 24.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.549 0.214 . . . . 10.0 111.169 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 26.0 t0 57.84 30.32 18.87 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.725 0.774 . . . . 10.0 110.782 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 3.0 m -127.44 143.28 51.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.381 -0.827 . . . . 10.0 109.756 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -75.06 -41.64 58.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.199 0.523 . . . . 10.0 110.487 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -106.24 109.03 20.84 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.573 0.701 . . . . 10.0 110.775 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.417 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 78.5 t -118.92 131.67 24.24 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.256 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 110' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 32.9 Cg_exo -59.63 101.76 0.15 Allowed 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.718 2.279 . . . . 10.0 111.381 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 111' ' ' MET . . . . . 0.565 ' HB2' HG21 ' B' ' 139' ' ' ILE . 65.8 mtt -127.16 149.67 49.86 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.154 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 112' ' ' VAL . . . . . 0.518 ' HB ' HD23 ' B' ' 79' ' ' LEU . 98.0 t -132.36 122.57 48.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.579 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 12.9 tp -76.87 115.68 16.87 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.274 -0.639 . . . . 10.0 109.274 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 114' ' ' VAL . . . . . 0.462 ' HB ' ' HA ' ' B' ' 81' ' ' VAL . 49.3 t -110.58 112.41 40.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.04 0.448 . . . . 10.0 111.425 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -95.56 95.51 1.85 Allowed Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.319 -1.112 . . . . 10.0 110.319 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -85.18 163.48 18.69 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -178.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 117' ' ' LYS . . . . . 0.51 ' HB3' HD12 ' B' ' 120' ' ' LEU . 92.5 mttt 72.13 33.19 1.62 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 115.38 -0.827 . . . . 10.0 112.208 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 118' ' ' CYS . . . . . 0.471 ' HA ' ' CD1' ' B' ' 84' ' ' ILE . 20.4 p -67.31 -17.0 64.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.761 0.315 . . . . 10.0 111.723 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -84.07 -8.93 58.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.464 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 120' ' ' LEU . . . . . 0.51 HD12 ' HB3' ' B' ' 117' ' ' LYS . 34.2 mt -84.7 124.65 72.77 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 120.762 0.315 . . . . 10.0 111.429 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -75.77 42.67 0.97 Allowed 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.111 2.541 . . . . 10.0 112.248 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 26.7 m -134.75 30.49 3.42 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.899 -0.778 . . . . 10.0 108.899 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 40.8 ttm-85 -57.63 108.93 0.62 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.379 -0.828 . . . . 10.0 111.989 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 2.5 m -98.87 -27.6 13.84 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.635 -0.711 . . . . 10.0 109.151 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 40.4 t -106.96 114.24 45.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.187 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -76.98 154.36 33.62 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.34 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 127' ' ' THR . . . . . 0.554 HG23 ' HE2' ' B' ' 141' ' ' PHE . 3.8 m -55.7 -41.06 73.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.921 -0.581 . . . . 10.0 111.517 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 11.0 ttpp -62.21 -45.11 94.81 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.803 0.335 . . . . 10.0 110.973 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -56.91 -46.8 81.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.583 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.77 -40.42 84.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.477 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -63.9 -40.44 96.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.524 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -60.7 -42.31 96.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.094 0.474 . . . . 10.0 110.44 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 42.0 tp -68.39 -44.68 74.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.415 179.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.58 -45.35 92.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.218 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -61.8 -36.01 79.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.255 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 22.9 m -67.66 -25.57 65.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.47 -179.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -95.29 -6.01 42.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.453 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 72.59 31.49 62.86 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.865 -0.684 . . . . 10.0 111.75 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 139' ' ' ILE . . . . . 0.565 HG21 ' HB2' ' B' ' 111' ' ' MET . 49.5 pt -126.25 153.05 74.48 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 110.295 -0.261 . . . . 10.0 110.295 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -81.14 158.05 20.26 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.586 2.191 . . . . 10.0 112.389 179.548 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.554 ' HE2' HG23 ' B' ' 127' ' ' THR . 45.0 t80 -122.8 129.51 51.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.535 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 32.3 mm -128.03 124.42 62.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.418 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -85.15 124.76 32.19 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.669 -0.863 . . . . 10.0 108.669 178.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 82.6 p -128.55 171.5 12.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.792 0.805 . . . . 10.0 112.974 -177.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 7.9 t -154.06 121.12 5.67 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.659 -1.155 . . . . 10.0 108.043 178.424 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.97 -17.79 62.64 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.864 0.364 . . . . 10.0 111.01 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 29.8 ttmt -81.55 -48.28 12.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.16 -0.473 . . . . 10.0 111.526 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 24.4 p -90.42 -12.8 36.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.802 0.334 . . . . 10.0 111.532 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 149' ' ' ARG . . . . . 0.576 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 40.2 ttt-85 70.04 20.22 6.56 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.694 -0.684 . . . . 10.0 111.531 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -75.7 131.93 40.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.604 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.9 -13.0 5.74 Favored Glycine 0 C--O 1.225 -0.436 0 N-CA-C 114.934 0.734 . . . . 10.0 114.934 177.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 59.7 t -53.55 -56.88 6.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -178.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -45.69 93.03 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.926 -179.425 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -66.62 -32.67 74.15 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.918 0.71 . . . . 10.0 112.918 -178.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.8 -46.52 84.52 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.074 0.464 . . . . 10.0 110.481 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -68.53 -37.41 79.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.713 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 21.4 m-30 -61.86 -45.3 94.36 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.315 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.519 ' HA ' ' HE ' ' B' ' 161' ' ' ARG . 12.2 m -61.71 -38.17 86.89 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.901 -0.591 . . . . 10.0 111.004 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.754 HD22 ' HG ' ' B' ' 79' ' ' LEU . 21.5 tp -61.53 -43.58 98.61 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 160' ' ' VAL . . . . . 0.41 HG21 HD13 ' B' ' 46' ' ' ILE . 67.0 t -65.7 -39.06 83.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.115 -0.493 . . . . 10.0 109.809 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 161' ' ' ARG . . . . . 0.519 ' HE ' ' HA ' ' B' ' 158' ' ' THR . 41.5 mtm-85 -61.6 -41.38 97.36 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.938 -0.574 . . . . 10.0 109.987 178.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -63.0 -40.5 97.97 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.202 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 163' ' ' ILE . . . . . 0.414 HG13 ' O ' ' B' ' 159' ' ' LEU . 93.1 mt -62.78 -42.07 94.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.444 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 164' ' ' ARG . . . . . 0.431 HH11 ' HD2' ' B' ' 164' ' ' ARG . 59.1 mtt180 -57.17 -52.23 66.16 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.783 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt -61.07 -39.38 89.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.666 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 -65.07 -36.92 85.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.009 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 7.8 mttt -73.63 -35.1 65.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.933 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 67.2 tt0 -69.15 -33.84 74.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.306 0.574 . . . . 10.0 109.574 179.16 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 16.2 tttp -64.59 -33.35 75.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.506 -0.77 . . . . 10.0 110.49 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 23.2 ttp -62.48 -25.42 67.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.704 -0.68 . . . . 10.0 112.067 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 39.0 m . . . . . 0 C--N 1.328 -0.347 0 CA-C-O 121.018 0.437 . . . . 10.0 111.299 179.715 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.595 0 N-CA-C 112.084 -0.406 . . . . 10.0 112.084 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' D' D ' 809' ' ' THR . . . . . 0.902 HG21 HD11 ' B' ' 36' ' ' ILE . 0.2 OUTLIER -137.2 134.2 36.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.686 0.279 . . . . 10.0 111.024 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' D' D ' 810' ' ' VAL . . . . . 0.601 HG23 HG22 ' D' ' 824' ' ' VAL . 75.3 t -106.14 133.4 50.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.122 -179.122 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 26.0 ttmt -87.27 110.31 20.11 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.419 -0.586 . . . . 10.0 109.419 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 57.5 t -99.2 125.4 52.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 120.894 0.378 . . . . 10.0 110.418 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -96.24 142.4 28.44 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.808 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 56.1 mt -107.96 150.09 39.91 Favored Pre-proline 0 C--N 1.318 -0.8 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.07 -179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -61.78 -16.87 51.72 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 123.178 2.585 . . . . 10.0 112.273 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 816' ' ' ASN . . . . . 0.479 ' OD1' ' HB3' ' B' ' 41' ' ' ARG . 0.2 OUTLIER -85.84 34.94 0.61 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.984 179.887 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' D' D ' 817' ' ' LYS . . . . . 0.605 ' HB2' ' NH1' ' B' ' 41' ' ' ARG . 5.0 mtpm? 52.43 38.25 24.83 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.124 -0.944 . . . . 10.0 112.161 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 818' ' ' GLN . . . . . 0.465 HE22 ' C ' ' B' ' 40' ' ' TYR . 72.0 mt-30 -135.73 -170.5 2.63 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 112.838 0.681 . . . . 10.0 112.838 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.36 168.4 26.75 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.336 0.589 . . . . 10.0 112.148 -178.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 14.1 t -152.38 139.15 18.87 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 107.301 -1.37 . . . . 10.0 107.301 178.173 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 821' ' ' VAL . . . . . 0.595 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 2.9 t -108.05 114.53 46.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 C-N-CA 120.147 -0.621 . . . . 10.0 112.02 -178.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 3.7 t -110.29 148.33 13.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.939 -178.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.89 146.94 37.33 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.78 0.324 . . . . 10.0 111.564 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 824' ' ' VAL . . . . . 0.601 HG22 HG23 ' D' ' 810' ' ' VAL . 47.7 t -84.68 96.39 4.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.069 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 825' ' ' ARG . . . . . 0.444 ' HB2' ' SD ' ' D' ' 828' ' ' MET . 15.3 mtp85 -99.65 103.46 15.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.52 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -59.3 123.62 17.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.952 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 128.03 -41.67 1.55 Allowed Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 115.665 -0.698 . . . . 10.0 112.041 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 828' ' ' MET . . . . . 0.444 ' SD ' ' HB2' ' D' ' 825' ' ' ARG . 12.7 ptm -81.86 154.89 25.63 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.916 0.389 . . . . 10.0 110.854 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 829' ' ' SER . . . . . 0.474 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 2.1 m -96.72 168.9 10.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.203 -0.453 . . . . 10.0 111.334 -179.039 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 830' ' ' VAL . . . . . 0.477 ' O ' ' HB2' ' D' ' 834' ' ' LEU . 69.7 t -54.86 -42.53 63.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.714 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 831' ' ' TYR . . . . . 0.515 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 36.6 t80 -55.89 -33.07 64.29 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.365 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -73.73 -59.35 2.76 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.367 0.506 . . . . 10.0 112.367 -178.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.99 -39.17 93.51 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 -179.101 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 834' ' ' LEU . . . . . 0.665 ' HG ' HG21 ' D' ' 850' ' ' VAL . 4.0 mm? -75.47 -14.9 60.46 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.429 0.529 . . . . 10.0 112.429 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 835' ' ' ASP . . . . . 0.523 ' O ' ' HG2' ' D' ' 839' ' ' LYS . 12.8 t70 -60.15 -49.52 77.31 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 7.6 mmmm -63.65 -32.5 74.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.449 -0.796 . . . . 10.0 111.046 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 837' ' ' ALA . . . . . 0.582 ' O ' HG12 ' D' ' 840' ' ' VAL . . . -70.02 -28.49 65.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.139 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 838' ' ' LEU . . . . . 0.513 HD12 ' HG3' ' D' ' 845' ' ' GLN . 91.6 mt -87.83 -39.33 14.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.549 179.125 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 839' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' D' ' 835' ' ' ASP . 30.9 mmtp -64.99 -31.88 73.33 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.404 179.046 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 840' ' ' VAL . . . . . 0.661 HG22 ' CE2' ' B' ' 40' ' ' TYR . 2.0 p -58.33 -24.95 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-O 121.426 0.632 . . . . 10.0 111.441 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -100.78 -37.89 8.51 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.314 -0.857 . . . . 10.0 110.154 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 117.01 20.29 4.92 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 111.085 -0.806 . . . . 10.0 111.085 -178.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 59.1 mt -105.32 179.74 4.18 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.775 0.322 . . . . 10.0 110.346 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -140.7 164.47 30.11 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.651 -0.5 . . . . 10.0 109.651 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 845' ' ' GLN . . . . . 0.513 ' HG3' HD12 ' D' ' 838' ' ' LEU . 22.4 mp0 -72.86 64.87 0.7 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.087 0.47 . . . . 10.0 111.2 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -123.0 -78.13 0.6 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.614 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -92.47 14.27 17.2 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.324 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 14.8 m -111.13 143.74 41.37 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.29 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 7.1 p -138.14 143.56 32.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.383 -0.371 . . . . 10.0 110.489 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 850' ' ' VAL . . . . . 0.665 HG21 ' HG ' ' D' ' 834' ' ' LEU . 18.8 t -97.13 124.31 49.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.967 0.413 . . . . 10.0 111.618 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 851' ' ' TYR . . . . . 0.673 ' HD2' ' HB3' ' D' ' 858' ' ' LYS . 4.4 m-30 -101.96 130.61 48.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.111 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 852' ' ' ARG . . . . . 0.515 ' HG3' ' HB ' ' D' ' 861' ' ' THR . 20.0 mtm180 -96.79 146.54 24.81 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.719 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 853' ' ' LEU . . . . . 0.479 HD12 ' HB2' ' D' ' 874' ' ' GLU . 13.4 mt -90.26 89.33 7.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.103 -0.499 . . . . 10.0 111.876 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 73.5 mt -105.47 106.25 20.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 178.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt 63.35 21.56 12.86 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.161 0.505 . . . . 10.0 110.706 -178.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 93.61 -22.03 37.78 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.571 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 44.2 ttt-85 -81.25 122.45 27.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.718 0.294 . . . . 10.0 111.057 -179.346 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 858' ' ' LYS . . . . . 0.673 ' HB3' ' HD2' ' D' ' 851' ' ' TYR . 87.9 mttt -65.22 118.65 9.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.07 179.253 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 7.2 m -119.76 134.78 55.11 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.433 -0.349 . . . . 10.0 111.26 -179.549 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 17.4 t -71.03 137.17 24.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.833 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 861' ' ' THR . . . . . 0.515 ' HB ' ' HG3' ' D' ' 852' ' ' ARG . 3.0 t -127.1 164.71 20.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.091 179.517 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -90.84 159.13 16.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.756 0.312 . . . . 10.0 110.913 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 863' ' ' TRP . . . . . 0.515 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 96.5 m95 -79.53 -23.31 42.98 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.053 0.454 . . . . 10.0 110.801 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -79.75 -13.72 59.24 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.61 -179.182 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 865' ' ' THR . . . . . 0.408 ' O ' HG23 ' D' ' 830' ' ' VAL . 3.8 m -63.49 139.92 58.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.488 -0.324 . . . . 10.0 110.851 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 866' ' ' ALA . . . . . 0.474 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -74.94 147.42 40.91 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.293 -0.262 . . . . 10.0 110.293 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 867' ' ' ILE . . . . . 0.447 HD12 ' HG ' ' D' ' 870' ' ' LEU . 5.2 tp -83.75 4.87 2.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.912 0.387 . . . . 10.0 111.599 -179.402 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 868' ' ' ALA . . . . . 0.555 ' HB3' ' HD3' ' D' ' 869' ' ' PRO . . . -56.0 -58.01 18.7 Favored Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 113.595 0.961 . . . . 10.0 113.595 -179.112 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 869' ' ' PRO . . . . . 0.555 ' HD3' ' HB3' ' D' ' 868' ' ' ALA . 67.9 Cg_endo -86.56 33.95 0.45 Allowed 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.115 1.877 . . . . 10.0 112.597 -179.508 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 870' ' ' LEU . . . . . 0.447 ' HG ' HD12 ' D' ' 867' ' ' ILE . 3.1 mm? -105.07 -5.4 20.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.943 0.401 . . . . 10.0 111.724 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -70.48 131.97 44.84 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.762 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 103.51 -0.5 46.26 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.527 -0.844 . . . . 10.0 113.542 179.391 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -136.83 173.75 11.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.449 0.625 . . . . 10.0 111.733 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 874' ' ' GLU . . . . . 0.479 ' HB2' HD12 ' D' ' 853' ' ' LEU . 69.6 mt-10 -109.9 162.18 14.75 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.066 -0.516 . . . . 10.0 109.973 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 96.7 mt -131.13 119.5 22.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.43 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 876' ' ' ILE . . . . . 0.635 HD13 ' HE2' ' D' ' 858' ' ' LYS . 3.0 mp -106.65 124.61 62.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 877' ' ' VAL . . . . . 0.434 HG11 HD21 ' D' ' 838' ' ' LEU . 39.0 t -93.02 120.04 41.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 120.895 0.378 . . . . 10.0 110.828 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -106.48 153.73 21.87 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 94.7 t -118.37 118.68 58.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.834 -0.432 . . . . 10.0 109.834 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 37.9 mt . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.406 -0.806 . . . . 10.0 110.246 -179.488 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 26.0 mt . . . . . 0 C--O 1.22 -0.491 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 240' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 240' ' ' ARG . 45.4 mtt85 -72.43 -38.45 68.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.545 0.212 . . . . 10.0 111.364 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -65.12 -24.05 67.31 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.151 -0.685 . . . . 10.0 109.151 178.379 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 242' ' ' GLU . . . . . 0.541 ' OE1' ' HA ' ' C' ' 528' ' ' ARG . 8.3 mt-10 -89.83 -43.49 10.6 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.043 -0.98 . . . . 10.0 110.053 178.43 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 243' ' ' MET . . . . . 0.612 ' HA ' ' HB2' ' A' ' 246' ' ' ASP . 75.4 mmm -59.38 -30.58 68.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.834 0.35 . . . . 10.0 111.114 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 244' ' ' SER . . . . . 0.635 ' O ' ' HB2' ' A' ' 248' ' ' GLU . 1.4 p -66.05 -32.83 74.53 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 178.217 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 245' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 249' ' ' GLU . 42.1 mmtt -81.82 -43.69 17.94 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 108.695 -0.854 . . . . 10.0 108.695 178.257 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 246' ' ' ASP . . . . . 0.612 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.3 OUTLIER -52.47 -59.09 4.85 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.464 178.868 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 71.8 mt -65.19 -33.23 75.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.617 -0.719 . . . . 10.0 111.42 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 248' ' ' GLU . . . . . 0.635 ' HB2' ' O ' ' A' ' 244' ' ' SER . 28.3 tt0 -60.57 -54.78 41.27 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.924 -0.399 . . . . 10.0 109.924 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 249' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 245' ' ' LYS . 44.3 mt-10 -67.46 -37.82 83.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.511 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 250' ' ' VAL . . . . . 0.611 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 25.2 t -65.2 -46.41 90.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.618 -0.265 . . . . 10.0 111.246 179.335 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 251' ' ' LYS . . . . . 0.428 ' O ' HG12 ' A' ' 254' ' ' VAL . 97.7 mttt -71.67 -42.25 67.71 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.708 0.262 . . . . 10.0 111.708 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -65.19 -35.25 80.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.845 0.355 . . . . 10.0 110.658 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -88.33 -21.95 24.11 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.678 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.611 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -60.33 -27.83 40.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.743 0.306 . . . . 10.0 110.765 179.72 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -64.62 -63.9 3.25 Favored Pre-proline 0 N--CA 1.452 -0.337 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.587 178.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.29 -32.38 72.98 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 121.821 1.681 . . . . 10.0 111.841 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 5.8 m-30 -63.87 -51.12 66.05 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.769 0.319 . . . . 10.0 110.445 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 59.2 mt -73.87 -34.66 64.55 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.032 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -64.06 -48.07 77.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.805 0.336 . . . . 10.0 110.737 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 260' ' ' ASP . . . . . 0.488 ' O ' ' HE2' ' A' ' 264' ' ' LYS . 38.3 t70 -60.72 -44.45 96.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.069 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -69.09 -34.8 75.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.649 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -63.57 -45.74 89.07 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 263' ' ' LYS . . . . . 0.519 ' O ' ' HG3' ' A' ' 267' ' ' GLU . 21.6 mttt -63.87 -42.66 97.45 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.044 -0.725 . . . . 10.0 109.044 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.526 ' HD2' ' HB1' ' C' ' 509' ' ' ALA . 0.1 OUTLIER -60.28 -48.7 80.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.438 178.565 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 1.6 m95 -60.75 -37.72 82.78 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.434 179.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -63.19 -50.41 70.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.86 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 267' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 13.0 mt-10 -62.25 -43.22 99.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 179.048 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 268' ' ' GLU . . . . . 0.455 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 26.6 mt-10 -60.74 -48.81 80.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.111 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 67.1 mmm -68.12 -40.48 82.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.499 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -62.69 -49.44 75.09 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.175 -0.305 . . . . 10.0 110.175 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 71.4 mt -64.73 -34.51 78.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.393 -0.595 . . . . 10.0 109.393 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 272' ' ' TYR . . . . . 0.427 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 11.9 t80 -64.5 -50.86 65.75 Favored 'General case' 0 C--O 1.217 -0.649 0 CA-C-N 115.495 -0.775 . . . . 10.0 109.753 178.564 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 273' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 273' ' ' ARG . 58.0 mtt180 -62.57 -42.35 99.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.926 0.393 . . . . 10.0 110.492 179.349 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -59.76 -25.44 64.89 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.956 -179.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.728 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 73.0 mttt -100.83 -36.45 9.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.435 179.165 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 3.0 t -51.92 -44.86 38.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 122.394 0.278 . . . . 10.0 111.17 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -60.37 -61.97 6.88 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 112.519 0.563 . . . . 10.0 112.519 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 278' ' ' PRO . . . . . 0.467 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 14.0 Cg_endo -59.53 -38.63 81.66 Favored 'Trans proline' 0 C--N 1.356 0.973 0 C-N-CA 121.886 1.724 . . . . 10.0 111.954 178.686 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.869 HD22 ' HG2' ' C' ' 495' ' ' LYS . 44.0 mt -65.66 -32.15 73.56 Favored 'General case' 0 N--CA 1.46 0.07 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -72.07 -33.92 68.3 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 177.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.22 -39.51 89.64 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 178.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 282' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 83.4 mt-10 -65.0 -45.88 83.75 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 108.78 -0.822 . . . . 10.0 108.78 178.046 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 47.8 mt -63.5 -37.82 88.76 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 115.364 -0.835 . . . . 10.0 109.946 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -66.41 -56.46 10.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.48 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -59.03 -46.21 88.79 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.737 -0.468 . . . . 10.0 109.737 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -59.72 -49.94 73.12 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 111.336 -0.706 . . . . 10.0 111.336 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.12 -40.51 94.05 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 110.596 -0.15 . . . . 10.0 110.596 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 288' ' ' ARG . . . . . 0.431 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 90.0 mtt180 -61.36 -42.18 98.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.57 -0.286 . . . . 10.0 110.233 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -64.9 -51.14 63.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.31 0.576 . . . . 10.0 109.656 178.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 50.9 mttt -60.2 -46.41 89.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.195 -0.912 . . . . 10.0 110.957 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 19.9 mt -67.05 -39.81 86.99 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.954 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 292' ' ' HIS . . . . . 0.431 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 20.2 t-160 -58.12 -46.55 85.4 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 293' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 297' ' ' LYS . 0.2 OUTLIER -65.3 -45.67 83.44 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.86 179.367 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 294' ' ' LEU . . . . . 0.435 ' O ' ' HG ' ' A' ' 298' ' ' LEU . 88.8 mt -64.5 -42.64 95.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.43 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -63.47 -42.5 98.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.7 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -77.8 -6.72 55.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.025 0.44 . . . . 10.0 110.932 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 297' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 293' ' ' GLU . 14.1 tptt -94.28 -37.04 11.71 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.19 -1.041 . . . . 10.0 108.19 177.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 298' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 294' ' ' LEU . 79.8 mt -62.93 -24.49 67.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.381 -0.827 . . . . 10.0 111.48 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 299' ' ' SER . . . . . 0.522 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 0.7 OUTLIER -68.79 -65.12 1.4 Allowed Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 121.193 -0.203 . . . . 10.0 111.444 179.232 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 300' ' ' PRO . . . . . 0.522 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 30.8 Cg_endo -64.56 -42.86 14.95 Favored 'Trans proline' 0 C--N 1.358 1.047 0 C-N-CA 122.13 1.887 . . . . 10.0 111.894 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.813 HD22 ' HE2' ' C' ' 473' ' ' LYS . 45.0 mt -66.5 -29.98 70.21 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 179.027 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -72.73 -39.58 55.11 Favored Glycine 0 N--CA 1.445 -0.73 0 N-CA-C 110.265 -1.134 . . . . 10.0 110.265 178.25 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -61.27 -41.57 97.15 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.525 -0.917 . . . . 10.0 108.525 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 304' ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' ' 308' ' ' ARG . 96.9 mt-10 -62.15 -49.38 76.06 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.27 -0.877 . . . . 10.0 108.905 178.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -59.22 -41.12 87.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.052 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 -62.62 -48.75 78.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.768 0.318 . . . . 10.0 110.332 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.35 -39.82 89.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.003 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 308' ' ' ARG . . . . . 1.25 ' HG3' ' CD1' ' C' ' 469' ' ' LEU . 2.4 mmt85 -66.9 -37.91 85.27 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.773 -0.455 . . . . 10.0 109.773 178.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -67.89 -36.78 80.84 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.376 -0.972 . . . . 10.0 108.376 177.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 310' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' A' ' 310' ' ' ARG . 36.0 ttm180 -61.67 -50.49 72.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.352 -0.84 . . . . 10.0 108.896 178.185 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.08 -41.12 95.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.146 0.498 . . . . 10.0 109.684 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 312' ' ' HIS . . . . . 0.416 ' HA ' ' HD3' ' C' ' 462' ' ' LYS . 0.8 OUTLIER -57.65 -56.21 24.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.487 179.314 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 83.6 t -69.68 -42.24 80.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.475 -0.784 . . . . 10.0 112.306 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 314' ' ' ASP . . . . . 0.563 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 0.5 OUTLIER -64.26 -43.2 95.58 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.518 -0.473 . . . . 10.0 111.493 -179.655 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 315' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 319' ' ' HIS . . . -65.06 -32.37 74.05 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.491 -0.929 . . . . 10.0 108.491 178.224 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 12.8 mt -70.5 -32.52 70.05 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.3 -0.864 . . . . 10.0 109.566 178.334 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 317' ' ' ARG . . . . . 0.563 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 95.3 mtt180 -64.69 -52.07 59.14 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 178.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.74 -11.31 58.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.829 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 319' ' ' HIS . . . . . 0.424 ' HB2' ' O ' ' A' ' 315' ' ' ALA . 0.1 OUTLIER -96.69 -47.47 5.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.975 178.97 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 320' ' ' LEU . . . . . 0.465 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 81.4 mt -67.71 -31.57 71.6 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.242 -0.436 . . . . 10.0 112.055 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 321' ' ' ALA . . . . . 0.409 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -55.86 -60.16 9.51 Favored Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 121.29 -0.164 . . . . 10.0 111.293 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 322' ' ' PRO . . . . . 0.409 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 42.5 Cg_endo -70.06 -30.86 20.23 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 121.492 1.461 . . . . 10.0 110.69 178.286 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 323' ' ' TYR . . . . . 0.465 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 3.7 m-30 -63.19 -43.03 99.37 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 116.544 -0.298 . . . . 10.0 111.379 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 324' ' ' SER . . . . . 0.505 ' HA ' HD12 ' A' ' 327' ' ' LEU . 13.6 p -69.88 -30.83 68.38 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.087 -0.708 . . . . 10.0 109.087 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -68.5 -39.27 81.34 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.642 -0.873 . . . . 10.0 108.642 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 74.4 mt-10 -67.17 -36.29 81.48 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 107.859 -1.163 . . . . 10.0 107.859 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 327' ' ' LEU . . . . . 0.522 ' HA ' ' HG2' ' A' ' 330' ' ' ARG . 70.0 mt -61.82 -38.08 86.82 Favored 'General case' 0 C--O 1.222 -0.361 0 N-CA-C 108.681 -0.859 . . . . 10.0 108.681 178.02 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 328' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 328' ' ' ARG . 48.6 mtt180 -67.63 -33.28 74.65 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -67.17 -53.67 28.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.763 -0.653 . . . . 10.0 109.455 178.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 330' ' ' ARG . . . . . 0.539 ' O ' ' HG2' ' A' ' 334' ' ' ARG . 7.7 ptp180 -63.98 -39.46 94.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.915 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 19.0 mt -61.6 -43.55 98.65 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 178.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.82 -47.47 84.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.674 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.58 -47.37 85.84 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.348 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 334' ' ' ARG . . . . . 0.566 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 8.1 mmt180 -61.69 -44.67 96.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.336 179.273 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 63.5 mt -65.57 -44.05 87.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.775 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -61.5 -37.04 82.22 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.044 0.45 . . . . 10.0 110.354 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -74.53 -43.31 56.41 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.445 -0.576 . . . . 10.0 109.445 178.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 7.9 mt -63.8 -27.61 69.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.637 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -76.24 -40.35 52.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.893 0.378 . . . . 10.0 110.139 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -71.47 -53.96 12.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.064 -0.516 . . . . 10.0 109.633 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 341' ' ' ASN . . . . . 0.432 HD21 ' HA3' ' C' ' 436' ' ' GLY . 98.0 m-20 -65.89 -31.21 72.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.629 -0.714 . . . . 10.0 109.724 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -70.6 -42.61 62.71 Favored Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.141 -0.783 . . . . 10.0 111.141 178.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.18 -40.96 99.66 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 109.637 -1.385 . . . . 10.0 109.637 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -67.84 -43.01 80.5 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.157 -0.683 . . . . 10.0 109.157 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 20.9 mtt180 -54.55 -50.7 67.31 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.406 178.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 87.7 mt -58.98 -42.89 91.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.498 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -64.15 -45.79 86.9 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -60.36 -50.61 72.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.128 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -59.05 -43.72 91.72 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.062 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -68.74 -44.64 73.34 Favored 'General case' 0 C--N 1.33 -0.252 0 O-C-N 123.11 0.257 . . . . 10.0 111.434 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.57 -33.3 73.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.234 0.54 . . . . 10.0 110.688 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 352' ' ' LYS . . . . . 0.649 ' HG2' HG22 ' C' ' 422' ' ' VAL . 4.9 mtmm -86.75 -20.71 27.25 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.246 178.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -72.49 -38.74 68.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.086 -0.506 . . . . 10.0 109.764 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -40.63 94.79 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 178.436 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -69.16 -27.56 65.64 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.671 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -71.33 -47.77 54.52 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 108.159 -1.052 . . . . 10.0 108.159 177.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 84.9 mt -62.26 -43.2 99.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.124 -0.944 . . . . 10.0 111.984 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 10.0 p -60.43 -50.41 73.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.731 0.3 . . . . 10.0 111.095 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 7.5 p -66.38 -35.96 81.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.942 179.524 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 34.1 mt -67.27 -31.6 72.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.429 -0.35 . . . . 10.0 110.185 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 50.7 m -67.81 -29.34 68.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.147 0.499 . . . . 10.0 109.929 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 362' ' ' GLU . . . . . 0.45 ' C ' ' HD2' ' A' ' 366' ' ' PRO . 11.4 mt-10 -76.3 -5.18 45.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.526 0.679 . . . . 10.0 109.73 178.516 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.552 ' O ' ' HB3' ' A' ' 367' ' ' ALA . 39.6 mttm -109.13 -38.92 5.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.83 -0.804 . . . . 10.0 108.83 178.163 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -71.07 -21.12 62.28 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.502 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.817 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 99.5 mttt -105.62 -74.48 0.02 OUTLIER Pre-proline 0 CA--C 1.537 0.448 0 N-CA-C 112.457 0.54 . . . . 10.0 112.457 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.817 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 32.2 Cg_exo -59.63 -47.74 15.27 Favored 'Trans proline' 0 C--N 1.357 1.005 0 C-N-CA 122.27 1.98 . . . . 10.0 113.278 -179.273 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 367' ' ' ALA . . . . . 0.552 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -66.93 -43.19 83.9 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.912 -0.315 . . . . 10.0 111.327 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 1.1 mt -65.92 -39.05 90.18 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 121.03 -0.268 . . . . 10.0 110.901 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 369' ' ' GLU . . . . . 0.639 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 5.6 mm-40 -64.43 -38.55 91.42 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.036 -0.728 . . . . 10.0 109.036 178.252 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -63.37 -41.44 98.82 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.333 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 79.3 mt -62.82 -45.0 94.66 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.362 -0.836 . . . . 10.0 110.006 178.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 72.0 mtt180 -64.95 -40.11 94.52 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.583 -0.525 . . . . 10.0 109.583 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.639 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.5 mt-30 -63.54 -30.97 72.01 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.56 -0.745 . . . . 20.0 112.051 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -85.75 -34.85 12.43 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 109.481 -1.448 . . . . 10.0 109.481 178.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 13.9 mt -57.11 -41.88 79.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.652 -0.274 . . . . 10.0 111.51 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 72.8 mt -54.34 -62.98 3.14 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 112.491 0.552 . . . . 10.0 112.491 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -63.39 -37.52 48.87 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 121.836 1.691 . . . . 10.0 111.657 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 18.3 t -61.66 -49.39 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 O-C-N 122.986 0.179 . . . . 10.0 110.677 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 59.4 mt -61.38 -39.45 90.72 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.503 -0.554 . . . . 10.0 109.503 178.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 380' ' ' GLU . . . . . 0.499 ' O ' HG23 ' A' ' 384' ' ' VAL . 19.1 mt-10 -63.24 -49.28 74.75 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.678 178.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 5.1 p -63.02 -38.92 93.11 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 120.928 0.394 . . . . 10.0 110.541 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -65.42 -43.43 90.52 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.737 178.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 383' ' ' LYS . . . . . 0.441 ' O ' ' HG ' ' A' ' 387' ' ' LEU . 83.5 mttt -61.81 -40.25 94.59 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.357 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 384' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 380' ' ' GLU . 73.2 t -60.43 -44.99 97.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.573 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 13.5 m -63.73 -42.66 97.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.706 178.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -64.38 -41.13 96.84 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.941 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 383' ' ' LYS . 83.6 mt -60.1 -37.95 81.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.37 0.605 . . . . 10.0 110.372 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 388' ' ' SER . . . . . 0.736 ' HB3' ' HE2' ' C' ' 594' ' ' LYS . 13.1 m -77.27 -41.11 42.22 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.681 -0.69 . . . . 10.0 110.002 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -62.83 -43.52 98.58 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.692 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 77.6 mt -65.54 -32.46 74.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.852 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -66.14 -49.04 68.84 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 179.204 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.49 -29.05 70.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.742 -0.663 . . . . 10.0 109.891 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -67.86 -20.87 65.18 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.48 0.712 . . . . 10.0 111.078 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.89 12.07 31.08 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 121.091 0.472 . . . . 10.0 110.705 -179.187 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 395' ' ' LYS . . . . . 0.403 ' HE3' ' HB2' ' A' ' 395' ' ' LYS . 46.3 mtmt . . . . . 0 C--N 1.316 -0.869 0 CA-C-O 121.09 0.471 . . . . 10.0 111.265 179.101 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.541 0.62 0 CA-C-O 120.783 0.325 . . . . 10.0 111.518 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 12.9 mt -78.08 -31.61 50.27 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.874 -0.417 . . . . 10.0 109.874 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -71.81 -47.87 50.29 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.009 -0.996 . . . . 10.0 111.51 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -62.91 -42.58 99.84 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 114.956 -1.02 . . . . 10.0 110.567 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -37.43 75.98 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 123.337 0.398 . . . . 10.0 110.563 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -62.18 -44.15 97.24 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.326 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 3.1 m -64.89 -36.11 83.3 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.331 0.586 . . . . 10.0 109.582 178.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 62.4 t -67.47 -46.95 82.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.06 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 52.6 m -60.83 -43.58 98.07 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.441 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 28.7 m -62.71 -40.41 97.05 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 120.846 0.355 . . . . 10.0 110.633 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 10.9 p -76.65 -11.23 59.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 10.0 111.057 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 412' ' ' PHE . . . . . 0.511 ' O ' ' HB2' ' C' ' 415' ' ' LEU . 45.8 t80 -85.6 -38.59 18.27 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 108.667 -0.864 . . . . 10.0 108.667 177.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 24.9 m -62.25 -39.91 94.42 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.616 -0.883 . . . . 10.0 108.616 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -66.49 -19.81 65.88 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.284 -0.871 . . . . 10.0 110.451 178.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 415' ' ' LEU . . . . . 0.511 ' HB2' ' O ' ' C' ' 412' ' ' PHE . 30.1 mt -76.37 -32.97 58.91 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 108.529 -0.915 . . . . 10.0 108.529 177.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 -74.16 -42.59 59.68 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 178.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -68.17 -14.09 62.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.624 -0.717 . . . . 10.0 109.852 178.707 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -94.67 -53.72 3.77 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.171 -0.922 . . . . 10.0 108.989 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 419' ' ' LEU . . . . . 0.419 ' HA ' ' HB ' ' C' ' 422' ' ' VAL . 43.5 mt -60.32 -28.92 68.52 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.711 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -54.19 -73.03 0.45 Allowed Glycine 0 CA--C 1.518 0.256 0 N-CA-C 111.37 -0.692 . . . . 10.0 111.37 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.32 -34.9 98.67 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.391 2.061 . . . . 10.0 111.177 178.432 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 422' ' ' VAL . . . . . 0.649 HG22 ' HG2' ' A' ' 352' ' ' LYS . 12.6 t -58.87 -50.0 81.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.273 -0.422 . . . . 10.0 111.08 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 18.4 p -70.22 -38.2 75.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.66 0.267 . . . . 10.0 110.805 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -60.52 -48.32 82.27 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.816 -0.439 . . . . 10.0 109.816 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -67.39 -37.75 83.61 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.077 -0.511 . . . . 10.0 109.624 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -63.19 -36.91 85.2 Favored 'General case' 0 C--O 1.225 -0.188 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 28.4 m95 -66.27 -42.9 87.79 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 178.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 428' ' ' ASP . . . . . 0.554 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 37.7 t70 -65.17 -37.31 86.98 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.972 -0.751 . . . . 10.0 108.972 178.341 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -65.28 -44.79 86.9 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.702 -0.851 . . . . 10.0 108.702 177.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 46.9 mt -62.38 -32.43 73.24 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.469 -0.787 . . . . 10.0 109.371 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -66.37 -41.6 89.23 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 178.014 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 432' ' ' LYS . . . . . 0.554 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 53.0 mttp -64.72 -45.27 87.22 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 108.423 -0.954 . . . . 10.0 108.423 178.238 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -61.2 -48.42 81.63 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.051 -0.977 . . . . 10.0 110.734 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 10.7 p -66.17 -38.6 88.44 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.826 -0.17 . . . . 10.0 111.195 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -61.59 -47.59 84.76 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.843 -0.799 . . . . 10.0 108.843 178.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 436' ' ' GLY . . . . . 0.432 ' HA3' HD21 ' A' ' 341' ' ' ASN . . . -63.87 -46.5 91.49 Favored Glycine 0 N--CA 1.443 -0.889 0 N-CA-C 110.048 -1.221 . . . . 10.0 110.048 177.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 34.6 mt -58.61 -33.26 69.81 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-O 120.517 0.199 . . . . 10.0 110.925 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -70.32 -38.29 74.9 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 178.817 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -71.39 -30.54 66.24 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.017 -0.735 . . . . 10.0 109.017 178.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 440' ' ' GLU . . . . . 0.566 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 37.4 mt-10 -75.29 -57.56 3.82 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.253 -0.885 . . . . 10.0 109.782 178.506 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 95.7 mmm -61.71 -29.21 69.95 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 113.743 1.016 . . . . 10.0 113.743 -178.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 5.5 p -63.15 -51.87 64.72 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -71.62 -36.23 70.71 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.587 -0.733 . . . . 10.0 109.531 178.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 444' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 5.7 t0 -57.29 -57.72 11.39 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.503 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 24.9 mt -64.18 -37.13 86.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.568 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -62.67 -49.94 73.16 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 178.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 447' ' ' GLU . . . . . 0.474 ' HB3' HH21 ' A' ' 330' ' ' ARG . 7.5 tt0 -66.14 -34.02 77.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.661 -0.7 . . . . 10.0 109.662 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 448' ' ' VAL . . . . . 0.534 HG23 HH22 ' A' ' 330' ' ' ARG . 2.6 t -60.96 -46.93 95.63 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.232 0 N-CA-C 109.367 -0.605 . . . . 10.0 109.367 178.493 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 83.9 mttt -67.21 -38.38 85.21 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 178.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -70.35 -11.69 61.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.318 178.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 451' ' ' LYS . . . . . 0.637 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 43.3 mttm -98.76 -50.1 4.35 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.541 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 63.0 t -58.22 -41.71 81.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.688 -0.687 . . . . 10.0 111.998 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -53.95 -63.52 2.57 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 112.213 0.449 . . . . 10.0 112.213 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 454' ' ' PRO . . . . . 0.418 ' HG2' ' OH ' ' A' ' 323' ' ' TYR . 43.1 Cg_endo -70.98 -20.9 28.5 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 121.643 1.562 . . . . 10.0 111.789 179.025 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 455' ' ' TYR . . . . . 0.637 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.4 OUTLIER -70.0 -50.85 37.4 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 179.1 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 456' ' ' LEU . . . . . 0.457 ' O ' ' HB2' ' C' ' 460' ' ' GLN . 17.5 mt -69.47 -36.31 76.45 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.061 -0.518 . . . . 10.0 109.915 179.154 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 457' ' ' ASP . . . . . 0.426 ' O ' ' HG3' ' C' ' 461' ' ' LYS . 7.7 t70 -62.13 -40.45 95.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.286 0.565 . . . . 10.0 110.558 179.011 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -79.33 -42.67 25.16 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.621 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 459' ' ' PHE . . . . . 0.444 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 1.0 OUTLIER -63.31 -40.89 98.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.662 179.377 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 460' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' C' ' 456' ' ' LEU . 14.3 mt-30 -62.44 -36.61 82.97 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.446 179.02 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 461' ' ' LYS . . . . . 0.426 ' HG3' ' O ' ' C' ' 457' ' ' ASP . 17.9 mttp -67.35 -40.6 85.84 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.054 -0.721 . . . . 10.0 109.054 178.379 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 462' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' C' ' 466' ' ' GLU . 15.5 mtmm -65.7 -43.74 88.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.324 178.434 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 463' ' ' TRP . . . . . 0.499 ' O ' ' HB2' ' C' ' 467' ' ' MET . 23.6 m0 -66.39 -34.4 77.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.15 178.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 464' ' ' GLN . . . . . 0.553 ' O ' ' HG3' ' C' ' 468' ' ' GLU . 37.6 mt-30 -67.0 -53.03 35.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.281 179.234 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 0.979 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 4.1 pt-20 -63.3 -31.61 72.8 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.076 0.465 . . . . 10.0 110.295 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 466' ' ' GLU . . . . . 0.506 ' HA ' HD12 ' C' ' 469' ' ' LEU . 6.9 tt0 -73.83 -37.82 64.72 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.188 -0.671 . . . . 10.0 109.188 178.615 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 467' ' ' MET . . . . . 0.499 ' HB2' ' O ' ' C' ' 463' ' ' TRP . 0.0 OUTLIER -63.64 -45.73 88.9 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.743 -0.836 . . . . 10.0 108.743 178.609 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 468' ' ' GLU . . . . . 0.553 ' HG3' ' O ' ' C' ' 464' ' ' GLN . 46.4 mt-10 -62.42 -40.45 96.58 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.498 -0.927 . . . . 10.0 108.498 178.008 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 1.25 ' CD1' ' HG3' ' A' ' 308' ' ' ARG . 96.4 mt -61.92 -40.16 94.53 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 115.169 -0.923 . . . . 20.0 110.0 178.416 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 13.8 m-30 -67.23 -41.26 86.0 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.501 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -60.82 -48.57 81.21 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 472' ' ' GLN . . . . . 0.453 HE21 ' HB3' ' C' ' 472' ' ' GLN . 0.0 OUTLIER -82.34 28.12 0.47 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.595 179.596 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 473' ' ' LYS . . . . . 0.813 ' HE2' HD22 ' A' ' 301' ' ' LEU . 0.0 OUTLIER -134.99 -62.78 0.71 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.383 -0.826 . . . . 10.0 109.028 178.675 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 61.8 t -65.66 -39.11 83.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.26 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -62.42 -58.62 16.18 Favored Pre-proline 0 CA--C 1.535 0.394 0 N-CA-C 112.061 0.393 . . . . 10.0 112.061 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -63.52 -37.88 45.39 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 121.649 1.566 . . . . 10.0 111.389 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 477' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' C' ' 477' ' ' LEU . 29.2 mt -66.98 -31.38 71.91 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.49 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -63.56 -36.19 82.98 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.565 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -70.89 -43.31 68.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.492 178.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.95 -43.61 95.29 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 59.1 mt -68.95 -30.48 68.94 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.551 -0.75 . . . . 10.0 110.195 178.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -66.97 -47.54 71.27 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -69.26 -34.27 74.51 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -68.21 -40.94 87.56 Favored Glycine 0 N--CA 1.445 -0.724 0 N-CA-C 109.873 -1.291 . . . . 10.0 109.873 177.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.41 76.72 Favored 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 44.8 mtt180 -61.73 -41.56 97.8 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 487' ' ' GLN . . . . . 0.542 ' O ' ' HG3' ' C' ' 491' ' ' GLU . 0.4 OUTLIER -63.69 -44.22 94.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.363 178.007 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 488' ' ' LYS . . . . . 0.402 ' O ' ' HG ' ' C' ' 492' ' ' LEU . 83.0 tttt -67.14 -40.4 86.74 Favored 'General case' 0 C--N 1.33 -0.249 0 O-C-N 123.276 0.36 . . . . 10.0 110.355 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 45.6 mt -64.76 -44.51 89.83 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.349 -0.611 . . . . 10.0 109.349 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.04 -39.19 91.48 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 108.795 -0.817 . . . . 10.0 108.795 178.392 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 491' ' ' GLU . . . . . 0.726 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 36.7 mt-10 -61.71 -49.97 74.31 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 108.133 -1.062 . . . . 10.0 108.133 177.366 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 492' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' C' ' 488' ' ' LYS . 90.3 mt -58.89 -37.34 76.36 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.872 -0.603 . . . . 10.0 110.674 179.427 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -63.69 -37.05 85.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.91 0.386 . . . . 10.0 110.151 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -88.93 -0.88 57.78 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.626 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.869 ' HG2' HD22 ' A' ' 279' ' ' LEU . 12.3 mttm -113.37 -55.75 2.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.817 0.341 . . . . 10.0 110.998 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 90.8 mt -64.96 -31.52 72.8 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.913 0.709 . . . . 10.0 112.913 -178.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 12.8 m -68.14 -59.09 6.69 Favored Pre-proline 0 CA--C 1.537 0.459 0 C-N-CA 120.722 -0.391 . . . . 10.0 112.005 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -62.63 -36.63 62.8 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.745 1.63 . . . . 10.0 110.866 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 34.5 mt -71.04 -34.96 71.77 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.095 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -65.7 -49.56 58.96 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 110.725 -0.95 . . . . 10.0 110.725 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.11 -41.63 97.03 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 178.407 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 502' ' ' GLU . . . . . 0.474 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 25.0 tt0 -64.84 -47.61 77.34 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.493 -0.776 . . . . 10.0 109.819 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 503' ' ' MET . . . . . 0.786 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 62.9 mmm -59.44 -38.05 79.7 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.752 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 20.5 mtt85 -64.98 -40.47 95.03 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 178.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 505' ' ' ASP . . . . . 0.519 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 0.4 OUTLIER -70.63 -36.1 73.27 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 178.599 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.786 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 44.3 mtt180 -62.87 -45.86 90.57 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 107.442 -1.318 . . . . 10.0 107.442 177.23 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -62.21 -38.73 90.29 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 114.857 -1.065 . . . . 10.0 109.361 178.536 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 508' ' ' ARG . . . . . 0.519 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 78.7 mtt180 -58.3 -53.57 56.81 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.111 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 509' ' ' ALA . . . . . 0.526 ' HB1' ' HD2' ' A' ' 264' ' ' LYS . . . -60.08 -36.14 76.73 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.485 -0.78 . . . . 10.0 111.144 179.446 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 510' ' ' HIS . . . . . 0.5 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 16.2 m-70 -74.47 -49.64 21.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.577 0.227 . . . . 10.0 111.549 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 79.2 t -65.74 -41.67 90.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 120.715 0.293 . . . . 10.0 110.509 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.403 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 3.3 t70 -63.97 -37.41 87.32 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.48 -44.78 86.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.344 -0.984 . . . . 10.0 108.344 177.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 514' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 89.2 mt -58.99 -32.67 69.89 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.372 178.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 515' ' ' ARG . . . . . 0.403 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 66.4 mtt180 -65.04 -34.7 79.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.326 178.802 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.3 5.19 46.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.684 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -117.22 -43.97 2.81 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.848 0.314 . . . . 10.0 111.848 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 92.1 mt -90.07 -47.83 7.57 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.409 0.522 . . . . 10.0 112.409 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 519' ' ' ALA . . . . . 0.411 ' N ' ' HD2' ' C' ' 520' ' ' PRO . . . -50.54 -55.37 26.68 Favored Pre-proline 0 N--CA 1.468 0.472 0 N-CA-C 112.904 0.705 . . . . 10.0 112.904 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 520' ' ' PRO . . . . . 0.411 ' HD2' ' N ' ' C' ' 519' ' ' ALA . 29.7 Cg_endo -64.91 -31.8 56.0 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 121.692 1.595 . . . . 10.0 110.701 178.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -64.11 -43.85 94.06 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.725 -0.67 . . . . 10.0 109.786 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.85 -31.24 71.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.001 0.429 . . . . 10.0 109.968 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 523' ' ' ASP . . . . . 0.688 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 30.3 t70 -70.02 -39.14 75.97 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.425 -0.583 . . . . 10.0 109.425 178.838 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -72.38 -33.23 67.05 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 177.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 525' ' ' LEU . . . . . 0.741 HD23 ' HD2' ' C' ' 528' ' ' ARG . 25.3 mt -66.89 -29.13 68.94 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.541 -0.754 . . . . 10.0 109.23 177.663 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 526' ' ' ARG . . . . . 0.688 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 63.5 mtt180 -60.91 -38.62 86.37 Favored 'General case' 0 C--O 1.224 -0.249 0 N-CA-C 109.681 -0.489 . . . . 10.0 109.681 178.537 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -66.95 -44.47 80.5 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.831 -0.803 . . . . 10.0 108.831 178.546 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 528' ' ' ARG . . . . . 0.741 ' HD2' HD23 ' C' ' 525' ' ' LEU . 77.6 mtt180 -63.85 -41.77 97.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 114.849 -1.069 . . . . 10.0 110.662 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 62.1 mt -68.09 -43.18 79.08 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.256 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.87 -43.51 98.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.922 179.624 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.3 -45.1 77.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.361 -0.381 . . . . 10.0 110.153 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 532' ' ' ARG . . . . . 0.569 ' NH2' ' HB3' ' C' ' 528' ' ' ARG . 1.1 ttm180 -61.9 -40.58 95.96 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 533' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' C' ' 537' ' ' LYS . 18.9 mt -64.29 -36.6 84.64 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.021 178.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -66.37 -40.92 90.02 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.839 -0.43 . . . . 10.0 109.839 178.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.26 -45.8 86.49 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 178.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 91.6 mt -69.94 -19.05 63.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.539 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 537' ' ' LYS . . . . . 0.501 ' HB2' ' O ' ' C' ' 533' ' ' LEU . 64.7 tttt -82.23 -44.37 16.42 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.662 -0.496 . . . . 10.0 109.662 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -68.6 -50.23 53.17 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.699 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -67.97 -37.58 81.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.727 -0.669 . . . . 10.0 109.388 179.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 540' ' ' GLY . . . . . 0.517 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -65.75 -43.04 94.84 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.251 -0.74 . . . . 10.0 111.251 179.228 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -63.18 -42.54 99.39 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 110.399 -1.08 . . . . 10.0 110.399 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -64.3 -42.69 96.24 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.413 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 543' ' ' ARG . . . . . 0.401 ' HD2' HH11 ' C' ' 543' ' ' ARG . 44.4 mtt85 -60.14 -39.54 86.71 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.367 179.084 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 544' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 79.8 mt -58.62 -42.23 87.76 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 178.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.92 -45.33 74.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.754 -0.657 . . . . 10.0 109.437 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -60.0 -48.49 81.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.318 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -59.72 -39.84 86.03 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.261 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 40.5 m170 -65.98 -43.26 88.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.449 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.48 -44.8 85.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.091 -0.504 . . . . 10.0 109.876 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 550' ' ' LYS . . . . . 0.473 ' HA ' ' OE1' ' C' ' 553' ' ' GLU . 0.2 OUTLIER -67.85 -27.33 66.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.256 179.345 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.62 -44.7 73.66 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.163 -0.68 . . . . 10.0 109.163 178.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.94 -38.19 85.71 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.702 -0.481 . . . . 10.0 109.702 178.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 553' ' ' GLU . . . . . 0.473 ' OE1' ' HA ' ' C' ' 550' ' ' LYS . 85.2 mt-10 -63.86 -36.71 84.83 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -72.05 -45.65 59.97 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.105 178.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 63.1 mt -61.68 -38.74 88.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.099 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 33.9 m -64.4 -46.35 83.68 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.5 -0.318 . . . . 10.0 110.38 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 1.1 p -69.47 -26.94 64.81 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.103 0.477 . . . . 10.0 110.694 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 54.2 mt -77.91 -25.84 48.68 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.391 178.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 56.7 m -64.59 -41.24 96.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.042 0.449 . . . . 10.0 111.112 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -72.96 -11.47 60.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.176 0.512 . . . . 10.0 111.005 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 561' ' ' LYS . . . . . 0.51 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 11.3 mptt -104.51 -28.13 11.48 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.792 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -83.96 -18.49 37.09 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.433 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 563' ' ' LYS . . . . . 0.853 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 50.0 mtmt -112.29 -74.9 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.348 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 564' ' ' PRO . . . . . 0.853 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 74.7 Cg_exo -52.92 -49.19 18.45 Favored 'Trans proline' 0 C--N 1.359 1.081 0 C-N-CA 122.171 1.914 . . . . 10.0 112.517 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 565' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -64.07 -40.18 95.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.698 0.285 . . . . 10.0 110.923 179.515 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 49.5 tp -66.78 -38.87 87.41 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.579 -0.282 . . . . 10.0 110.46 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 567' ' ' GLU . . . . . 0.928 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 4.0 mm-40 -59.06 -45.56 90.46 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.671 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -68.91 -41.59 77.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.449 178.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 43.6 mt -58.98 -44.93 91.66 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.837 0.351 . . . . 10.0 110.123 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 570' ' ' ARG . . . . . 0.454 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 60.1 mtt180 -68.85 -35.54 77.07 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.576 -0.528 . . . . 10.0 109.576 178.51 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 571' ' ' GLN . . . . . 0.928 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.6 mt-30 -66.28 -30.68 71.16 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.447 -0.797 . . . . 20.0 111.346 179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -84.02 -35.76 14.73 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 109.429 -1.468 . . . . 10.0 109.429 178.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 17.8 mt -62.28 -34.47 76.63 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 122.044 0.138 . . . . 10.0 111.302 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 574' ' ' LEU . . . . . 0.6 ' O ' ' HG3' ' C' ' 578' ' ' GLU . 91.4 mt -55.63 -63.25 3.34 Favored Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 112.003 0.372 . . . . 10.0 112.003 179.532 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 575' ' ' PRO . . . . . 0.428 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 36.5 Cg_endo -67.38 -29.25 38.34 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.877 1.718 . . . . 10.0 111.708 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 4.7 t -64.9 -45.21 95.49 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 N-CA-C 109.343 -0.614 . . . . 10.0 109.343 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 577' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' C' ' 581' ' ' LYS . 26.7 mt -64.5 -39.51 93.93 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.614 -0.513 . . . . 10.0 109.614 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 578' ' ' GLU . . . . . 0.6 ' HG3' ' O ' ' C' ' 574' ' ' LEU . 48.2 mt-10 -63.17 -51.19 67.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.056 179.234 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 4.7 p -62.19 -41.33 98.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.779 0.323 . . . . 10.0 110.343 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -61.7 -48.27 81.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.072 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 581' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' C' ' 577' ' ' LEU . 41.8 mtmt -58.75 -46.77 86.7 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.406 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.95 -48.49 83.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.887 0.375 . . . . 10.0 110.286 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 16.2 m -61.62 -44.06 97.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.109 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -66.97 -41.18 87.3 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.521 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 585' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' C' ' 581' ' ' LYS . 73.2 mt -59.28 -51.28 70.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.875 0.369 . . . . 10.0 110.483 179.528 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 13.1 m -63.87 -35.23 79.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.652 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -67.8 -45.35 75.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.574 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 86.2 mt -65.11 -37.03 86.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.011 0.434 . . . . 10.0 110.311 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -66.6 -29.77 69.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.461 179.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -79.5 -44.66 20.81 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.046 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -63.59 -41.89 98.32 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.805 0.669 . . . . 10.0 112.805 -179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 592' ' ' THR . . . . . 0.457 ' O ' ' HB2' ' C' ' 596' ' ' ASN . 2.1 p -60.69 -28.59 68.74 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.836 0.31 . . . . 10.0 111.836 -179.802 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -69.19 -40.21 78.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.043 0.449 . . . . 10.0 110.499 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 594' ' ' LYS . . . . . 0.736 ' HE2' ' HB3' ' A' ' 388' ' ' SER . 5.1 mptt -76.68 -37.61 55.9 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.96 -0.564 . . . . 10.0 111.105 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 90.1 mt -85.36 34.53 0.57 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.649 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 596' ' ' ASN . . . . . 0.457 ' HB2' ' O ' ' C' ' 592' ' ' THR . 9.2 t-20 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.515 -0.755 . . . . 10.0 110.007 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 14.6 t . . . . . 0 C--O 1.237 0.405 0 CA-C-O 120.774 0.321 . . . . 10.0 110.601 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 3' ' ' GLU . . . . . 0.441 ' HA ' ' O ' ' B' ' 52' ' ' LEU . 24.9 tt0 -116.29 101.37 8.62 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.884 -0.413 . . . . 10.0 109.884 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -73.7 144.49 45.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.676 -178.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.419 ' HB3' ' HA2' ' B' ' 75' ' ' GLY . 4.0 mptt -100.37 113.91 27.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.493 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.62 HD22 HD23 ' B' ' 159' ' ' LEU . 34.3 mt -110.01 108.9 19.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.49 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 58.8 t -101.89 115.09 43.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-O 120.961 0.41 . . . . 10.0 110.918 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 21.3 t -91.73 117.74 35.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.537 ' HB ' ' CE1' ' B' ' 96' ' ' TYR . 26.8 m -112.88 165.45 7.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 120.995 0.426 . . . . 10.0 111.327 -179.477 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 151.07 174.23 21.8 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.21 -0.756 . . . . 10.0 111.21 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.16 177.29 6.01 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.922 0.391 . . . . 10.0 111.271 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.84 125.64 8.48 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.873 -0.679 . . . . 10.0 111.775 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 115.24 -12.98 19.19 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.775 -0.726 . . . . 10.0 112.514 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 20.9 m -72.54 -31.73 38.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 112.003 0.371 . . . . 10.0 112.003 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 93.65 43.4 3.94 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.54 -0.838 . . . . 10.0 113.204 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 42.0 mtmt -62.13 -46.88 87.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.854 0.359 . . . . 10.0 111.64 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.5 p -63.26 -36.52 83.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.465 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.48 -47.15 82.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.653 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 45.1 mt -62.69 -44.27 96.67 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.918 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 12.7 m -64.88 -50.15 67.67 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.672 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 97.4 mt -65.43 -28.26 43.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-O 120.782 0.325 . . . . 10.0 110.999 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.644 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 6.5 tp-100 -68.29 -22.62 64.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.153 0.501 . . . . 10.0 110.8 179.43 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.7 tp -96.93 -41.48 8.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.306 0.574 . . . . 10.0 110.481 179.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 24' ' ' ILE . . . . . 0.644 ' HA ' ' HD2' ' B' ' 42' ' ' LYS . 51.1 mm -73.88 -49.16 35.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.691 -0.686 . . . . 10.0 112.506 -178.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -107.83 -18.92 13.69 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.092 0.404 . . . . 10.0 112.092 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.552 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 33.1 m-80 66.61 35.22 5.45 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.468 -0.938 . . . . 10.0 108.468 -177.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -124.53 130.99 53.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 114.183 -1.371 . . . . 10.0 109.628 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -93.51 134.76 35.45 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.456 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 16.7 m -100.43 138.41 24.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.996 0.427 . . . . 10.0 111.031 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -103.46 -26.57 12.82 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.508 0.671 . . . . 10.0 109.838 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -78.38 148.31 33.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.384 -0.826 . . . . 10.0 110.726 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -91.47 77.64 5.74 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.651 -0.5 . . . . 10.0 109.651 178.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.85 134.91 68.06 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.094 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.49 177.17 3.48 Favored 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 123.081 2.521 . . . . 10.0 112.849 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -166.72 135.37 2.82 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.199 0.523 . . . . 10.0 112.163 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.823 HD11 HG21 ' D' ' 809' ' ' THR . 4.3 mt -119.98 -67.01 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 108.551 -0.907 . . . . 10.0 108.551 179.081 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.453 ' O ' HG23 ' D' ' 821' ' ' VAL . 4.0 tt0 -146.08 92.39 2.19 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.372 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 38' ' ' ASP . . . . . 0.711 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 57.7 m-20 -111.79 160.84 16.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.379 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 39' ' ' SER . . . . . 0.415 ' HA ' ' O ' ' B' ' 55' ' ' ILE . 1.7 p -148.1 139.89 23.88 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.643 -0.253 . . . . 10.0 111.594 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 40' ' ' TYR . . . . . 0.659 ' CE2' HG22 ' D' ' 840' ' ' VAL . 24.3 m-85 -125.53 145.28 50.18 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -178.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 41' ' ' ARG . . . . . 0.459 ' NH1' ' HD3' ' D' ' 817' ' ' LYS . 1.2 ttp180 -126.81 127.98 45.85 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.754 0.311 . . . . 10.0 111.561 -178.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 42' ' ' LYS . . . . . 0.644 ' HD2' ' HA ' ' B' ' 24' ' ' ILE . 37.9 tttp -151.24 150.69 30.87 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.589 178.857 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -114.07 125.2 53.71 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 110.326 -0.249 . . . . 10.0 110.326 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 10.3 m -136.19 158.83 38.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.965 0.412 . . . . 10.0 110.848 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 47.2 t -99.77 107.11 20.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.414 -0.587 . . . . 10.0 109.414 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 72.7 mt -106.19 120.01 56.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.82 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.88 16.1 7.71 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.808 0.67 . . . . 10.0 112.808 178.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.21 -9.03 45.64 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.755 -0.736 . . . . 10.0 112.666 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -106.97 124.33 49.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.037 0.446 . . . . 10.0 110.665 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 9.5 t -85.75 128.1 34.71 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.101 -0.499 . . . . 10.0 109.742 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 1.6 p -144.71 163.05 35.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.866 0.365 . . . . 10.0 111.42 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' B' ' 3' ' ' GLU . 15.1 tp -97.5 135.75 38.91 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.09 -0.708 . . . . 10.0 109.09 179.621 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 90.6 mt -113.6 122.72 48.06 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 111.986 0.365 . . . . 10.0 111.986 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -103.53 102.33 12.23 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.103 -1.073 . . . . 10.0 108.103 177.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.566 HD12 HD11 ' B' ' 24' ' ' ILE . 44.8 mt -93.58 129.52 43.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.447 -178.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.406 HD21 ' CD1' ' B' ' 71' ' ' TYR . 53.4 tp -105.94 116.0 31.2 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.943 -0.572 . . . . 10.0 111.206 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.711 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 7.3 t0 -92.97 93.2 8.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.236 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 48.7 p -72.61 162.71 29.13 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.203 -0.908 . . . . 10.0 112.155 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.6 159.07 32.68 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.232 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -80.05 -32.07 37.03 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.747 -0.739 . . . . 10.0 111.918 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -139.24 128.45 23.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.618 0.247 . . . . 20.0 110.541 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -169.92 142.88 2.46 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.591 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -100.98 -141.33 0.34 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.252 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -68.22 122.43 18.3 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 65' ' ' SER . . . . . 0.4 ' HB3' ' HB3' ' B' ' 68' ' ' ARG . 13.5 t -144.99 125.08 13.61 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.172 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.27 -31.79 72.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.111 0.482 . . . . 10.0 109.909 179.253 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 40.7 mmm -70.86 -44.52 66.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.691 -0.686 . . . . 10.0 109.599 179.186 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.554 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 47.9 ttt85 -63.27 -44.86 93.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.71 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.446 ' O ' ' HB2' ' B' ' 73' ' ' ARG . 0.1 OUTLIER -59.25 -20.84 57.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.677 -0.692 . . . . 10.0 111.593 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.93 -47.92 6.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.114 179.267 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 71' ' ' TYR . . . . . 0.554 ' CE2' ' HA ' ' B' ' 68' ' ' ARG 0.253 0.5 OUTLIER -66.01 -28.52 68.94 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 113.121 0.786 . . . . 10.0 113.121 -178.968 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 2.7 mtp -91.82 4.07 53.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.185 0.517 . . . . 10.0 110.609 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 73' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' B' ' 69' ' ' ASP . 11.7 ttm180 -98.33 -28.35 13.7 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.135 0.493 . . . . 10.0 110.402 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.6 -5.7 53.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.615 -0.72 . . . . 10.0 112.119 -179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 75' ' ' GLY . . . . . 0.419 ' HA2' ' HB3' ' B' ' 5' ' ' LYS . . . -83.15 144.16 22.46 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.552 -0.832 . . . . 10.0 112.701 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -96.68 -49.28 5.16 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.033 0.444 . . . . 10.0 110.005 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -112.19 139.61 15.73 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 111.203 -0.759 . . . . 10.0 111.203 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.403 ' O ' ' HA ' ' B' ' 111' ' ' MET . 62.2 m-85 -121.25 123.58 42.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.166 0.507 . . . . 10.0 111.999 -179.079 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.921 ' HG ' HD22 ' B' ' 159' ' ' LEU . 45.0 mt -95.4 108.72 20.94 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.107 179.325 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 11.4 m -84.58 88.93 7.36 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.991 -0.374 . . . . 10.0 109.991 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.497 HG22 ' HB ' ' B' ' 114' ' ' VAL . 43.7 t -90.52 127.72 42.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.78 -178.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.7 ' HB3' HD11 ' B' ' 93' ' ' ILE . 29.2 p90 -132.78 159.38 39.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.108 178.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.409 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -96.04 119.86 35.29 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.993 -0.373 . . . . 10.0 109.993 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 84' ' ' ILE . . . . . 0.737 HD11 ' HA ' ' B' ' 118' ' ' CYS . 13.1 pt -69.6 -5.45 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 112.231 0.456 . . . . 10.0 112.231 -179.292 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 85' ' ' ASN . . . . . 0.409 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 4.4 p-10 -94.33 -1.8 53.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.984 0.421 . . . . 10.0 110.949 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -138.86 112.34 8.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.244 -0.434 . . . . 10.0 110.693 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 87' ' ' THR . . . . . 0.456 ' O ' ' HG3' ' B' ' 91' ' ' GLU . 0.2 OUTLIER -60.18 -33.73 72.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.024 -0.535 . . . . 10.0 111.939 -179.519 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 38.6 tptt -62.07 -34.56 76.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.108 0.48 . . . . 10.0 110.368 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 31.8 t -67.27 -30.21 70.03 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.091 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 90' ' ' PHE . . . . . 0.418 ' CE1' ' HA ' ' B' ' 130' ' ' ALA . 68.6 t80 -80.72 -38.6 28.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.372 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 91' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' B' ' 87' ' ' THR . 40.5 mt-10 -72.02 -23.26 61.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.833 -179.544 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 92' ' ' ASP . . . . . 0.456 ' O ' ' HB3' ' B' ' 95' ' ' HIS . 0.4 OUTLIER -81.43 -3.57 53.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.525 -0.307 . . . . 10.0 111.549 -179.749 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 93' ' ' ILE . . . . . 0.7 HD11 ' HB3' ' B' ' 82' ' ' PHE . 22.4 mm -61.48 -39.73 83.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.278 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 28.9 t60 -64.16 -33.57 76.1 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 95' ' ' HIS . . . . . 0.456 ' HB3' ' O ' ' B' ' 92' ' ' ASP . 5.1 t-160 -60.95 -39.91 91.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.443 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 96' ' ' TYR . . . . . 0.537 ' CE1' ' HB ' ' B' ' 9' ' ' VAL . 1.9 m-85 -74.66 -39.84 61.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.654 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -56.2 -44.57 79.58 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.185 -0.462 . . . . 10.0 110.359 179.236 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -66.34 -40.27 89.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.883 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -64.81 -47.9 76.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.482 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 58.6 mt -62.89 -44.71 99.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.883 0.373 . . . . 10.0 110.25 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 101' ' ' LYS . . . . . 0.815 ' HD2' ' HG3' ' B' ' 107' ' ' GLU . 13.1 tttp -59.37 -37.84 78.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.302 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 65.4 ttp85 -67.5 -47.21 70.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.779 -0.646 . . . . 10.0 112.109 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 34.1 m -71.35 -25.85 25.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 112.672 0.619 . . . . 10.0 112.672 -178.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -95.14 -10.28 31.07 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 25.8 t0 58.79 22.88 10.59 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.486 0.66 . . . . 10.0 111.309 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 4.6 m -144.47 151.88 39.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.85 -0.613 . . . . 10.0 110.647 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 107' ' ' GLU . . . . . 0.815 ' HG3' ' HD2' ' B' ' 101' ' ' LYS . 3.7 mp0 -92.76 -38.49 11.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.147 0.498 . . . . 10.0 110.895 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -81.43 62.54 5.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.459 0.647 . . . . 10.0 112.382 -178.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.413 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 49.1 t -101.46 132.92 21.22 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.74 -0.664 . . . . 10.0 109.243 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 110' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 49.4 Cg_exo -57.11 104.7 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.94 2.426 . . . . 10.0 112.382 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 111' ' ' MET . . . . . 0.403 ' HA ' ' O ' ' B' ' 78' ' ' PHE . 43.2 mtt -130.88 143.63 50.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.881 -0.599 . . . . 10.0 109.695 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 112' ' ' VAL . . . . . 0.561 ' HB ' HD23 ' B' ' 79' ' ' LEU . 92.4 t -128.29 127.67 67.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.612 -0.514 . . . . 10.0 109.612 179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 18.9 tp -81.0 120.91 25.38 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 114' ' ' VAL . . . . . 0.497 ' HB ' HG22 ' B' ' 81' ' ' VAL . 40.3 t -118.52 117.66 55.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.904 0.383 . . . . 10.0 111.426 -178.671 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.71 99.59 2.1 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 110.237 -1.145 . . . . 10.0 110.237 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -88.9 163.71 15.49 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.889 0.329 . . . . 10.0 111.889 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 30.4 mtpt 70.83 38.87 1.12 Allowed 'General case' 0 C--O 1.231 0.096 0 CA-C-N 115.257 -0.883 . . . . 10.0 112.258 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 118' ' ' CYS . . . . . 0.737 ' HA ' HD11 ' B' ' 84' ' ' ILE . 28.2 p -76.21 2.0 14.37 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.077 -0.511 . . . . 10.0 111.441 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -95.18 -4.58 45.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.458 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 46.7 mt -80.89 139.21 49.87 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.846 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -68.72 -27.81 31.39 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.757 2.305 . . . . 10.0 112.583 -179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 2.1 m -85.07 59.01 5.36 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.388 0.514 . . . . 10.0 112.388 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 123' ' ' ARG . . . . . 0.664 ' HG3' HD12 ' B' ' 84' ' ' ILE . 36.7 ttm-85 -72.11 100.62 2.57 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.217 -0.66 . . . . 10.0 109.217 178.697 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.7 m -88.75 -31.54 18.36 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.618 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 25.0 t -102.08 117.59 47.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.051 179.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -79.35 151.34 31.06 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.366 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 127' ' ' THR . . . . . 0.493 HG23 ' HE2' ' B' ' 141' ' ' PHE . 6.7 m -56.84 -37.12 70.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.416 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -64.29 -42.24 96.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.86 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -62.04 -47.75 83.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.202 0.525 . . . . 10.0 110.305 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 130' ' ' ALA . . . . . 0.418 ' HA ' ' CE1' ' B' ' 90' ' ' PHE . . . -62.98 -44.49 95.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.653 -0.703 . . . . 10.0 111.269 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.531 ' HG3' ' HD2' ' B' ' 141' ' ' PHE . 31.5 mt-30 -68.15 -33.1 73.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.539 -0.3 . . . . 10.0 111.427 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.94 -43.0 99.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.392 0.615 . . . . 10.0 109.852 178.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 14.5 tp -67.21 -46.76 72.89 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.476 -0.784 . . . . 10.0 110.014 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.51 -43.06 99.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.833 -0.621 . . . . 10.0 110.844 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -60.59 -34.14 73.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.947 -0.569 . . . . 10.0 110.8 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 20.7 m -73.14 -27.13 61.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.47 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -90.41 -14.52 32.76 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.131 0.491 . . . . 10.0 110.957 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 79.97 32.33 36.49 Favored Glycine 0 N--CA 1.446 -0.661 0 N-CA-C 111.351 -0.699 . . . . 10.0 111.351 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 45.8 pt -127.38 153.98 77.2 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 110.164 -0.31 . . . . 10.0 110.164 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -79.49 157.26 25.33 Favored 'Trans proline' 0 CA--C 1.531 0.351 0 C-N-CA 122.593 2.195 . . . . 10.0 112.408 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.531 ' HD2' ' HG3' ' B' ' 131' ' ' GLN . 36.4 t80 -127.27 126.72 43.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.373 179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 34.4 mm -121.19 124.69 72.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.317 -0.402 . . . . 10.0 110.164 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -86.63 125.44 33.84 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 107.525 -1.287 . . . . 10.0 107.525 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 144' ' ' THR . . . . . 0.449 HG22 ' HA3' ' B' ' 151' ' ' GLY . 71.5 p -134.96 173.82 11.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.51 0.93 . . . . 10.0 113.51 -176.672 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 13.3 t -155.97 108.39 2.62 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.347 -1.297 . . . . 10.0 108.054 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -61.85 -27.07 68.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.275 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -68.69 -41.69 78.82 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.457 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 27.3 p -98.57 -4.83 33.24 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.869 0.322 . . . . 10.0 111.869 -178.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 149' ' ' ARG . . . . . 0.644 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 26.5 ttt-85 66.33 14.37 9.65 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.904 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -75.11 116.72 16.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.563 -178.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 151' ' ' GLY . . . . . 0.449 ' HA3' HG22 ' B' ' 144' ' ' THR . . . 82.53 5.29 89.64 Favored Glycine 0 N--CA 1.452 -0.299 0 N-CA-C 114.517 0.567 . . . . 10.0 114.517 177.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 67.8 t -58.83 -50.71 78.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 117.187 0.494 . . . . 10.0 111.713 -179.451 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -69.71 -42.33 74.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.789 0.328 . . . . 10.0 110.362 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.52 -45.48 69.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.726 -0.67 . . . . 10.0 112.235 -178.805 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.84 -50.58 73.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.833 0.349 . . . . 10.0 111.652 -179.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -67.48 -42.49 82.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.264 -0.426 . . . . 10.0 111.609 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -61.99 -40.25 94.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.845 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 46.9 m -66.61 -36.39 82.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.615 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.921 HD22 ' HG ' ' B' ' 79' ' ' LEU . 32.8 tp -60.46 -48.56 81.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.353 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 160' ' ' VAL . . . . . 0.426 ' HA ' HD12 ' B' ' 163' ' ' ILE . 46.6 t -62.55 -35.83 72.03 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.153 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 22.7 ttm-85 -63.77 -45.32 90.33 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.609 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -63.09 -39.33 94.4 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.997 0.427 . . . . 10.0 110.343 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 163' ' ' ILE . . . . . 0.452 HG13 ' O ' ' B' ' 159' ' ' LEU . 85.9 mt -61.21 -49.32 85.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.172 179.295 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -62.51 -46.67 87.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.895 -0.593 . . . . 10.0 111.957 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -59.12 -43.58 91.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.976 0.417 . . . . 10.0 110.937 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 48.5 t-80 -63.92 -40.92 97.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.704 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -66.14 -43.36 87.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.372 -0.376 . . . . 10.0 111.031 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -62.48 -37.3 85.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.034 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 41.4 tttp -65.73 -35.11 79.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.055 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 80.1 mtp -64.81 -23.82 67.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.183 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 1.9 m . . . . . 0 C--N 1.331 -0.234 0 CA-C-O 121.376 0.608 . . . . 10.0 109.88 179.127 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.506 0 N-CA-C 112.291 -0.323 . . . . 10.0 112.291 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' D' D ' 809' ' ' THR . . . . . 0.823 HG21 HD11 ' B' ' 36' ' ' ILE . 1.5 p -132.91 164.82 26.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.461 0.172 . . . . 10.0 110.593 -179.707 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 810' ' ' VAL . . . . . 0.606 HG23 HG22 ' D' ' 824' ' ' VAL . 91.5 t -118.64 123.23 71.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 120.756 0.312 . . . . 10.0 110.488 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 811' ' ' LYS . . . . . 0.737 ' HE3' ' HG3' ' D' ' 819' ' ' ARG . 72.5 tttt -87.95 107.88 18.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.278 -0.419 . . . . 10.0 109.883 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 43.5 t -94.9 129.33 45.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.477 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -96.3 136.24 37.04 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.61 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 58.4 mt -107.32 153.23 41.3 Favored Pre-proline 0 C--N 1.319 -0.73 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.155 -178.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 815' ' ' PRO . . . . . 0.747 ' HD3' ' HB ' ' D' ' 877' ' ' VAL . 72.4 Cg_endo -74.82 56.64 4.2 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.929 2.419 . . . . 10.0 111.111 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 816' ' ' ASN . . . . . 0.411 HD22 ' HA ' ' D' ' 816' ' ' ASN . 0.2 OUTLIER -157.2 32.6 0.29 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.227 -0.897 . . . . 10.0 109.998 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D ' 817' ' ' LYS . . . . . 0.459 ' HD3' ' NH1' ' B' ' 41' ' ' ARG . 9.8 ttpt 58.29 28.31 16.49 Favored 'General case' 0 CA--C 1.529 0.163 0 O-C-N 123.788 0.68 . . . . 10.0 110.311 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 818' ' ' GLN . . . . . 0.408 ' NE2' ' HB2' ' B' ' 39' ' ' SER . 79.3 mt-30 -138.44 -177.58 4.91 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 114.421 1.267 . . . . 10.0 114.421 -177.531 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 819' ' ' ARG . . . . . 0.737 ' HG3' ' HE3' ' D' ' 811' ' ' LYS . 0.0 OUTLIER -151.88 171.11 18.28 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.01 -0.996 . . . . 10.0 112.01 -177.634 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 14.6 t -152.22 138.81 18.69 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 107.449 -1.315 . . . . 10.0 107.449 178.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 821' ' ' VAL . . . . . 0.555 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 4.0 t -104.53 114.2 43.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 120.059 -0.656 . . . . 10.0 111.553 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 35.2 m -103.31 162.38 4.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.761 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 5.2 m -96.23 140.4 30.97 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.532 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 824' ' ' VAL . . . . . 0.606 HG22 HG23 ' D' ' 810' ' ' VAL . 6.4 t -68.17 121.65 17.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 110.132 -0.322 . . . . 10.0 110.132 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -126.34 113.01 16.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.451 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -67.27 145.55 55.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.285 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 90.29 -38.99 3.14 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.827 -0.701 . . . . 10.0 112.08 -179.467 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 57.6 ttm -68.39 144.82 54.6 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.651 0.262 . . . . 10.0 110.702 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 829' ' ' SER . . . . . 0.667 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.0 OUTLIER -99.77 162.8 12.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.556 -0.293 . . . . 10.0 111.279 -179.838 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D ' 830' ' ' VAL . . . . . 0.509 ' O ' ' HB2' ' D' ' 834' ' ' LEU . 86.0 t -55.17 -41.51 60.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.186 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 831' ' ' TYR . . . . . 0.488 ' O ' ' HB2' ' D' ' 835' ' ' ASP . 67.5 t80 -56.35 -32.99 65.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.941 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -75.87 -57.49 3.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.502 -0.317 . . . . 10.0 111.634 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.44 -42.72 99.66 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.688 -179.106 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 834' ' ' LEU . . . . . 0.548 ' HG ' HG21 ' D' ' 850' ' ' VAL . 2.2 mm? -74.24 -17.78 60.83 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 113.089 0.774 . . . . 10.0 113.089 -179.113 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 835' ' ' ASP . . . . . 0.488 ' HB2' ' O ' ' D' ' 831' ' ' TYR . 28.0 t70 -61.71 -50.12 73.73 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.641 -0.424 . . . . 10.0 109.973 179.45 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 35.4 tttt -68.46 -26.96 65.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.648 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 837' ' ' ALA . . . . . 0.435 ' HB3' HD13 ' D' ' 834' ' ' LEU . . . -77.22 -22.27 52.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.07 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 838' ' ' LEU . . . . . 0.65 HD21 HG11 ' D' ' 877' ' ' VAL . 37.3 mt -94.52 -43.85 8.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.044 0.449 . . . . 10.0 110.452 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -63.91 -18.39 64.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.857 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 840' ' ' VAL . . . . . 0.659 HG22 ' CE2' ' B' ' 40' ' ' TYR . 3.2 p -52.69 -22.96 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 O-C-N 123.801 0.688 . . . . 10.0 112.321 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 15.9 ptp180 -139.15 17.09 2.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.01 0.433 . . . . 10.0 111.809 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 82.05 35.89 19.95 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.955 -0.641 . . . . 10.0 114.592 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 98.7 mt -99.78 149.64 23.15 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 117.427 0.614 . . . . 10.0 110.326 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -119.53 148.55 43.16 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.04 0.448 . . . . 10.0 111.661 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -67.29 -9.1 37.43 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.454 -0.794 . . . . 10.0 112.835 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -94.87 -2.55 50.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.026 0.441 . . . . 10.0 111.901 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 91.3 m -129.17 5.16 5.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.237 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 67.5 m -142.84 147.83 36.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.697 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 12.8 p -130.01 151.05 35.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 850' ' ' VAL . . . . . 0.548 HG21 ' HG ' ' D' ' 834' ' ' LEU . 17.4 t -108.07 134.06 51.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.059 0.456 . . . . 10.0 111.764 -179.213 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 851' ' ' TYR . . . . . 0.777 ' HE1' ' HB3' ' D' ' 878' ' ' GLU . 91.8 m-85 -109.22 141.97 40.72 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.816 -0.629 . . . . 10.0 109.721 178.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 852' ' ' ARG . . . . . 0.719 ' HD2' HD11 ' D' ' 870' ' ' LEU . 31.7 mtm-85 -98.67 135.12 40.63 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.968 -0.752 . . . . 10.0 108.968 178.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 853' ' ' LEU . . . . . 0.428 ' HG ' HD11 ' D' ' 876' ' ' ILE . 1.7 mt -82.25 81.39 8.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.92 0.39 . . . . 10.0 111.702 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 37.7 mt -88.08 87.78 2.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.549 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 855' ' ' LYS . . . . . 0.464 ' HA ' ' HD3' ' D' ' 855' ' ' LYS . 23.0 mmtt 50.83 55.89 8.84 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.438 0.903 . . . . 10.0 113.438 179.288 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 86.53 -0.77 87.05 Favored Glycine 0 CA--C 1.518 0.255 0 C-N-CA 120.84 -0.695 . . . . 10.0 114.116 178.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 857' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' D' ' 857' ' ' ARG . 29.6 mmt180 -115.11 135.76 53.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 117.406 0.603 . . . . 10.0 111.011 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 858' ' ' LYS . . . . . 0.735 ' HE2' HD13 ' D' ' 876' ' ' ILE . 94.5 mttt -92.92 99.69 12.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.528 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 4.5 m -98.34 134.0 41.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.702 -0.226 . . . . 10.0 110.744 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 43.0 t -66.19 130.5 31.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.643 0.258 . . . . 10.0 110.845 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 861' ' ' THR . . . . . 0.41 ' HB ' ' HG3' ' D' ' 852' ' ' ARG . 1.8 t -108.12 153.05 23.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.857 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 862' ' ' ALA . . . . . 0.463 ' HB3' ' OG1' ' D' ' 865' ' ' THR . . . -88.53 149.84 23.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.155 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 863' ' ' TRP . . . . . 0.505 ' HZ3' ' HB3' ' D' ' 834' ' ' LEU . 99.8 m95 -73.5 -30.06 62.89 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.655 0.613 . . . . 10.0 112.655 -179.091 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -80.3 -10.65 59.76 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.821 0.675 . . . . 10.0 112.821 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 865' ' ' THR . . . . . 0.463 ' OG1' ' HB3' ' D' ' 862' ' ' ALA . 5.3 m -67.89 143.79 55.55 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.15 -0.315 . . . . 10.0 110.15 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 866' ' ' ALA . . . . . 0.667 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -74.93 149.56 39.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.74 0.305 . . . . 10.0 110.684 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 867' ' ' ILE . . . . . 0.441 ' HA ' HD23 ' D' ' 870' ' ' LEU . 7.9 tp -88.16 2.62 5.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.615 0.721 . . . . 10.0 110.498 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -63.53 -51.54 66.18 Favored Pre-proline 0 CA--C 1.539 0.543 0 N-CA-C 113.162 0.801 . . . . 10.0 113.162 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -76.53 14.44 1.21 Allowed 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.162 1.908 . . . . 10.0 112.961 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 870' ' ' LEU . . . . . 0.719 HD11 ' HD2' ' D' ' 852' ' ' ARG . 3.9 mm? -98.18 33.0 2.28 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.368 0.604 . . . . 10.0 110.761 179.922 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -72.41 116.55 13.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.809 -0.632 . . . . 10.0 111.2 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 73.52 32.0 60.18 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 121.039 -0.6 . . . . 10.0 112.5 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -119.89 152.85 36.72 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.19 -0.3 . . . . 10.0 110.19 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -108.69 135.18 50.36 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.007 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 77.3 mt -113.55 127.47 56.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.55 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 876' ' ' ILE . . . . . 0.735 HD13 ' HE2' ' D' ' 858' ' ' LYS . 6.3 mt -118.4 117.63 55.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.107 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 877' ' ' VAL . . . . . 0.747 ' HB ' ' HD3' ' D' ' 815' ' ' PRO . 12.9 t -87.89 137.69 20.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 109.96 -0.385 . . . . 10.0 109.96 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 878' ' ' GLU . . . . . 0.777 ' HB3' ' HE1' ' D' ' 851' ' ' TYR . 37.5 tt0 -135.0 154.98 51.54 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.371 -0.603 . . . . 10.0 109.371 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 10.3 m -80.56 153.58 4.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 116.537 -0.302 . . . . 10.0 110.291 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 50.8 mt . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.365 -0.826 . . . . 10.0 110.863 -179.85 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 239' ' ' LEU . . . . . 0.593 ' O ' ' HB2' ' A' ' 243' ' ' MET . 85.5 mt . . . . . 0 C--O 1.219 -0.524 0 CA-C-O 120.39 0.138 . . . . 10.0 111.172 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 29.8 mtm180 -70.65 -42.0 71.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.995 0.426 . . . . 10.0 110.818 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -71.04 -32.93 69.8 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.459 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 242' ' ' GLU . . . . . 0.811 ' HB3' HH21 ' C' ' 532' ' ' ARG . 20.2 mt-10 -80.64 -41.98 22.93 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.712 -0.677 . . . . 10.0 111.011 179.182 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 243' ' ' MET . . . . . 0.593 ' HB2' ' O ' ' A' ' 239' ' ' LEU . 1.6 mmm -63.24 -33.49 75.61 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.62 0.248 . . . . 10.0 111.176 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.8 p -65.36 -41.53 93.75 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.106 -0.701 . . . . 10.0 109.106 178.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -71.44 -43.96 65.72 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.7 -0.852 . . . . 10.0 108.7 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 246' ' ' ASP . . . . . 0.483 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.2 OUTLIER -53.77 -57.69 9.95 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.419 -0.81 . . . . 10.0 109.564 178.926 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 47.1 mt -60.33 -44.74 95.21 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.738 -0.665 . . . . 10.0 111.459 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -59.78 -52.32 65.97 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.475 0.178 . . . . 10.0 111.319 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -63.1 -45.66 91.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.365 -0.38 . . . . 10.0 110.389 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 250' ' ' VAL . . . . . 0.705 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 36.1 t -61.92 -44.33 98.73 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.399 0 CA-C-N 116.447 -0.342 . . . . 10.0 111.455 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 251' ' ' LYS . . . . . 0.451 ' O ' HG12 ' A' ' 254' ' ' VAL . 95.7 mttt -70.54 -48.02 57.52 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.811 0.3 . . . . 10.0 111.811 -179.522 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -60.52 -40.61 92.06 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.913 0.387 . . . . 10.0 110.829 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt -82.55 -22.33 34.99 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.156 -0.474 . . . . 10.0 111.719 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.705 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -64.91 -26.08 39.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 C-N-CA 121.152 -0.219 . . . . 10.0 110.842 179.904 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 255' ' ' GLN . . . . . 0.506 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 71.2 mt-30 -63.08 -61.62 7.06 Favored Pre-proline 0 CA--C 1.531 0.225 0 CA-C-N 116.257 -0.429 . . . . 10.0 109.865 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 256' ' ' PRO . . . . . 0.506 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 18.7 Cg_endo -62.32 -30.56 81.15 Favored 'Trans proline' 0 C--N 1.359 1.092 0 C-N-CA 121.778 1.652 . . . . 10.0 110.96 177.517 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 257' ' ' TYR . . . . . 0.422 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 6.8 m-30 -61.74 -54.21 45.62 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.225 0.536 . . . . 10.0 109.7 178.644 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 79.6 mt -67.95 -46.32 71.75 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 115.397 -0.82 . . . . 10.0 111.207 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -60.18 -39.77 87.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.822 0.344 . . . . 10.0 111.766 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -62.07 -50.63 71.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.112 0.482 . . . . 10.0 110.021 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 261' ' ' PHE . . . . . 0.405 ' O ' ' HB2' ' A' ' 265' ' ' TRP . 14.3 m-85 -69.71 -30.38 68.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.819 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -66.15 -48.08 71.95 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.582 179.061 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 11.4 mtmt -59.21 -43.08 92.28 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.206 -0.665 . . . . 10.0 109.206 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.436 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 16.6 mttt -65.64 -46.39 79.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.234 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 265' ' ' TRP . . . . . 0.405 ' HB2' ' O ' ' A' ' 261' ' ' PHE . 0.0 OUTLIER -60.73 -34.61 74.66 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.535 -0.302 . . . . 10.0 110.404 179.386 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -65.17 -49.3 70.35 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.058 -0.719 . . . . 10.0 109.058 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -61.7 -41.77 98.03 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 268' ' ' GLU . . . . . 0.518 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 41.3 mt-10 -61.68 -46.63 88.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.767 179.405 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 5.6 mmt -65.05 -43.87 90.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.652 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 270' ' ' GLU . . . . . 0.521 ' O ' ' HB2' ' A' ' 274' ' ' GLN . 79.8 mt-10 -62.01 -48.6 79.59 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.738 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 66.3 mt -66.61 -35.1 79.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.667 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 272' ' ' TYR . . . . . 0.518 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 2.2 t80 -63.43 -52.34 61.9 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.712 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 273' ' ' ARG . . . . . 0.423 ' HA ' ' HB ' ' A' ' 276' ' ' VAL . 46.6 mtt180 -63.12 -39.52 94.94 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 274' ' ' GLN . . . . . 0.521 ' HB2' ' O ' ' A' ' 270' ' ' GLU . 3.1 tt0 -56.55 -32.93 65.64 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.472 -0.786 . . . . 10.0 110.096 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.615 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 59.0 mttp -90.0 -35.23 15.64 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.478 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 276' ' ' VAL . . . . . 0.423 ' HB ' ' HA ' ' A' ' 273' ' ' ARG . 7.6 t -54.45 -40.5 49.49 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.168 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 277' ' ' GLU . . . . . 0.494 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 35.5 mt-10 -57.58 -63.29 3.95 Favored Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 111.966 0.358 . . . . 10.0 111.966 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 278' ' ' PRO . . . . . 0.554 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 23.6 Cg_endo -63.42 -37.23 50.46 Favored 'Trans proline' 0 C--N 1.357 1.018 0 C-N-CA 121.956 1.77 . . . . 10.0 111.798 178.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.689 HD22 ' HG2' ' C' ' 495' ' ' LYS . 29.4 mt -65.69 -36.55 83.97 Favored 'General case' 0 C--N 1.334 -0.088 0 C-N-CA 121.052 -0.259 . . . . 10.0 110.676 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -71.53 -34.67 70.26 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.124 -1.065 . . . . 10.0 108.124 178.039 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -63.83 -41.91 97.75 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.38 -0.97 . . . . 10.0 108.38 177.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 282' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 35.5 mt-10 -61.22 -46.19 91.45 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.064 -0.717 . . . . 10.0 109.064 177.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 97.0 mt -60.9 -43.62 98.26 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.163 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -63.03 -53.49 52.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.172 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -57.95 -51.12 70.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.287 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -60.53 -46.4 94.47 Favored Glycine 0 N--CA 1.443 -0.837 0 CA-C-N 115.604 -0.726 . . . . 10.0 112.248 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.96 -38.76 89.73 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.644 0.222 . . . . 10.0 110.573 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 288' ' ' ARG . . . . . 0.685 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 88.0 mtt180 -59.25 -42.97 92.35 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 178.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 289' ' ' GLN . . . . . 0.448 ' O ' ' HG2' ' A' ' 293' ' ' GLU . 38.9 mt-30 -71.87 -55.6 7.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.614 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 290' ' ' LYS . . . . . 0.511 ' HE3' ' OE1' ' C' ' 487' ' ' GLN . 34.4 mttt -54.87 -46.6 74.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.922 -0.581 . . . . 10.0 111.957 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 291' ' ' LEU . . . . . 0.671 HD23 HD12 ' A' ' 294' ' ' LEU . 78.4 mt -70.8 -32.37 69.43 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 121.259 -0.176 . . . . 10.0 111.023 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 292' ' ' HIS . . . . . 0.685 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 0.3 OUTLIER -65.25 -41.51 94.23 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.82 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 293' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 289' ' ' GLN . 21.5 mm-40 -64.44 -35.15 79.99 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.852 -0.796 . . . . 10.0 108.852 178.38 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 294' ' ' LEU . . . . . 0.671 HD12 HD23 ' A' ' 291' ' ' LEU . 79.2 mt -68.43 -38.54 81.3 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.585 -0.734 . . . . 10.0 109.923 178.572 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -63.18 -37.75 88.47 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.217 -0.661 . . . . 10.0 109.217 178.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -72.23 5.65 2.7 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.094 -0.957 . . . . 10.0 111.117 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 297' ' ' LYS . . . . . 0.52 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 39.9 mttp -125.02 -36.55 2.53 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.254 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 298' ' ' LEU . . . . . 0.441 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 76.8 mt -60.53 -41.81 95.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.399 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 299' ' ' SER . . . . . 0.824 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 19.5 m -81.38 -64.38 0.28 Allowed Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 300' ' ' PRO . . . . . 0.824 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 53.5 Cg_exo -55.7 -58.35 1.15 Allowed 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 122.306 2.004 . . . . 10.0 112.853 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.52 ' HB2' ' O ' ' A' ' 297' ' ' LYS . 81.3 mt -67.36 -31.16 71.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.699 0.285 . . . . 10.0 110.673 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 302' ' ' GLY . . . . . 0.441 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -65.95 -44.7 91.21 Favored Glycine 0 N--CA 1.449 -0.479 0 N-CA-C 111.334 -0.706 . . . . 10.0 111.334 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -60.63 -37.79 82.63 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 304' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 300' ' ' PRO . 93.7 mt-10 -64.25 -44.9 90.35 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 178.281 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 5.6 tpt -62.96 -42.97 99.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.222 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 306' ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 94.6 mtt180 -64.56 -38.13 89.94 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 109.122 -0.696 . . . . 10.0 109.122 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 307' ' ' ASP . . . . . 0.57 ' HA ' ' CD ' ' A' ' 310' ' ' ARG . 33.2 t70 -66.56 -43.66 84.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.196 179.285 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 308' ' ' ARG . . . . . 0.802 ' HG3' HD11 ' C' ' 469' ' ' LEU . 11.3 mmt180 -68.76 -26.75 65.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.736 -0.665 . . . . 10.0 109.361 178.529 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 309' ' ' ALA . . . . . 0.551 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -69.97 -32.0 70.0 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 177.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 310' ' ' ARG . . . . . 0.57 ' CD ' ' HA ' ' A' ' 307' ' ' ASP . 15.6 mtp180 -62.89 -46.4 88.0 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 107.906 -1.146 . . . . 10.0 107.906 178.043 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -66.85 -41.11 87.91 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.434 -0.803 . . . . 10.0 109.633 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 312' ' ' HIS . . . . . 0.558 ' HA ' ' HD3' ' C' ' 462' ' ' LYS . 0.7 OUTLIER -56.14 -49.1 74.9 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.123 178.984 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 97.2 t -73.91 -39.76 52.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 115.762 -0.653 . . . . 10.0 111.419 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 314' ' ' ASP . . . . . 0.428 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 0.7 OUTLIER -60.87 -42.88 98.76 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.249 0.547 . . . . 10.0 110.232 179.717 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 315' ' ' ALA . . . . . 0.57 ' O ' ' HB2' ' A' ' 319' ' ' HIS . . . -65.1 -33.39 75.91 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.212 178.299 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 40.5 mt -71.15 -37.66 72.23 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.712 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 317' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 81.1 mtt180 -61.02 -53.41 57.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.138 0.494 . . . . 10.0 110.207 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.98 2.69 6.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.337 -0.847 . . . . 10.0 112.245 -179.037 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 319' ' ' HIS . . . . . 0.57 ' HB2' ' O ' ' A' ' 315' ' ' ALA . 0.1 OUTLIER -117.42 -51.64 2.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.65 0.262 . . . . 10.0 110.771 179.793 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 91.5 mt -65.04 -35.82 82.4 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.374 -0.375 . . . . 10.0 111.547 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -57.19 -60.4 9.78 Favored Pre-proline 0 CA--C 1.536 0.432 0 C-N-CA 121.138 -0.225 . . . . 10.0 111.316 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -65.0 -33.36 51.51 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 121.603 1.535 . . . . 10.0 111.214 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -62.25 -50.58 71.17 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-N 116.594 -0.276 . . . . 10.0 110.866 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 324' ' ' SER . . . . . 0.441 ' HA ' HD12 ' A' ' 327' ' ' LEU . 21.1 p -68.8 -34.25 75.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.356 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -66.03 -41.01 91.5 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 326' ' ' GLU . . . . . 0.401 ' CD ' ' HZ1' ' C' ' 451' ' ' LYS . 27.4 mt-10 -68.87 -36.0 77.58 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.315 -0.995 . . . . 10.0 108.315 177.339 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 327' ' ' LEU . . . . . 0.441 HD12 ' HA ' ' A' ' 324' ' ' SER . 29.3 mt -60.72 -35.05 75.36 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 109.302 -0.629 . . . . 10.0 109.302 178.203 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 -63.56 -40.81 97.95 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.941 -0.763 . . . . 10.0 108.941 178.262 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -70.22 -41.98 72.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.027 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 330' ' ' ARG . . . . . 0.469 ' HA ' ' HE3' ' C' ' 443' ' ' LYS . 13.6 mtp180 -63.89 -45.75 87.95 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.8 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 64.6 mt -65.85 -37.56 86.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.1 179.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.9 -46.73 88.09 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -60.83 -44.98 96.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.956 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 20.5 mtt180 -62.86 -47.73 82.1 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.144 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 335' ' ' LEU . . . . . 0.491 ' O ' ' HB2' ' A' ' 339' ' ' LYS . 68.1 mt -64.39 -33.82 76.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 10.0 111.432 -179.576 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -69.81 -44.05 70.81 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.913 -0.403 . . . . 10.0 109.913 178.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.73 -44.33 77.86 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 71.0 mt -66.09 -20.89 66.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.765 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 339' ' ' LYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 335' ' ' LEU . 31.0 tttt -75.58 -49.06 19.71 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 178.722 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -67.59 -39.06 84.83 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 341' ' ' ASN . . . . . 0.515 ' OD1' ' HA ' ' C' ' 433' ' ' GLU . 0.2 OUTLIER -67.22 -42.61 83.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.285 -0.87 . . . . 10.0 108.921 178.41 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -62.16 -42.94 99.73 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.564 -0.744 . . . . 10.0 111.566 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.93 -40.75 97.28 Favored Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 110.445 -1.062 . . . . 10.0 110.445 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -67.78 -42.85 81.02 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 178.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 345' ' ' ARG . . . . . 0.453 ' HE ' ' ND2' ' A' ' 341' ' ' ASN . 23.5 mtt180 -62.86 -43.54 98.54 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.736 179.265 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 13.5 mt -65.02 -46.64 80.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.504 -0.317 . . . . 10.0 110.861 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.02 -43.99 97.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.036 0.446 . . . . 10.0 110.105 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 348' ' ' GLU . . . . . 0.409 ' HB3' ' HE2' ' A' ' 352' ' ' LYS . 17.6 mt-10 -67.09 -47.48 71.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.142 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -62.05 -33.48 74.46 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 121.115 -0.234 . . . . 10.0 110.445 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.22 -40.84 86.46 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.818 -0.808 . . . . 10.0 108.818 178.004 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 351' ' ' ALA . . . . . 0.572 ' O ' ' HG2' ' A' ' 355' ' ' GLU . . . -66.13 -46.16 78.49 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.426 178.492 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 352' ' ' LYS . . . . . 0.409 ' HE2' ' HB3' ' A' ' 348' ' ' GLU . 19.4 mttm -63.3 -29.51 70.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.761 -0.654 . . . . 10.0 109.946 178.777 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.95 -46.37 74.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.988 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.8 -37.17 85.65 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 121.015 0.436 . . . . 10.0 109.891 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 355' ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' ' 351' ' ' ALA . 20.3 mm-40 -67.74 -41.54 83.25 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -60.63 -48.29 82.45 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 108.841 -0.8 . . . . 10.0 108.841 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 84.3 mt -59.62 -37.81 79.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.986 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 53.9 m -61.87 -56.78 15.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.231 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 17.8 m -63.17 -35.35 79.99 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.41 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 19.7 mt -65.89 -36.4 83.31 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.453 -0.34 . . . . 10.0 110.24 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 70.2 m -65.76 -31.53 72.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.095 0.474 . . . . 10.0 110.524 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -73.93 -8.16 55.05 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 121.377 0.608 . . . . 10.0 109.928 179.173 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' A' ' 367' ' ' ALA . 44.7 mttm -107.93 -38.31 5.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.104 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.74 -26.01 63.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.564 -0.743 . . . . 10.0 111.897 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.793 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 58.1 mttp -106.46 -74.29 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 112.794 0.664 . . . . 10.0 112.794 179.422 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.793 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 52.2 Cg_exo -56.91 -53.17 5.36 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 122.115 1.876 . . . . 10.0 113.175 -178.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 367' ' ' ALA . . . . . 0.459 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -61.56 -43.77 98.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.674 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 368' ' ' LEU . . . . . 0.485 HD23 ' HA ' ' A' ' 368' ' ' LEU . 6.5 mt -65.57 -36.26 83.26 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.979 -0.288 . . . . 10.0 110.791 179.287 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 369' ' ' GLU . . . . . 0.551 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 19.6 mt-10 -63.36 -41.4 98.84 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.188 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.88 -39.84 94.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.352 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 371' ' ' LEU . . . . . 0.405 HD12 HD23 ' A' ' 368' ' ' LEU . 84.9 mt -65.63 -40.73 92.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.406 178.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -67.28 -40.78 86.17 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.551 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.7 mt-30 -66.2 -26.73 67.53 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.22 -0.9 . . . . 20.0 111.222 178.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -81.67 -40.3 11.03 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 109.261 -1.536 . . . . 10.0 109.261 178.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 14.2 mt -61.55 -31.65 71.69 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.963 0.357 . . . . 10.0 111.963 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 376' ' ' LEU . . . . . 0.478 ' HB2' ' HD3' ' A' ' 377' ' ' PRO . 38.3 mt -54.55 -64.62 1.81 Allowed Pre-proline 0 CA--C 1.537 0.479 0 O-C-N 122.969 0.168 . . . . 10.0 111.027 179.261 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 377' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' A' ' 376' ' ' LEU . 40.9 Cg_endo -69.26 -32.45 20.64 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.866 1.711 . . . . 10.0 111.364 178.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 3.9 t -59.38 -49.11 84.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.721 -0.218 . . . . 10.0 110.453 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 37.1 mt -63.92 -31.82 73.13 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.179 -0.464 . . . . 10.0 109.92 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 380' ' ' GLU . . . . . 0.439 ' O ' HG23 ' A' ' 384' ' ' VAL . 11.8 mt-10 -67.41 -50.91 57.46 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 1.2 p -59.99 -34.86 73.9 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 120.952 0.406 . . . . 10.0 110.06 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 5.9 m-30 -69.71 -44.7 69.84 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 115.892 -0.594 . . . . 10.0 110.043 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -61.81 -42.46 99.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.491 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 384' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 380' ' ' GLU . 74.7 t -59.58 -43.31 90.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.745 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.4 p -75.04 -37.87 61.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.582 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 14.3 m-30 -66.42 -44.21 83.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.691 0.282 . . . . 10.0 110.489 179.264 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.485 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 51.5 mt -59.17 -43.07 92.12 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.549 179.732 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 1.8 p -71.33 -46.63 60.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.229 -0.442 . . . . 10.0 110.769 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -56.66 -41.15 76.74 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.143 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 58.4 mt -59.33 -41.53 89.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.016 0.436 . . . . 10.0 110.378 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 391' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 17.8 mt-10 -71.78 -37.91 70.38 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.78 -46.16 78.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.442 178.831 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -65.59 -44.37 86.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.112 0.482 . . . . 10.0 110.432 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 55.8 m -60.17 -45.14 94.11 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.641 -0.709 . . . . 10.0 111.81 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 30.1 mtmt . . . . . 0 CA--C 1.531 0.228 0 N-CA-C 112.678 0.622 . . . . 10.0 112.678 -178.753 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C ' 401' ' ' LEU . . . . . 0.427 ' HG ' ' CD1' ' C' ' 405' ' ' TRP . 15.6 tp . . . . . 0 C--O 1.228 -0.055 0 N-CA-C 111.802 0.297 . . . . 10.0 111.802 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 92.2 mt -61.32 -44.18 97.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.995 0.426 . . . . 10.0 110.078 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -74.87 -38.51 61.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.748 179.36 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -58.01 -47.0 84.35 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.959 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 405' ' ' TRP . . . . . 0.427 ' CD1' ' HG ' ' C' ' 401' ' ' LEU . 13.0 m95 -59.59 -36.26 75.92 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.478 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -64.42 -46.9 81.21 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 109.483 -0.562 . . . . 10.0 109.483 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.16 -40.65 90.65 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.862 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.05 -37.93 81.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.74 178.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 63.0 m -64.44 -49.5 71.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.238 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 7.3 m -63.74 -25.39 68.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.911 0.386 . . . . 10.0 111.799 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 18.0 p -92.74 -5.36 51.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.829 0.347 . . . . 10.0 111.029 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -98.37 -37.72 9.51 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.92 -0.77 . . . . 10.0 108.92 178.626 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 2.5 p -62.58 -47.32 84.35 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 109.151 -0.685 . . . . 10.0 109.151 178.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 23.3 mttm -63.18 -29.25 70.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.551 -0.749 . . . . 10.0 110.33 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 9.0 mt -66.5 -43.3 85.71 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -69.14 -40.67 78.1 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.628 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 417' ' ' GLU . . . . . 0.587 ' O ' ' HD2' ' C' ' 421' ' ' PRO . 36.9 mt-10 -58.81 -42.8 90.0 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.312 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -43.23 74.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.459 -0.791 . . . . 10.0 109.953 178.839 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 37.7 mt -57.5 -33.14 67.73 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.893 -0.594 . . . . 10.0 112.062 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -53.09 -78.52 0.11 Allowed Glycine 0 CA--C 1.521 0.455 0 C-N-CA 121.34 -0.457 . . . . 10.0 112.079 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 421' ' ' PRO . . . . . 0.61 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 9.9 Cg_endo -53.42 -38.14 82.5 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 122.941 2.427 . . . . 10.0 111.829 178.662 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 16.0 t -58.96 -46.86 91.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-N 116.548 -0.297 . . . . 10.0 111.342 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 27.9 p -72.49 -33.5 66.99 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 120.84 -0.344 . . . . 10.0 110.459 179.321 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -56.51 -54.38 46.5 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.033 0.444 . . . . 10.0 109.825 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 425' ' ' GLU . . . . . 0.61 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 7.2 pt-20 -71.47 -31.31 67.0 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.43 179.194 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -62.6 -39.1 92.66 Favored 'General case' 0 N--CA 1.461 0.114 0 N-CA-C 109.433 -0.58 . . . . 10.0 109.433 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 23.2 m95 -67.95 -35.48 78.46 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.021 -0.733 . . . . 10.0 109.021 178.188 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -67.85 -35.4 78.5 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.454 -0.943 . . . . 10.0 108.454 177.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 429' ' ' ASN . . . . . 0.687 ' HA ' ' HD2' ' C' ' 432' ' ' LYS . 12.5 t-20 -66.5 -39.96 88.97 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.312 -0.996 . . . . 10.0 108.312 177.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.68 -33.47 75.71 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.689 -0.856 . . . . 10.0 108.689 177.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 431' ' ' GLU . . . . . 0.414 ' HA ' ' OG1' ' C' ' 434' ' ' THR . 12.7 mt-10 -70.01 -41.01 74.89 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.193 -0.669 . . . . 10.0 109.193 177.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 432' ' ' LYS . . . . . 0.687 ' HD2' ' HA ' ' C' ' 429' ' ' ASN . 18.0 mttt -61.68 -40.25 94.31 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.325 -0.991 . . . . 10.0 108.325 177.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 433' ' ' GLU . . . . . 0.515 ' HA ' ' OD1' ' A' ' 341' ' ' ASN . 31.1 tt0 -68.51 -48.8 63.45 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.94 -1.027 . . . . 10.0 111.022 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 434' ' ' THR . . . . . 0.51 ' HB ' ' CZ ' ' C' ' 438' ' ' ARG . 3.3 p -64.01 -47.5 80.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.787 -0.188 . . . . 10.0 111.118 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 435' ' ' GLU . . . . . 0.408 ' OE1' ' HD2' ' C' ' 438' ' ' ARG . 6.2 mm-40 -61.23 -41.26 96.57 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 110.448 -0.204 . . . . 10.0 110.448 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -66.3 -47.88 68.13 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.481 -1.048 . . . . 10.0 110.481 178.585 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 20.2 mt -63.89 -28.66 69.99 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 115.734 -0.233 . . . . 10.0 110.603 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 438' ' ' ARG . . . . . 0.51 ' CZ ' ' HB ' ' C' ' 434' ' ' THR . 37.4 mtt180 -67.98 -33.42 74.6 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 178.672 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -72.9 -42.79 63.19 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 108.382 -0.97 . . . . 10.0 108.382 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.48 -55.35 16.02 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.159 -0.928 . . . . 10.0 110.957 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 69.5 mmm -58.18 -41.5 84.04 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 113.57 0.952 . . . . 10.0 113.57 -178.132 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 10.9 p -61.14 -52.54 64.45 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.513 -0.475 . . . . 10.0 109.934 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 443' ' ' LYS . . . . . 0.469 ' HE3' ' HA ' ' A' ' 330' ' ' ARG . 0.6 OUTLIER -62.99 -41.44 99.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.594 -0.73 . . . . 10.0 109.869 179.069 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 444' ' ' ASP . . . . . 0.507 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 5.0 t70 -60.08 -50.81 72.23 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.393 -0.821 . . . . 10.0 110.29 179.649 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 445' ' ' LEU . . . . . 0.503 ' HA ' HG12 ' C' ' 448' ' ' VAL . 43.5 mt -64.55 -46.29 83.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.941 -0.572 . . . . 10.0 112.153 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -59.5 -47.97 83.44 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.94 -0.304 . . . . 10.0 111.004 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 447' ' ' GLU . . . . . 0.619 ' O ' ' HB2' ' C' ' 451' ' ' LYS . 73.1 mt-10 -74.9 -17.33 60.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.921 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 448' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.5 OUTLIER -86.06 -37.6 11.88 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 C-N-CA 120.899 -0.321 . . . . 10.0 110.715 178.899 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -68.65 -38.35 80.37 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.079 -0.711 . . . . 10.0 109.079 178.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -77.1 -0.87 26.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.526 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 451' ' ' LYS . . . . . 0.621 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 0.0 OUTLIER -107.0 -35.15 6.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.372 -0.831 . . . . 10.0 109.451 179.451 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 452' ' ' VAL . . . . . 0.448 HG23 ' O ' ' C' ' 448' ' ' VAL . 41.8 t -67.31 -37.08 78.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.069 179.165 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 453' ' ' GLN . . . . . 0.411 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 67.0 mt-30 -56.09 -60.19 9.59 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.788 178.845 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 454' ' ' PRO . . . . . 0.411 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 36.6 Cg_endo -68.52 -20.6 41.16 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.572 1.514 . . . . 10.0 111.323 178.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 455' ' ' TYR . . . . . 0.621 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.1 OUTLIER -70.06 -50.75 38.02 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.983 -0.747 . . . . 10.0 108.983 178.749 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 456' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' C' ' 460' ' ' GLN . 57.1 mt -66.45 -39.13 88.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.415 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -62.28 -49.13 76.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.247 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -67.06 -41.41 86.49 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.681 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 459' ' ' PHE . . . . . 0.504 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 0.1 OUTLIER -62.89 -47.64 82.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 10.0 109.939 179.271 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 460' ' ' GLN . . . . . 0.573 ' HA ' ' HB2' ' C' ' 463' ' ' TRP . 0.7 OUTLIER -68.36 -26.04 65.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.326 -0.397 . . . . 10.0 111.177 179.747 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 461' ' ' LYS . . . . . 0.456 ' HB2' ' HE3' ' C' ' 461' ' ' LYS . 20.1 ttmt -67.92 -46.32 71.89 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.121 -1.066 . . . . 10.0 108.121 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 462' ' ' LYS . . . . . 0.558 ' HD3' ' HA ' ' A' ' 312' ' ' HIS . 20.8 mtmm -71.59 -36.64 70.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.108 -0.951 . . . . 10.0 109.781 178.511 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 463' ' ' TRP . . . . . 0.573 ' HB2' ' HA ' ' C' ' 460' ' ' GLN . 1.1 m0 -63.48 -44.0 95.65 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.575 -0.738 . . . . 10.0 109.927 179.05 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -65.7 -40.28 92.13 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 178.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 1.188 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 31.9 tt0 -58.19 -48.37 80.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.489 -0.778 . . . . 10.0 109.697 178.441 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 466' ' ' GLU . . . . . 0.637 ' HA ' HD12 ' C' ' 469' ' ' LEU . 16.4 mt-10 -72.51 -36.49 68.37 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.388 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 3.8 mmt -61.66 -51.77 67.08 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 110.285 -0.265 . . . . 10.0 110.285 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.76 -39.08 93.39 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.618 -0.882 . . . . 10.0 108.618 178.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 1.188 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 96.5 mt -57.7 -50.09 74.34 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.369 -0.832 . . . . 20.0 109.602 178.251 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 18.3 m-30 -60.71 -40.04 90.79 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.132 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -64.51 -31.95 73.38 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.541 -0.299 . . . . 10.0 111.211 179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -92.93 -2.03 56.18 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.988 0.366 . . . . 10.0 111.988 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 53.8 mttm -114.28 -45.66 3.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.898 0.38 . . . . 10.0 111.213 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 88.0 t -69.23 -32.44 53.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.519 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 475' ' ' GLU . . . . . 0.436 ' HB3' ' CD ' ' C' ' 476' ' ' PRO . 35.2 tt0 -59.44 -59.98 12.05 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 121.066 -0.254 . . . . 10.0 110.723 179.089 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 476' ' ' PRO . . . . . 0.436 ' CD ' ' HB3' ' C' ' 475' ' ' GLU . 18.6 Cg_endo -62.0 -31.95 84.18 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 121.589 1.526 . . . . 10.0 110.458 177.826 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 8.0 mt -65.7 -37.89 87.71 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -64.81 -41.57 95.67 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 108.577 -0.897 . . . . 10.0 108.577 178.381 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.57 89.87 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.846 -0.616 . . . . 10.0 109.616 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.18 -41.58 98.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.67 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 22.9 mt -69.26 -30.32 68.42 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.993 -0.548 . . . . 10.0 109.837 178.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -69.64 -60.07 2.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.09 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -62.95 -35.24 79.49 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -66.61 -43.21 92.63 Favored Glycine 0 N--CA 1.446 -0.666 0 N-CA-C 110.949 -0.86 . . . . 10.0 110.949 178.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -70.82 -35.76 72.62 Favored 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 109.308 -0.627 . . . . 10.0 109.308 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 66.1 mtt180 -62.45 -41.48 98.77 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 109.453 -0.573 . . . . 10.0 109.453 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 487' ' ' GLN . . . . . 0.511 ' OE1' ' HE3' ' A' ' 290' ' ' LYS . 1.3 tt0 -66.44 -46.67 75.66 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.809 -0.812 . . . . 10.0 108.809 178.055 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -63.47 -37.63 88.02 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.654 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 489' ' ' LEU . . . . . 0.6 ' O ' ' HG3' ' C' ' 493' ' ' GLN . 37.2 mt -68.46 -43.96 75.9 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 178.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -62.93 -37.6 87.69 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.408 -0.96 . . . . 10.0 108.408 178.154 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 491' ' ' GLU . . . . . 0.61 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 28.9 mt-10 -62.04 -50.24 72.8 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 107.711 -1.218 . . . . 10.0 107.711 176.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 48.2 mt -58.01 -33.14 68.62 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 115.424 -0.807 . . . . 10.0 111.152 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 493' ' ' GLN . . . . . 0.6 ' HG3' ' O ' ' C' ' 489' ' ' LEU . 29.6 mt-30 -65.06 -40.88 95.35 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.936 -0.764 . . . . 10.0 108.936 178.341 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.54 7.61 16.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.291 179.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.689 ' HG2' HD22 ' A' ' 279' ' ' LEU . 16.1 mttm -116.88 -48.74 2.65 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 178.349 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 95.4 mt -71.58 -37.26 71.03 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.65 0.611 . . . . 10.0 112.65 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 4.9 m -65.51 -58.86 10.7 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 112.17 0.433 . . . . 10.0 112.17 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -62.93 -45.65 12.52 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 122.113 1.875 . . . . 10.0 111.621 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 499' ' ' LEU . . . . . 0.579 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 18.7 mt -67.49 -35.01 78.32 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 121.1 -0.24 . . . . 10.0 110.656 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.67 -48.35 62.62 Favored Glycine 0 N--CA 1.451 -0.314 0 N-CA-C 110.317 -1.113 . . . . 10.0 110.317 178.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -61.26 -38.21 85.89 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 502' ' ' GLU . . . . . 0.688 ' HG2' ' HE ' ' C' ' 506' ' ' ARG . 25.7 tt0 -68.29 -45.57 72.71 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.387 -0.824 . . . . 10.0 109.674 178.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 503' ' ' MET . . . . . 0.631 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 78.3 mmm -60.17 -34.43 73.58 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.887 -0.412 . . . . 10.0 109.887 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -66.63 -39.9 88.5 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.56 -0.533 . . . . 10.0 109.56 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -69.01 -42.09 76.91 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.787 -0.82 . . . . 10.0 108.787 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.688 ' HE ' ' HG2' ' C' ' 502' ' ' GLU . 45.0 mtt180 -61.84 -44.7 96.31 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.341 -0.845 . . . . 10.0 108.858 178.504 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.9 -44.77 94.07 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.063 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 508' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' C' ' 508' ' ' ARG . 46.3 mtt85 -62.08 -44.41 96.72 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.537 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -69.15 -19.62 64.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.711 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 8.9 m170 -94.23 -57.81 2.4 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.94 0.4 . . . . 10.0 111.225 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 25.8 t -66.37 -43.36 91.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.985 -0.552 . . . . 10.0 112.375 -178.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.764 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 3.0 t70 -66.17 -33.0 74.77 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 120.194 -0.602 . . . . 10.0 109.919 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.65 -37.5 84.93 Favored 'General case' 0 C--O 1.222 -0.344 0 N-CA-C 107.606 -1.257 . . . . 10.0 107.606 177.363 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 84.6 mt -67.73 -27.93 67.22 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.566 178.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 515' ' ' ARG . . . . . 0.764 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 86.0 mtt180 -70.56 -33.53 71.22 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.564 -0.532 . . . . 10.0 109.564 178.702 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.32 3.78 54.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.817 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 62.7 m170 -119.61 -49.72 2.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.844 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 79.7 mt -77.48 -36.34 52.82 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.46 0.541 . . . . 10.0 112.46 -179.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -57.37 -57.17 26.89 Favored Pre-proline 0 C--N 1.331 -0.211 0 C-N-CA 120.747 -0.381 . . . . 10.0 110.973 179.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -62.96 -34.36 71.33 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.21 1.273 . . . . 10.0 110.166 177.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 521' ' ' TYR . . . . . 0.502 ' HA ' ' OE1' ' C' ' 524' ' ' GLU . 35.2 t80 -61.55 -45.81 92.59 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.767 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 522' ' ' SER . . . . . 0.49 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 12.1 p -63.86 -34.75 78.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.969 0.414 . . . . 10.0 110.392 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 523' ' ' ASP . . . . . 0.424 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 2.6 t0 -70.79 -40.22 72.68 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.455 -0.572 . . . . 10.0 109.455 178.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 524' ' ' GLU . . . . . 0.502 ' OE1' ' HA ' ' C' ' 521' ' ' TYR . 69.0 mt-10 -64.26 -40.3 95.7 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 108.451 -0.944 . . . . 10.0 108.451 178.075 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 35.6 mt -62.89 -38.53 91.27 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 115.3 -0.864 . . . . 10.0 109.655 178.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 526' ' ' ARG . . . . . 0.49 ' HG3' ' O ' ' C' ' 522' ' ' SER . 78.6 mtt180 -58.3 -40.2 81.38 Favored 'General case' 0 C--O 1.226 -0.174 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.322 178.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -64.94 -49.35 70.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.979 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 44.4 mtt180 -64.25 -39.95 95.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.109 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 60.0 mt -70.22 -30.34 67.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.055 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -61.89 -48.09 82.04 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.78 -40.69 92.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.422 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 532' ' ' ARG . . . . . 0.811 HH21 ' HB3' ' A' ' 242' ' ' GLU . 8.5 ttm180 -59.44 -46.76 87.84 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.669 -0.696 . . . . 10.0 109.94 178.76 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 65.1 mt -66.15 -39.77 90.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.813 -0.631 . . . . 10.0 110.125 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -62.57 -39.41 93.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 10.0 109.935 178.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.41 -42.72 92.26 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.669 -0.863 . . . . 10.0 108.669 177.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.5 -24.45 67.14 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.1 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -79.18 -45.63 19.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.843 178.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -63.22 -52.17 63.3 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 54.2 m-20 -68.34 -30.71 69.73 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.569 -0.741 . . . . 10.0 109.519 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 540' ' ' GLY . . . . . 0.483 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -65.79 -51.91 42.61 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.21 -0.756 . . . . 10.0 111.21 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -60.48 -38.25 94.55 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 110.734 -0.947 . . . . 10.0 110.734 178.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -63.42 -54.28 39.04 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.845 -0.798 . . . . 10.0 108.845 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 543' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' C' ' 543' ' ' ARG . 50.0 mtt180 -55.14 -41.76 72.16 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.61 179.098 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 544' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 55.8 mt -56.57 -50.43 71.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.667 0.27 . . . . 10.0 110.808 179.591 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.85 -47.53 68.69 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.023 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -60.72 -44.52 96.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.879 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -69.85 -37.89 76.3 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.015 -0.365 . . . . 10.0 110.015 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.4 m170 -63.5 -46.64 85.15 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.864 -0.421 . . . . 10.0 109.864 179.07 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 549' ' ' ALA . . . . . 0.501 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -63.1 -45.6 91.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.978 -0.556 . . . . 10.0 109.527 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 550' ' ' LYS . . . . . 0.449 ' HA ' ' HD3' ' C' ' 550' ' ' LYS . 0.1 OUTLIER -63.12 -35.57 80.71 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.772 179.304 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -67.57 -36.8 81.63 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.28 -0.637 . . . . 10.0 109.28 178.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 18.1 m -63.06 -48.19 79.71 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 108.174 -1.047 . . . . 10.0 108.174 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 553' ' ' GLU . . . . . 0.501 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 39.8 mt-10 -59.47 -43.49 93.24 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.023 178.41 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 554' ' ' HIS . . . . . 0.504 ' O ' ' HB2' ' C' ' 558' ' ' LEU . 39.6 t-80 -63.87 -31.79 73.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.63 -0.714 . . . . 10.0 111.397 179.54 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 60.4 mt -73.72 -49.02 27.71 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.167 -0.308 . . . . 10.0 110.167 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 5.5 m -62.12 -33.73 75.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.033 0.444 . . . . 10.0 110.629 179.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 33.2 p -83.45 -9.7 58.83 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.107 0.479 . . . . 10.0 110.944 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 558' ' ' LEU . . . . . 0.504 ' HB2' ' O ' ' C' ' 554' ' ' HIS . 0.2 OUTLIER -86.51 -47.75 8.98 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.459 -1.311 . . . . 10.0 107.459 177.806 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 559' ' ' SER . . . . . 0.706 ' HB2' ' HE2' ' C' ' 563' ' ' LYS . 1.7 p -67.83 -23.22 65.14 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.442 -0.947 . . . . 10.0 108.442 177.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -57.92 -25.69 61.22 Favored 'General case' 0 CA--C 1.524 -0.045 0 CA-C-N 114.907 -1.042 . . . . 10.0 109.505 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 561' ' ' LYS . . . . . 0.443 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 47.4 mttp -112.4 -33.94 6.03 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.571 -0.741 . . . . 10.0 110.35 179.306 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 562' ' ' ALA . . . . . 0.612 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -61.16 -11.47 9.12 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.948 0.404 . . . . 10.0 111.896 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 563' ' ' LYS . . . . . 0.706 ' HE2' ' HB2' ' C' ' 559' ' ' SER . 62.9 mttm -98.09 -67.07 0.06 OUTLIER Pre-proline 0 C--N 1.325 -0.496 0 C-N-CA 120.913 -0.315 . . . . 10.0 111.316 178.549 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 564' ' ' PRO . . . . . 0.572 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 55.8 Cg_endo -69.92 -40.92 4.53 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 121.887 1.725 . . . . 10.0 113.467 -179.066 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 565' ' ' ALA . . . . . 0.443 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -68.07 -42.78 79.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.496 0.189 . . . . 10.0 110.702 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 566' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' C' ' 562' ' ' ALA . 8.0 mt -64.01 -39.44 94.11 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.723 -0.391 . . . . 10.0 109.958 178.405 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -68.96 -33.32 73.51 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.855 -0.424 . . . . 10.0 109.855 178.381 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.04 -44.93 91.0 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.341 -0.985 . . . . 10.0 108.341 178.076 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 83.2 mt -67.19 -38.17 84.89 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.131 -0.94 . . . . 10.0 110.356 178.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -64.25 -38.18 90.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.452 0.644 . . . . 10.0 109.605 178.567 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -81.69 -10.31 59.42 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.408 -0.815 . . . . 20.0 111.285 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -92.23 -47.96 3.18 Favored Glycine 0 CA--C 1.521 0.432 0 N-CA-C 108.993 -1.643 . . . . 10.0 108.993 178.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 573' ' ' LEU . . . . . 0.434 ' HA ' ' HB ' ' C' ' 576' ' ' VAL . 75.0 mt -61.54 -25.03 67.03 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.572 -0.314 . . . . 10.0 111.45 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 4.7 mt -60.07 -66.34 1.55 Allowed Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 121.191 -0.204 . . . . 10.0 111.038 178.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.98 -28.73 57.76 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 121.711 1.607 . . . . 10.0 111.094 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 576' ' ' VAL . . . . . 0.434 ' HB ' ' HA ' ' C' ' 573' ' ' LEU . 5.7 t -64.39 -47.07 91.05 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 178.547 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 34.0 mt -67.38 -34.93 78.3 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.919 -0.4 . . . . 10.0 109.919 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -62.9 -47.85 81.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.315 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 4.2 p -71.21 -36.57 71.92 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.917 -0.401 . . . . 10.0 109.917 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.7 -43.65 98.44 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 178.423 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -62.06 -44.99 95.49 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 178.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 50.8 t -59.29 -44.24 91.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.204 0.526 . . . . 10.0 109.624 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 15.2 m -65.98 -45.18 82.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.706 -0.679 . . . . 10.0 111.05 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -69.68 -40.91 76.09 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.375 0.509 . . . . 10.0 112.375 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 52.7 mt -61.29 -40.27 93.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.865 0.364 . . . . 10.0 110.049 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 586' ' ' SER . . . . . 0.478 ' O ' ' HG3' ' C' ' 590' ' ' GLU . 19.1 m -73.47 -37.43 65.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.078 -0.712 . . . . 10.0 109.078 178.417 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -58.89 -50.52 73.71 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.674 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.9 mt -62.82 -37.61 87.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.29 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 589' ' ' GLU . . . . . 0.409 ' HG2' ' HE3' ' C' ' 593' ' ' LYS . 3.5 tt0 -62.64 -46.5 87.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.337 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 590' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' C' ' 586' ' ' SER . 55.2 mt-10 -63.81 -40.99 97.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.78 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -64.54 -42.99 95.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.879 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 1.6 p -69.49 -21.93 63.65 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.562 0.579 . . . . 10.0 112.562 -179.134 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 593' ' ' LYS . . . . . 0.409 ' HE3' ' HG2' ' C' ' 589' ' ' GLU . 90.5 mttt -84.94 -14.86 46.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.306 0.574 . . . . 10.0 110.586 179.386 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.19 -48.98 4.22 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.76 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 89.2 mt -94.2 48.94 1.27 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.143 0.497 . . . . 10.0 110.478 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 . . . . . 0 C--O 1.251 1.146 0 CA-C-O 118.652 -0.69 . . . . 10.0 110.825 -179.067 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 120.643 0.258 . . . . 10.0 110.749 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 3' ' ' GLU . . . . . 0.728 ' HG2' ' HB2' ' B' ' 52' ' ' LEU . 0.0 OUTLIER -145.63 138.84 26.21 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.878 -0.786 . . . . 10.0 108.878 -179.423 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -140.16 127.28 20.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.061 0.457 . . . . 10.0 111.91 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.453 ' HG3' ' HB3' ' B' ' 54' ' ' ASP . 14.3 mptt -93.22 117.9 30.61 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.846 -0.798 . . . . 10.0 108.846 178.538 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 68.8 mt -110.69 118.24 35.64 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.206 0.527 . . . . 10.0 111.663 -178.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.402 HG13 HD23 ' B' ' 56' ' ' LEU . 39.6 t -95.71 112.05 27.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.437 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 38.6 t -94.32 116.0 34.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 109.596 -0.52 . . . . 10.0 109.596 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 21.2 m -105.33 167.54 2.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.425 -0.352 . . . . 10.0 111.336 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 150.56 165.69 12.92 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 111.458 -0.657 . . . . 10.0 111.458 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.26 169.06 14.15 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.726 0.298 . . . . 10.0 111.025 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -77.75 61.32 3.67 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.298 -0.477 . . . . 10.0 112.373 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -153.83 -32.06 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 111.027 -0.829 . . . . 10.0 111.027 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 21.4 m -77.2 166.68 2.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 110.205 -0.294 . . . . 10.0 110.205 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -83.77 54.96 5.0 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.756 -0.735 . . . . 10.0 113.498 -179.004 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 18.5 mtmt -60.62 -61.99 2.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.989 0.423 . . . . 10.0 111.204 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 17' ' ' SER . . . . . 0.415 ' O ' HG13 ' B' ' 21' ' ' ILE . 1.8 p -63.99 -36.27 83.41 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.82 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.58 -50.0 75.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.113 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 63.8 mt -61.31 -42.68 99.07 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.831 0.348 . . . . 10.0 110.767 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 13.7 m -61.24 -49.21 78.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.953 -0.567 . . . . 10.0 111.002 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' ILE . . . . . 0.415 HG13 ' O ' ' B' ' 17' ' ' SER . 67.4 mt -67.39 -32.49 57.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.79 0.328 . . . . 10.0 110.591 179.744 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.527 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 17.1 tp60 -67.68 -18.61 65.0 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.121 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.8 tp -99.11 -37.88 9.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.208 0.528 . . . . 10.0 110.656 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 45.8 mm -76.04 -68.92 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.408 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 25' ' ' GLN . . . . . 0.416 ' OE1' ' HA ' ' D' ' 840' ' ' VAL . 42.0 mt-30 -85.89 -21.55 27.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.061 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.527 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 27.9 m-80 66.97 34.53 5.17 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.971 -178.498 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -127.45 126.97 43.29 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.252 -0.886 . . . . 10.0 109.277 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -78.19 133.44 37.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.93 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 3.4 m -107.62 123.71 63.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.762 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -89.08 -29.32 19.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.589 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -68.31 135.01 51.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.463 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -87.33 94.42 9.67 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.979 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 33' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 2.0 t70 -98.11 130.68 28.0 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 109.486 -0.561 . . . . 10.0 109.486 179.026 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 34' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 31.0 Cg_exo -64.14 178.08 1.69 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.97 2.447 . . . . 10.0 112.454 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.2 m -163.69 141.73 7.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.225 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.794 HD11 HG21 ' D' ' 809' ' ' THR . 5.3 mt -118.7 -65.19 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 108.654 -0.869 . . . . 10.0 108.654 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.48 ' O ' HG23 ' D' ' 821' ' ' VAL . 14.1 tt0 -148.77 93.45 2.12 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.093 -0.706 . . . . 10.0 109.093 179.019 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 38' ' ' ASP . . . . . 0.718 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 56.6 m-20 -114.13 160.95 18.38 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.654 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 39' ' ' SER . . . . . 0.406 ' HB2' ' HB3' ' D' ' 818' ' ' GLN . 4.5 m -146.53 140.41 26.14 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.971 0.415 . . . . 10.0 112.021 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 40' ' ' TYR . . . . . 0.592 ' CE2' HG22 ' D' ' 840' ' ' VAL . 2.8 m-85 -129.67 152.43 49.19 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 109.336 -0.616 . . . . 10.0 109.336 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 41' ' ' ARG . . . . . 0.602 HH12 ' HD3' ' D' ' 817' ' ' LYS . 11.7 ttp180 -141.47 137.25 31.99 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 122.076 -0.39 . . . . 10.0 110.826 -178.284 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -155.92 147.51 22.87 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -102.16 125.62 48.9 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.782 -0.451 . . . . 10.0 109.782 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 15.6 m -136.97 158.26 36.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.847 0.356 . . . . 10.0 111.074 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.613 ' HA ' ' HA ' ' B' ' 50' ' ' THR . 24.7 t -95.63 101.71 12.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 109.179 -0.674 . . . . 10.0 109.179 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 46' ' ' ILE . . . . . 0.528 HD11 HD11 ' B' ' 53' ' ' LEU . 54.5 mt -92.26 105.28 16.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.453 -178.671 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 57.25 36.63 27.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.5 -0.773 . . . . 10.0 111.728 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.1 -15.32 62.67 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.772 -0.728 . . . . 10.0 113.611 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -106.13 109.05 20.86 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.874 0.337 . . . . 10.0 111.07 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.613 ' HA ' ' HA ' ' B' ' 45' ' ' VAL . 11.1 t -76.04 143.52 41.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.561 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 1.4 p -165.0 162.41 20.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.378 -179.623 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.728 ' HB2' ' HG2' ' B' ' 3' ' ' GLU . 17.6 mt -95.06 129.49 42.13 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 179.053 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.528 HD11 HD11 ' B' ' 46' ' ' ILE . 89.6 mt -110.03 122.09 46.77 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.958 -0.297 . . . . 10.0 111.552 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.453 ' HB3' ' HG3' ' B' ' 5' ' ' LYS . 7.8 t70 -99.25 100.9 12.05 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.067 -1.086 . . . . 10.0 108.067 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 32.1 mt -88.86 126.02 41.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.346 -178.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.402 HD23 HG13 ' B' ' 7' ' ' VAL . 33.0 tp -101.1 116.31 32.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.778 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.718 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 9.1 t0 -92.48 98.94 11.78 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 40.1 p -77.92 164.92 24.7 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 113.004 0.742 . . . . 10.0 113.004 -178.196 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.63 163.59 23.41 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.219 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.63 -32.04 47.77 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.73 -0.747 . . . . 10.0 112.675 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -150.28 131.85 14.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.823 0.344 . . . . 20.0 111.218 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.429 ' OE2' ' HD2' ' B' ' 68' ' ' ARG . 36.6 mt-10 -133.46 158.35 43.32 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.527 -0.546 . . . . 10.0 109.527 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -92.68 -74.38 0.52 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.127 0.489 . . . . 10.0 109.722 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -162.99 61.01 0.19 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.364 -0.834 . . . . 10.0 109.096 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.49 126.82 31.58 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.415 -0.812 . . . . 10.0 111.486 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.07 -37.44 87.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.255 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 7.9 tmm? -63.11 -34.32 77.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.287 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.685 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 32.3 ttt85 -61.86 -46.7 88.31 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.396 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.61 -24.65 67.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.633 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -78.54 -44.4 24.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.767 -0.651 . . . . 10.0 111.115 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 71' ' ' TYR . . . . . 0.685 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 1.4 p90 -70.95 -29.27 65.24 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 120.363 -0.535 . . . . 10.0 112.183 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 76.5 mtp -79.42 -15.22 58.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 10.0 109.996 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 73' ' ' ARG . . . . . 0.789 ' HD3' ' HB ' ' B' ' 103' ' ' VAL . 2.9 tpp180 -74.01 -27.01 60.75 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.18 -179.262 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 m -82.8 -33.2 27.32 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.689 0.625 . . . . 10.0 112.689 -178.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -57.29 148.28 33.7 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 114.445 0.538 . . . . 10.0 114.445 -178.527 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 76' ' ' GLU . . . . . 0.491 ' O ' ' HD2' ' B' ' 110' ' ' PRO . 13.6 tt0 -111.21 -39.71 4.65 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-O 121.112 0.482 . . . . 10.0 109.8 178.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -118.51 138.11 13.47 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 110.998 -0.841 . . . . 10.0 110.998 179.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.403 ' O ' ' HA ' ' B' ' 111' ' ' MET . 85.5 m-85 -129.58 143.08 50.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.051 0.453 . . . . 10.0 111.949 -178.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.746 ' HG ' HD22 ' B' ' 159' ' ' LEU . 58.7 mt -99.85 122.21 42.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.144 179.375 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 80' ' ' CYS . . . . . 0.428 ' HB2' ' HA ' ' B' ' 113' ' ' LEU . 6.7 m -88.87 78.88 7.49 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.533 ' HA ' ' HB ' ' B' ' 114' ' ' VAL . 21.5 t -82.91 118.66 30.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.547 -178.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.824 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 18.8 p90 -134.75 158.93 42.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.855 -0.612 . . . . 10.0 109.712 178.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -97.29 130.69 44.45 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 84' ' ' ILE . . . . . 0.668 HD11 ' HA ' ' B' ' 118' ' ' CYS . 27.7 pt -73.31 -5.25 6.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.015 0.436 . . . . 10.0 111.372 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.08 3.5 28.19 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.027 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -126.62 116.81 21.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.915 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.41 -32.36 71.29 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.283 0.475 . . . . 10.0 112.283 -178.794 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -60.97 -46.19 91.73 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 111.654 0.242 . . . . 10.0 111.654 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 89' ' ' SER . . . . . 0.824 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.8 OUTLIER -59.73 -26.32 65.55 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.43 0.53 . . . . 10.0 112.43 -179.643 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -70.54 -34.01 71.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.041 0.448 . . . . 10.0 110.138 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -85.71 -26.99 25.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.738 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 92' ' ' ASP . . . . . 0.467 ' HB2' ' HA ' ' B' ' 89' ' ' SER . 0.3 OUTLIER -66.71 -17.07 64.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.439 179.752 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 93' ' ' ILE . . . . . 0.632 HD11 ' HB3' ' B' ' 82' ' ' PHE . 43.6 mm -60.69 -45.82 96.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -67.71 -37.13 81.83 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 8.7 t-160 -61.42 -39.32 90.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.396 -0.82 . . . . 10.0 110.195 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -74.83 -46.72 34.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.526 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.97 -40.76 85.75 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.673 0.273 . . . . 10.0 111.27 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -65.32 -34.41 78.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.758 0.313 . . . . 10.0 111.144 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -69.25 -46.23 67.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.224 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 100' ' ' ILE . . . . . 0.502 ' HA ' HG22 ' B' ' 103' ' ' VAL . 41.8 mt -68.29 -33.96 63.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.115 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 101' ' ' LYS . . . . . 0.419 ' HD2' ' HG3' ' B' ' 107' ' ' GLU . 29.2 ttpt -60.43 -31.41 70.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.984 0.421 . . . . 10.0 110.642 179.386 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 44.9 ttp85 -78.21 -34.05 49.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.009 -0.542 . . . . 10.0 111.852 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.789 ' HB ' ' HD3' ' B' ' 73' ' ' ARG . 19.9 m -77.39 -32.11 18.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 112.405 0.52 . . . . 10.0 112.405 -179.157 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -95.92 -14.66 22.93 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.682 -0.407 . . . . 10.0 111.379 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 26.2 t0 58.85 48.15 11.6 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.496 0.665 . . . . 10.0 110.995 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 32.5 t -178.23 153.59 0.78 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.445 -0.798 . . . . 10.0 110.336 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 107' ' ' GLU . . . . . 0.419 ' HG3' ' HD2' ' B' ' 101' ' ' LYS . 17.1 mp0 -91.82 -8.17 47.39 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 108.715 -0.846 . . . . 10.0 108.715 178.364 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -83.82 64.02 7.82 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 114.969 -1.014 . . . . 10.0 110.568 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 50.5 t -121.15 116.95 30.88 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.226 -0.897 . . . . 10.0 109.797 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 110' ' ' PRO . . . . . 0.491 ' HD2' ' O ' ' B' ' 76' ' ' GLU . 51.4 Cg_exo -55.77 113.14 1.29 Allowed 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.927 2.418 . . . . 10.0 111.555 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 111' ' ' MET . . . . . 0.403 ' HA ' ' O ' ' B' ' 78' ' ' PHE . 65.3 mtt -133.28 150.95 51.89 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.293 -179.726 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 112' ' ' VAL . . . . . 0.481 ' HB ' HD23 ' B' ' 79' ' ' LEU . 95.1 t -132.0 124.96 54.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 179.2 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 113' ' ' LEU . . . . . 0.428 ' HA ' ' HB2' ' B' ' 80' ' ' CYS . 15.0 tp -75.6 121.09 21.91 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.8 -0.815 . . . . 10.0 108.8 179.313 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 114' ' ' VAL . . . . . 0.533 ' HB ' ' HA ' ' B' ' 81' ' ' VAL . 60.8 t -114.8 111.5 36.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 112.026 0.38 . . . . 10.0 112.026 -178.238 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -89.38 100.12 2.63 Favored Glycine 0 N--CA 1.449 -0.486 0 N-CA-C 109.746 -1.341 . . . . 10.0 109.746 178.558 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -86.67 153.13 21.99 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 112.544 0.572 . . . . 10.0 112.544 -177.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 77.4 mttt 70.38 46.39 0.58 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 114.919 -1.037 . . . . 10.0 113.442 178.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 118' ' ' CYS . . . . . 0.668 ' HA ' HD11 ' B' ' 84' ' ' ILE . 15.5 p -78.78 -2.53 39.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.986 0.422 . . . . 10.0 111.404 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -92.67 0.56 57.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.967 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 17.7 mt -97.13 127.08 39.82 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.838 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.68 -26.59 68.7 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.999 2.466 . . . . 10.0 111.286 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.35 70.4 4.7 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.589 -0.732 . . . . 10.0 110.001 179.29 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 24.6 ttt180 -101.41 122.46 43.79 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.579 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.21 -49.43 4.48 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.361 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 62.1 t -78.67 116.51 22.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.665 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -73.3 153.48 40.54 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.028 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 2.3 m -60.15 -37.41 80.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.229 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 16.4 tttm -68.25 -36.93 80.21 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 121.174 -0.211 . . . . 10.0 111.092 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -60.26 -39.65 87.55 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.058 0.456 . . . . 10.0 110.188 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -71.93 -41.22 68.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.114 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -61.64 -37.09 82.71 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.895 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.89 -46.76 80.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.149 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 32.8 tp -64.36 -42.13 96.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.451 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.76 -44.56 95.89 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.967 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.59 -27.53 69.01 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.071 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.9 m -71.21 -25.73 62.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.074 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 137' ' ' TYR . . . . . 0.431 ' HB2' HG12 ' B' ' 139' ' ' ILE . 21.8 m-85 -99.8 -20.0 16.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.975 0.416 . . . . 10.0 110.376 179.386 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.89 21.49 52.82 Favored Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 111.018 -0.833 . . . . 10.0 111.018 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 139' ' ' ILE . . . . . 0.431 HG12 ' HB2' ' B' ' 137' ' ' TYR . 49.1 pt -109.58 155.78 40.76 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.732 -0.234 . . . . 10.0 110.654 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -79.9 158.01 24.16 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.341 2.027 . . . . 10.0 111.97 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -120.76 122.95 41.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.553 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 24.0 mm -122.0 116.52 49.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.715 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 143' ' ' GLU . . . . . 0.6 ' HG2' ' HB3' ' B' ' 118' ' ' CYS . 6.8 tt0 -83.19 128.13 34.22 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.74 -0.837 . . . . 10.0 108.74 178.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 81.4 p -135.66 167.82 20.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.884 0.85 . . . . 10.0 112.987 -177.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 145' ' ' SER . . . . . 0.409 ' HB3' ' OG1' ' B' ' 148' ' ' THR . 5.6 t -157.55 131.81 8.32 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.471 -1.24 . . . . 10.0 108.173 178.342 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -76.71 -14.56 59.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.842 0.353 . . . . 10.0 110.639 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -85.48 -44.43 12.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.954 -0.566 . . . . 10.0 111.111 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 148' ' ' THR . . . . . 0.409 ' OG1' ' HB3' ' B' ' 145' ' ' SER . 48.9 p -86.05 -25.83 25.68 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.992 0.425 . . . . 10.0 110.368 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 14.2 ttt-85 66.07 27.55 10.55 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.435 -0.802 . . . . 10.0 110.682 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -91.9 127.53 37.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.262 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.35 7.22 67.49 Favored Glycine 0 C--O 1.228 -0.268 0 CA-C-N 115.977 -0.556 . . . . 10.0 113.939 178.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 95.3 t -66.57 -55.36 18.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.72 0.295 . . . . 10.0 111.63 -179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.46 -42.46 98.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.672 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -65.05 -31.77 73.16 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.319 0.489 . . . . 10.0 112.319 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.91 -46.67 89.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.107 0.48 . . . . 10.0 109.868 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -70.94 -40.03 72.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.384 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -62.92 -44.36 96.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.228 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.767 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 70.7 m -63.91 -33.68 76.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.859 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.746 HD22 ' HG ' ' B' ' 79' ' ' LEU . 58.1 tp -60.9 -42.82 98.76 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.513 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 160' ' ' VAL . . . . . 0.419 HG21 HD13 ' B' ' 46' ' ' ILE . 47.8 t -69.76 -32.96 54.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.74 178.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 161' ' ' ARG . . . . . 0.767 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 72.8 mtt180 -63.4 -41.19 98.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.557 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -64.65 -38.17 90.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 163' ' ' ILE . . . . . 0.547 HG22 ' HE2' ' B' ' 167' ' ' LYS . 97.1 mt -67.02 -40.12 84.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.477 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 30.1 ttm180 -58.17 -46.52 85.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.584 -0.735 . . . . 10.0 109.701 179.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -70.39 -33.32 71.25 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.291 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -59.93 -41.79 92.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.756 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 167' ' ' LYS . . . . . 0.547 ' HE2' HG22 ' B' ' 163' ' ' ILE . 67.6 mttm -68.22 -43.66 77.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.691 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -67.83 -33.52 74.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.078 0.466 . . . . 10.0 110.201 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -67.78 -28.92 68.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.704 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 54.8 ttp -62.01 -38.01 87.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.95 0.405 . . . . 10.0 111.233 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 49.9 m . . . . . 0 C--N 1.327 -0.398 0 CA-C-O 121.191 0.519 . . . . 10.0 111.077 179.634 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.134 -0.386 . . . . 10.0 112.134 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' D' D ' 809' ' ' THR . . . . . 0.794 HG21 HD11 ' B' ' 36' ' ' ILE . 11.8 p -122.7 145.83 48.04 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.667 0.27 . . . . 10.0 110.562 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 51.0 t -121.88 136.19 59.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.639 -0.255 . . . . 10.0 110.359 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 811' ' ' LYS . . . . . 0.533 ' HG2' HG22 ' D' ' 821' ' ' VAL . 80.2 mttt -86.55 120.79 28.24 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.19 0.519 . . . . 10.0 110.862 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 44.7 t -105.65 123.55 60.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.493 179.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 813' ' ' TYR . . . . . 0.809 ' HB2' HG12 ' D' ' 876' ' ' ILE . 80.1 m-85 -91.15 137.26 32.5 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.038 0.447 . . . . 10.0 110.785 -179.396 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 814' ' ' LEU . . . . . 0.772 HD13 ' HD2' ' D' ' 841' ' ' ARG . 13.3 mt -105.46 153.22 39.91 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.388 -178.454 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -65.01 -13.71 41.29 Favored 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 123.263 2.642 . . . . 10.0 113.428 -179.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -90.27 37.92 0.92 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.967 -0.383 . . . . 10.0 109.967 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 817' ' ' LYS . . . . . 0.602 ' HD3' HH12 ' B' ' 41' ' ' ARG . 30.0 mtpp 51.94 39.43 26.03 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.207 -0.906 . . . . 10.0 111.646 -179.477 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 818' ' ' GLN . . . . . 0.496 HE22 ' C ' ' B' ' 40' ' ' TYR . 84.1 mt-30 -136.63 -169.51 2.48 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 114.515 1.302 . . . . 10.0 114.515 -177.643 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 819' ' ' ARG . . . . . 0.46 ' NH1' ' HA ' ' D' ' 818' ' ' GLN . 0.0 OUTLIER -151.85 167.73 27.36 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.123 -0.944 . . . . 10.0 111.539 -178.363 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 14.7 t -154.03 139.12 17.36 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.949 -1.13 . . . . 10.0 107.949 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 821' ' ' VAL . . . . . 0.553 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 3.2 t -107.87 112.79 41.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 C-N-CA 120.443 -0.503 . . . . 10.0 111.202 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 5.6 t -110.22 148.91 13.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.54 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 2.6 m -88.68 108.33 19.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.115 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 61.5 t -77.7 121.18 29.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.942 0.401 . . . . 10.0 110.636 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 21.6 mtp85 -122.41 156.14 34.63 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.186 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -73.54 139.4 45.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.811 0.338 . . . . 10.0 110.766 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 110.82 -36.91 3.98 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.781 -0.724 . . . . 10.0 112.252 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 12.0 ptm -81.42 149.74 28.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.741 0.305 . . . . 10.0 110.61 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 97.9 p -100.03 176.3 5.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.952 0.406 . . . . 10.0 110.657 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 16.1 t -63.2 -36.82 77.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.193 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -62.47 -44.87 95.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.484 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -65.21 -47.52 76.58 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.048 0.452 . . . . 10.0 111.072 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 3.1 m -64.89 -43.0 94.33 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.769 -0.651 . . . . 10.0 112.416 -178.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.87 -16.63 56.8 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.31 0.856 . . . . 10.0 113.31 -178.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -59.23 -50.78 72.68 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.031 0.443 . . . . 10.0 111.01 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 5.5 mmmm -66.3 -25.92 67.08 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.387 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -80.11 -18.02 51.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.533 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 838' ' ' LEU . . . . . 0.563 HD21 HG11 ' D' ' 877' ' ' VAL . 78.2 mt -100.68 -48.66 4.43 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.236 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -58.26 -33.16 69.08 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.983 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 840' ' ' VAL . . . . . 0.755 HG13 ' HG3' ' D' ' 841' ' ' ARG . 9.6 p -56.03 -22.63 13.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 115.805 -0.634 . . . . 10.0 112.096 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 841' ' ' ARG . . . . . 0.772 ' HD2' HD13 ' D' ' 814' ' ' LEU . 0.9 OUTLIER -119.53 13.23 12.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.586 -179.381 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 75.95 19.33 78.87 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.68 -0.771 . . . . 10.0 112.526 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 58.5 mt -92.65 175.51 6.79 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.935 -0.394 . . . . 10.0 109.935 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -152.22 155.15 37.19 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.382 -0.229 . . . . 10.0 110.382 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 845' ' ' GLN . . . . . 0.47 ' HG3' HD12 ' D' ' 838' ' ' LEU . 22.4 mp0 -75.6 71.01 2.48 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.995 0.426 . . . . 10.0 111.054 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -129.4 -70.45 0.65 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.669 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -104.62 15.31 28.26 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.395 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 16.0 m -111.5 129.74 55.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.198 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 6.1 p -121.69 153.12 25.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.486 -0.324 . . . . 10.0 110.517 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 20.1 t -100.16 136.28 32.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.132 0.492 . . . . 10.0 111.523 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 851' ' ' TYR . . . . . 0.51 ' CE2' HG22 ' D' ' 860' ' ' VAL . 86.9 m-85 -112.83 135.01 54.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.687 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 852' ' ' ARG . . . . . 0.494 ' HG3' ' HB ' ' D' ' 861' ' ' THR . 61.1 mtp180 -78.97 131.4 36.32 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 178.485 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 853' ' ' LEU . . . . . 0.722 HD21 ' HE3' ' D' ' 858' ' ' LYS . 0.4 OUTLIER -106.73 114.12 28.03 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.121 0.486 . . . . 10.0 111.746 -179.315 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 2.4 pt -150.75 141.21 16.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt 68.47 -53.29 0.55 Allowed 'General case' 0 N--CA 1.472 0.631 0 O-C-N 123.653 0.596 . . . . 10.0 112.567 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 167.09 -30.56 0.19 Allowed Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 111.21 -0.756 . . . . 10.0 111.21 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 11.9 mmt180 -83.68 150.64 25.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.749 0.309 . . . . 10.0 110.629 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 858' ' ' LYS . . . . . 0.722 ' HE3' HD21 ' D' ' 853' ' ' LEU . 7.6 mptt -108.71 114.67 28.67 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.26 -0.427 . . . . 10.0 109.927 179.656 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.02 138.75 42.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.574 0.226 . . . . 10.0 111.212 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 860' ' ' VAL . . . . . 0.51 HG22 ' CE2' ' D' ' 851' ' ' TYR . 1.6 t -62.99 146.9 12.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.95 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 861' ' ' THR . . . . . 0.494 ' HB ' ' HG3' ' D' ' 852' ' ' ARG . 1.8 t -134.2 160.59 37.39 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.165 179.324 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -99.35 157.62 16.28 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.502 -0.317 . . . . 10.0 110.417 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -78.79 -29.6 45.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.931 0.395 . . . . 10.0 111.127 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -89.25 50.03 1.86 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.992 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 1.3 m -123.91 153.1 41.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.823 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -67.59 141.49 56.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.83 0.348 . . . . 10.0 110.811 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 9.9 tp -91.86 -14.4 8.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.183 0.516 . . . . 10.0 111.08 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 868' ' ' ALA . . . . . 0.453 ' N ' ' HD2' ' D' ' 869' ' ' PRO . . . -55.28 -49.37 92.79 Favored Pre-proline 0 CA--C 1.541 0.62 0 N-CA-C 113.795 1.035 . . . . 10.0 113.795 -179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 869' ' ' PRO . . . . . 0.453 ' HD2' ' N ' ' D' ' 868' ' ' ALA . 50.9 Cg_endo -68.89 -13.35 36.58 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 122.143 1.895 . . . . 10.0 113.058 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 8.8 mp -85.94 81.93 8.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.257 0.551 . . . . 10.0 110.557 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -139.52 123.4 17.63 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.107 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 87.68 15.6 61.36 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.911 -0.662 . . . . 10.0 112.02 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -127.09 159.44 34.2 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 122.871 -0.194 . . . . 10.0 110.613 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 874' ' ' GLU . . . . . 0.417 ' HB2' ' HB3' ' D' ' 853' ' ' LEU . 2.2 mp0 -102.47 174.07 6.07 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.092 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 93.1 mt -136.56 131.41 33.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.71 -0.223 . . . . 10.0 110.568 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 876' ' ' ILE . . . . . 0.809 HG12 ' HB2' ' D' ' 813' ' ' TYR . 6.5 mt -117.11 129.09 74.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.585 -0.279 . . . . 10.0 110.301 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 877' ' ' VAL . . . . . 0.563 HG11 HD21 ' D' ' 838' ' ' LEU . 24.3 t -102.64 126.92 56.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -140.79 179.22 6.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.95 0.405 . . . . 10.0 111.112 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 20.1 m -81.39 148.11 5.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.55 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 15.3 mt . . . . . 0 C--O 1.254 1.335 0 CA-C-O 118.402 -0.809 . . . . 10.0 111.063 -179.984 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 239' ' ' LEU . . . . . 0.605 ' HA ' ' HB2' ' A' ' 242' ' ' GLU . 75.2 mt . . . . . 0 C--O 1.227 -0.131 0 CA-C-O 120.446 0.165 . . . . 10.0 111.153 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 54.2 mtm-85 -65.35 -50.03 67.14 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.648 -0.871 . . . . 10.0 108.648 178.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -64.73 -40.62 95.63 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.53 -0.915 . . . . 10.0 108.53 178.274 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 242' ' ' GLU . . . . . 0.605 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 41.9 mm-40 -58.94 -51.9 68.05 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.202 -0.908 . . . . 10.0 110.715 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 62.3 mtm -63.84 -28.0 69.56 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.795 0.331 . . . . 10.0 110.818 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 56.6 m -70.78 -13.46 62.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.296 178.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 41.8 mttm -109.43 -53.31 2.67 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 108.64 -0.874 . . . . 10.0 108.64 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 246' ' ' ASP . . . . . 0.472 ' O ' HG23 ' A' ' 250' ' ' VAL . 7.3 t70 -52.14 -64.5 0.79 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.078 -0.965 . . . . 10.0 111.395 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 95.8 mt -57.98 -39.61 78.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.977 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -65.72 -44.45 86.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.682 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -64.85 -40.53 95.31 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.518 -0.549 . . . . 10.0 109.518 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 250' ' ' VAL . . . . . 0.692 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 54.2 t -62.08 -51.36 73.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.451 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.016 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 251' ' ' LYS . . . . . 0.457 ' O ' HG12 ' A' ' 254' ' ' VAL . 84.0 mttt -66.16 -46.6 76.86 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.593 0.59 . . . . 10.0 112.593 -179.393 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.12 -43.87 97.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.187 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -80.32 -24.78 39.7 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.302 0.482 . . . . 10.0 112.302 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.692 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.4 OUTLIER -62.64 -27.52 43.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.924 -0.31 . . . . 10.0 110.728 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 255' ' ' GLN . . . . . 0.489 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 63.8 mt-30 -61.31 -62.0 6.8 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-N 116.526 -0.306 . . . . 10.0 110.591 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 256' ' ' PRO . . . . . 0.49 ' O ' ' HB2' ' A' ' 260' ' ' ASP . 32.4 Cg_endo -67.56 -28.51 38.04 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 121.73 1.62 . . . . 10.0 111.569 178.243 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -66.1 -50.37 64.29 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 109.524 -0.547 . . . . 10.0 109.524 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 258' ' ' LEU . . . . . 0.414 ' HG ' HG22 ' A' ' 254' ' ' VAL . 41.7 mt -68.92 -37.75 79.13 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.009 -0.542 . . . . 10.0 110.058 179.043 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -61.48 -44.55 96.88 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.497 -0.557 . . . . 10.0 109.497 178.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 260' ' ' ASP . . . . . 0.49 ' HB2' ' O ' ' A' ' 256' ' ' PRO . 9.4 t0 -58.57 -49.08 78.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.506 179.12 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -65.39 -46.39 80.26 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 115.466 -0.788 . . . . 10.0 110.934 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -58.93 -52.47 65.61 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 111.888 0.329 . . . . 10.0 111.888 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -57.05 -46.39 82.47 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 120.782 0.325 . . . . 10.0 111.289 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 0.1 OUTLIER -70.08 -38.28 75.68 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.639 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 15.3 t90 -66.43 -36.58 83.17 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 179.343 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 266' ' ' GLN . . . . . 0.444 ' O ' ' HB2' ' A' ' 270' ' ' GLU . 67.5 mt-30 -63.23 -42.21 99.21 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.465 -0.939 . . . . 10.0 108.465 178.11 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -66.56 -39.78 88.69 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.855 -0.795 . . . . 10.0 108.855 178.204 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 268' ' ' GLU . . . . . 0.45 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 22.9 mt-10 -60.21 -49.65 76.77 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.818 178.292 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 79.4 mmm -65.29 -44.67 87.22 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.703 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 270' ' ' GLU . . . . . 0.466 ' HG3' HH12 ' A' ' 273' ' ' ARG . 0.4 OUTLIER -60.91 -49.74 76.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.917 179.6 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 271' ' ' LEU . . . . . 0.467 ' O ' ' HG2' ' A' ' 275' ' ' LYS . 59.4 mt -64.2 -44.03 93.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.298 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 272' ' ' TYR . . . . . 0.49 ' O ' HG23 ' A' ' 276' ' ' VAL . 26.6 t80 -60.67 -47.35 86.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.222 -0.444 . . . . 10.0 109.979 179.374 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 273' ' ' ARG . . . . . 0.466 HH12 ' HG3' ' A' ' 270' ' ' GLU . 32.1 ttm105 -65.14 -37.34 87.11 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.125 0.488 . . . . 10.0 110.083 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 274' ' ' GLN . . . . . 0.418 ' HB2' ' O ' ' A' ' 270' ' ' GLU . 0.0 OUTLIER -63.08 -35.81 81.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.403 -0.817 . . . . 10.0 109.559 178.885 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.567 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 25.9 mmtp -80.84 -34.57 33.74 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.138 178.772 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 276' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 272' ' ' TYR . 12.0 t -51.78 -44.92 37.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 N-CA-C 112.112 0.412 . . . . 10.0 112.112 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 277' ' ' GLU . . . . . 0.44 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 54.0 mt-10 -50.6 -64.05 1.52 Allowed Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 112.613 0.597 . . . . 10.0 112.613 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 278' ' ' PRO . . . . . 0.519 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 50.2 Cg_endo -70.89 -35.93 8.57 Favored 'Trans proline' 0 C--N 1.355 0.91 0 C-N-CA 121.846 1.698 . . . . 10.0 113.031 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.641 HD22 ' HG2' ' C' ' 495' ' ' LYS . 28.5 mt -63.71 -39.78 95.15 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 121.031 -0.268 . . . . 10.0 111.0 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -73.86 -29.72 62.27 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.952 -0.759 . . . . 10.0 108.952 178.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 281' ' ' ALA . . . . . 0.422 ' O ' ' HG3' ' A' ' 285' ' ' GLU . . . -64.45 -44.52 90.85 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.89 -0.782 . . . . 10.0 108.89 178.418 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 282' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 65.7 mt-10 -58.9 -42.27 89.16 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 108.711 -0.848 . . . . 10.0 108.711 178.073 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 95.0 mt -63.36 -46.16 87.81 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.244 -0.889 . . . . 10.0 110.431 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -62.27 -54.1 45.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.897 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 285' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 281' ' ' ALA . 21.7 mt-10 -60.82 -44.74 96.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.08 0.467 . . . . 10.0 110.504 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.02 -44.07 97.91 Favored Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.689 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.83 -39.39 93.49 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 109.919 -0.4 . . . . 10.0 109.919 179.259 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 288' ' ' ARG . . . . . 0.57 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 96.8 mtt180 -60.07 -42.57 94.83 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.476 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 14.1 tm0? -67.07 -49.69 64.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.176 -0.466 . . . . 10.0 109.999 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 33.6 mttp -59.42 -47.1 86.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.501 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 77.8 mt -66.31 -35.42 80.34 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.455 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 292' ' ' HIS . . . . . 0.57 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 20.5 t60 -60.41 -50.17 74.64 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 293' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 297' ' ' LYS . 0.4 OUTLIER -64.12 -36.47 84.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.854 179.497 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 83.0 mt -71.51 -38.64 71.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.995 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -66.83 -41.93 86.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.473 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -77.72 2.37 17.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.268 0.556 . . . . 10.0 110.24 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 297' ' ' LYS . . . . . 1.034 ' HE2' ' HG ' ' C' ' 477' ' ' LEU . 29.3 tttp -105.25 -37.45 6.88 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.859 -0.793 . . . . 10.0 108.859 178.644 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 13.7 mt -68.45 -24.57 64.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.359 -0.837 . . . . 10.0 111.053 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -62.59 1.71 Allowed Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.495 -0.32 . . . . 10.0 111.851 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -68.06 -51.55 0.61 Allowed 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 122.055 1.837 . . . . 10.0 112.445 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.812 HD13 ' HG2' ' C' ' 473' ' ' LYS . 60.2 mt -66.98 -26.65 66.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.704 0.287 . . . . 10.0 111.171 -179.614 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -75.81 -40.11 31.98 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 109.35 -1.5 . . . . 10.0 109.35 177.747 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -64.65 -43.86 92.3 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.767 -0.827 . . . . 10.0 108.767 178.12 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -62.62 -40.15 96.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.441 -0.799 . . . . 10.0 108.909 178.223 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 14.7 tpt -61.75 -41.82 98.17 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 115.693 -0.685 . . . . 10.0 109.368 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 -64.78 -42.88 94.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.473 . . . . 10.0 109.963 178.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -63.44 -46.84 84.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.251 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 308' ' ' ARG . . . . . 0.672 ' HG3' HD21 ' C' ' 469' ' ' LEU . 16.5 mmt180 -68.19 -33.67 74.87 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.406 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 309' ' ' ALA . . . . . 0.401 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -65.5 -39.34 91.77 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 178.555 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 310' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' A' ' 314' ' ' ASP . 44.8 mtt85 -60.22 -47.22 86.91 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.031 -0.729 . . . . 10.0 109.031 178.213 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -64.68 -43.09 94.68 Favored 'General case' 0 C--O 1.226 -0.184 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 178.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 312' ' ' HIS . . . . . 0.709 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 0.4 OUTLIER -53.45 -54.42 37.3 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.424 -0.807 . . . . 10.0 110.331 179.052 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 39.9 t -73.84 -38.68 50.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.396 -0.82 . . . . 10.0 112.053 -178.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 314' ' ' ASP . . . . . 0.531 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 1.3 m-20 -63.51 -40.95 98.41 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.889 0.376 . . . . 10.0 110.632 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -66.76 -28.99 68.85 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 177.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 19.2 mt -74.28 -40.65 62.17 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.191 -0.913 . . . . 10.0 109.131 178.09 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -62.19 -47.1 85.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.975 0.416 . . . . 10.0 110.345 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 1.4 p -66.9 -15.24 63.52 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.618 -0.719 . . . . 10.0 111.664 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -103.27 -38.19 7.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.087 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 320' ' ' LEU . . . . . 0.44 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 39.9 mt -64.82 -34.72 79.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.387 -0.369 . . . . 10.0 111.19 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.94 -60.82 8.37 Favored Pre-proline 0 CA--C 1.535 0.395 0 O-C-N 123.213 0.32 . . . . 10.0 110.541 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -65.16 -30.06 55.51 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 121.524 1.482 . . . . 10.0 111.08 177.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 323' ' ' TYR . . . . . 0.44 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 4.2 m-30 -61.8 -56.42 19.67 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 110.249 -0.278 . . . . 10.0 110.249 178.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 324' ' ' SER . . . . . 0.405 ' HA ' ' HB2' ' A' ' 327' ' ' LEU . 17.0 p -66.72 -36.55 82.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.924 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -63.07 -48.61 77.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.3 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -71.57 -22.53 61.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.889 0.376 . . . . 10.0 110.009 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 327' ' ' LEU . . . . . 0.506 HD23 ' HG3' ' A' ' 330' ' ' ARG . 14.2 mt -69.98 -28.09 65.24 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 177.571 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -65.0 -39.73 93.9 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 107.323 -1.362 . . . . 10.0 107.323 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -64.93 -39.56 93.69 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.007 -0.997 . . . . 10.0 108.729 177.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 330' ' ' ARG . . . . . 0.69 ' O ' ' HG2' ' A' ' 334' ' ' ARG . 10.5 mmt180 -62.19 -53.4 55.84 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 108.658 -0.867 . . . . 10.0 108.658 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 331' ' ' LEU . . . . . 0.421 ' O ' ' HB2' ' A' ' 335' ' ' LEU . 95.6 mt -54.59 -44.01 72.65 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.454 -0.793 . . . . 10.0 110.366 179.351 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 332' ' ' ALA . . . . . 0.409 ' O ' ' HG3' ' A' ' 336' ' ' GLU . . . -62.97 -48.55 78.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.412 -0.358 . . . . 10.0 110.522 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.18 -45.64 90.5 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.592 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 334' ' ' ARG . . . . . 0.69 ' HG2' ' O ' ' A' ' 330' ' ' ARG . 4.0 mmt85 -66.68 -46.2 76.41 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.942 179.499 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 335' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 331' ' ' LEU . 5.2 mt -60.43 -41.37 93.85 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.797 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 336' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 332' ' ' ALA . 89.0 mt-10 -58.72 -44.53 90.42 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.901 -0.407 . . . . 10.0 109.901 178.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -68.77 -42.53 77.31 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.662 -0.496 . . . . 10.0 109.662 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 338' ' ' LEU . . . . . 0.491 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 71.6 mt -65.49 -24.38 67.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.398 179.25 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -89.5 -38.28 14.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.883 0.373 . . . . 10.0 110.841 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -72.94 -53.78 10.38 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.128 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -71.06 -32.52 69.23 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.509 -0.922 . . . . 10.0 108.509 178.372 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 342' ' ' GLY . . . . . 0.491 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -63.46 -46.37 92.71 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.344 -0.844 . . . . 10.0 111.121 179.13 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.72 -41.2 98.92 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 109.975 -1.25 . . . . 10.0 109.975 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.62 -44.18 91.36 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 345' ' ' ARG . . . . . 0.496 ' HD3' ' OE2' ' C' ' 433' ' ' GLU . 22.5 mtm180 -58.57 -45.07 89.81 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.397 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 87.4 mt -63.09 -51.25 67.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.816 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.24 -44.64 95.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.155 0.502 . . . . 10.0 110.373 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 348' ' ' GLU . . . . . 0.626 ' HB3' ' HZ1' ' A' ' 352' ' ' LYS . 27.8 mt-10 -65.5 -43.34 90.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.88 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -62.48 -36.22 81.79 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -64.86 -46.94 79.72 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.548 -0.538 . . . . 10.0 109.548 178.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -65.1 -41.46 94.95 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.246 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 352' ' ' LYS . . . . . 0.717 ' HZ2' ' HB3' ' C' ' 425' ' ' GLU . 16.1 mtmm -71.82 -16.91 62.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.481 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -86.67 -42.43 13.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.55 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.63 -40.29 96.52 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.948 -0.39 . . . . 10.0 109.948 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 355' ' ' GLU . . . . . 0.436 ' HA ' ' OG ' ' A' ' 358' ' ' SER . 5.4 mm-40 -71.14 -27.79 63.81 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.419 0.628 . . . . 10.0 109.461 178.348 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 356' ' ' HIS . . . . . 0.515 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 0.1 OUTLIER -73.75 -33.75 64.44 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.467 -0.938 . . . . 10.0 108.467 178.309 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 82.4 mt -78.68 -38.23 39.8 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.136 -0.938 . . . . 10.0 111.747 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 358' ' ' SER . . . . . 0.436 ' OG ' ' HA ' ' A' ' 355' ' ' GLU . 1.9 p -63.11 -45.89 89.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.923 0.392 . . . . 10.0 109.967 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 359' ' ' THR . . . . . 0.592 ' HA ' ' OE1' ' A' ' 362' ' ' GLU . 17.6 p -71.96 -15.98 62.08 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.473 0.654 . . . . 10.0 109.256 178.661 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 360' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 356' ' ' HIS . 18.6 tp -84.32 -28.87 26.78 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.396 -0.82 . . . . 10.0 109.118 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 3.1 m -64.71 -34.27 77.92 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.107 -1.071 . . . . 10.0 108.107 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 362' ' ' GLU . . . . . 0.592 ' OE1' ' HA ' ' A' ' 359' ' ' THR . 32.5 mt-10 -73.55 -0.08 14.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.703 -1.135 . . . . 10.0 110.538 178.673 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.658 ' HG2' HG22 ' C' ' 411' ' ' THR . 55.4 mttp -115.38 -37.06 4.13 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.548 -0.908 . . . . 10.0 108.548 177.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -75.29 -14.78 60.53 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.591 -0.731 . . . . 10.0 111.72 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.93 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 94.0 mttt -110.64 -71.19 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 120.73 -0.388 . . . . 10.0 112.028 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.93 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 40.7 Cg_exo -59.4 -52.22 5.11 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.06 1.84 . . . . 10.0 112.322 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 367' ' ' ALA . . . . . 0.587 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -62.82 -40.24 96.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.561 0.22 . . . . 10.0 111.468 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.75 -43.21 94.06 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.975 -0.38 . . . . 10.0 109.975 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 369' ' ' GLU . . . . . 0.599 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 16.0 mt-10 -65.34 -34.82 79.22 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 109.744 -0.465 . . . . 10.0 109.744 178.519 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -44.7 91.96 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 178.278 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 82.5 mt -62.29 -40.71 97.16 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.333 178.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.574 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 65.0 mtt180 -62.91 -43.68 98.14 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.249 -0.648 . . . . 10.0 109.249 178.621 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.599 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.3 mt-30 -62.33 -26.61 68.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.257 -0.883 . . . . 20.0 112.564 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -89.23 -38.63 6.67 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 109.684 -1.366 . . . . 10.0 109.684 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 31.9 mt -58.1 -35.88 72.08 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.706 0.262 . . . . 10.0 111.706 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 376' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 35.3 mt -55.96 -65.38 1.56 Allowed Pre-proline 0 CA--C 1.538 0.507 0 N-CA-C 111.612 0.227 . . . . 10.0 111.612 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 377' ' ' PRO . . . . . 0.545 ' HD3' ' HB2' ' A' ' 376' ' ' LEU . 37.9 Cg_endo -66.9 -30.53 39.86 Favored 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 122.069 1.846 . . . . 10.0 111.783 179.18 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 4.3 t -64.89 -48.91 82.35 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 CA-C-O 120.514 0.197 . . . . 10.0 110.567 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 41.6 mt -64.22 -35.61 81.39 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 380' ' ' GLU . . . . . 0.442 ' HG3' ' O ' ' A' ' 376' ' ' LEU . 19.4 mt-10 -66.25 -53.7 33.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.799 178.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 5.5 p -60.54 -38.05 83.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.861 0.362 . . . . 10.0 110.464 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -63.12 -49.32 74.89 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.923 -0.58 . . . . 10.0 109.835 178.369 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -62.89 -42.22 99.69 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 116.483 -0.326 . . . . 10.0 110.863 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 48.0 t -58.43 -47.3 88.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 12.7 m -69.42 -38.96 78.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.148 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 386' ' ' PHE . . . . . 0.469 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 3.3 m-85 -67.36 -49.46 63.89 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.688 0.255 . . . . 10.0 111.688 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 92.1 mt -59.82 -41.34 91.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.49 -0.323 . . . . 10.0 111.233 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 388' ' ' SER . . . . . 0.429 ' HA ' ' OE1' ' A' ' 391' ' ' GLU . 22.6 p -72.23 -31.45 65.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.112 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -73.39 -33.89 65.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.904 0.383 . . . . 10.0 110.087 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 390' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 83.4 mt -60.2 -28.35 67.9 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.331 0.586 . . . . 10.0 109.913 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 391' ' ' GLU . . . . . 0.429 ' OE1' ' HA ' ' A' ' 388' ' ' SER . 39.0 mt-10 -65.78 -40.19 91.73 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.365 -0.834 . . . . 10.0 109.688 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 392' ' ' GLU . . . . . 0.548 ' HA ' ' HE3' ' A' ' 395' ' ' LYS . 0.7 OUTLIER -62.37 -47.4 84.34 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 120.86 0.362 . . . . 10.0 110.43 179.413 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -58.1 -46.32 85.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.465 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 10.5 m -65.21 -41.85 94.08 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.224 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 395' ' ' LYS . . . . . 0.548 ' HE3' ' HA ' ' A' ' 392' ' ' GLU . 50.5 mtmt . . . . . 0 C--O 1.234 0.237 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.631 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 82.1 mt . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 120.712 0.291 . . . . 10.0 110.24 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 81.5 mt -66.04 -42.81 89.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.699 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -46.46 85.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.453 0.644 . . . . 10.0 109.857 179.677 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 404' ' ' ASN . . . . . 0.447 ' O ' HG23 ' C' ' 408' ' ' VAL . 11.0 t-20 -62.92 -48.19 80.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.969 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 16.4 t90 -58.08 -37.74 75.05 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.104 -0.498 . . . . 10.0 112.173 -179.353 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -60.47 -41.39 94.09 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.071 0.462 . . . . 10.0 110.378 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 6.1 m -73.69 -19.93 60.68 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.595 -0.729 . . . . 10.0 110.623 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 408' ' ' VAL . . . . . 0.447 HG23 ' O ' ' C' ' 404' ' ' ASN . 54.6 t -74.19 -34.12 36.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.262 -0.644 . . . . 10.0 109.262 178.171 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.83 -39.37 83.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.188 178.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -44.46 84.3 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.176 -0.465 . . . . 10.0 109.949 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 411' ' ' THR . . . . . 0.658 HG22 ' HG2' ' A' ' 363' ' ' LYS . 2.2 p -66.49 -32.45 73.82 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.168 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.37 -39.32 92.13 Favored 'General case' 0 CA--C 1.521 -0.172 0 N-CA-C 108.494 -0.928 . . . . 10.0 108.494 177.687 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 413' ' ' SER . . . . . 0.437 ' C ' ' H ' ' C' ' 415' ' ' LEU . 73.5 m -64.9 -38.13 89.93 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 177.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -72.97 10.42 0.91 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.801 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 415' ' ' LEU . . . . . 0.437 ' H ' ' C ' ' C' ' 413' ' ' SER . 69.3 mt -124.78 -48.74 1.77 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.335 -0.987 . . . . 10.0 108.335 178.009 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -65.9 -49.69 67.14 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.231 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -69.14 -22.7 63.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.272 0.558 . . . . 10.0 109.883 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.93 -36.77 30.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.61 -0.723 . . . . 10.0 109.654 179.386 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 22.9 mt -60.69 -29.61 69.42 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.96 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -51.48 -73.85 0.34 Allowed Glycine 0 CA--C 1.519 0.332 0 C-N-CA 121.272 -0.49 . . . . 10.0 112.145 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.91 -36.06 98.85 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.629 2.219 . . . . 10.0 111.738 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 38.8 t -60.61 -49.8 82.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.795 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 23.9 p -70.89 -36.28 72.68 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.405 0.145 . . . . 10.0 110.728 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -55.94 -50.14 71.56 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.785 -0.821 . . . . 10.0 108.785 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 425' ' ' GLU . . . . . 0.717 ' HB3' ' HZ2' ' A' ' 352' ' ' LYS . 63.0 mt-10 -69.0 -40.76 78.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.18 -0.918 . . . . 10.0 109.93 178.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -58.54 -44.09 89.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.096 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 427' ' ' TRP . . . . . 0.483 ' O ' ' HG3' ' C' ' 431' ' ' GLU . 62.9 m95 -64.81 -38.93 92.63 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 178.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -63.53 -41.49 98.47 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.756 -0.831 . . . . 10.0 108.756 178.362 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 429' ' ' ASN . . . . . 0.675 ' HA ' ' HD2' ' C' ' 432' ' ' LYS . 23.6 t-20 -64.82 -43.66 92.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.337 -0.847 . . . . 10.0 109.463 178.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 33.4 mt -60.22 -35.06 74.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.052 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 431' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' C' ' 427' ' ' TRP . 51.2 mt-10 -65.94 -45.3 82.34 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 178.314 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 432' ' ' LYS . . . . . 0.675 ' HD2' ' HA ' ' C' ' 429' ' ' ASN . 32.0 mttt -57.35 -46.33 83.44 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 108.57 -0.9 . . . . 10.0 108.57 178.031 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 433' ' ' GLU . . . . . 0.496 ' OE2' ' HD3' ' A' ' 345' ' ' ARG . 5.9 mm-40 -60.11 -49.06 79.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.025 -0.988 . . . . 10.0 110.652 179.046 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 27.0 m -61.36 -44.75 96.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.438 -0.346 . . . . 10.0 111.002 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -64.79 -40.8 95.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.909 0.385 . . . . 10.0 110.215 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.94 -47.36 83.56 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.045 -1.222 . . . . 10.0 110.045 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 71.0 mt -60.71 -33.0 72.23 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -64.65 -48.79 73.53 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -62.99 -37.68 88.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.183 0.516 . . . . 10.0 110.08 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 440' ' ' GLU . . . . . 0.648 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 48.3 mt-10 -67.66 -55.75 12.04 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.685 -0.688 . . . . 10.0 110.38 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 71.6 mtm -68.13 -28.37 67.26 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 114.555 1.317 . . . . 10.0 114.555 -177.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.8 p -62.48 -43.6 98.41 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.013 -0.675 . . . . 10.0 109.642 179.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -78.22 -42.28 31.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.165 178.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 444' ' ' ASP . . . . . 0.466 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 2.9 t70 -57.62 -58.1 9.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.206 -0.906 . . . . 10.0 111.448 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 445' ' ' LEU . . . . . 0.433 ' O ' ' HG3' ' C' ' 449' ' ' LYS . 93.0 mt -64.39 -41.58 96.59 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.077 0.399 . . . . 10.0 112.077 -178.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -62.57 -48.17 80.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.027 0.441 . . . . 10.0 110.021 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -68.61 -25.17 64.73 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 179.074 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 448' ' ' VAL . . . . . 0.432 ' HB ' ' HA ' ' C' ' 445' ' ' LEU . 1.1 t -64.75 -42.84 96.08 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 N-CA-C 108.842 -0.799 . . . . 10.0 108.842 177.605 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 449' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' C' ' 445' ' ' LEU . 88.4 mttt -65.91 -34.53 78.33 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.225 -0.657 . . . . 10.0 109.225 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -81.0 0.21 36.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.4 -0.818 . . . . 10.0 111.265 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 451' ' ' LYS . . . . . 0.487 ' C ' ' HD2' ' C' ' 454' ' ' PRO . 56.7 mttm -117.47 -37.66 3.46 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.625 179.019 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 25.2 t -62.76 -41.41 92.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.28 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 453' ' ' GLN . . . . . 0.6 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 41.0 mt-30 -57.93 -58.52 18.01 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 116.665 -0.243 . . . . 10.0 110.701 178.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 454' ' ' PRO . . . . . 0.6 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 52.9 Cg_exo -60.32 -36.44 87.5 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 122.199 1.932 . . . . 10.0 110.931 178.092 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -60.9 -49.38 77.71 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.876 179.201 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 53.8 mt -70.54 -37.78 74.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.985 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -63.66 -47.61 80.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.096 0.474 . . . . 10.0 109.97 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 458' ' ' ASP . . . . . 0.75 ' HA ' ' HE3' ' C' ' 461' ' ' LYS . 28.5 t0 -68.73 -32.91 73.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.688 179.102 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -66.13 -42.75 88.69 Favored 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 108.446 -0.946 . . . . 10.0 108.446 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -62.74 -46.17 89.3 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.039 -0.726 . . . . 10.0 109.039 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 461' ' ' LYS . . . . . 0.75 ' HE3' ' HA ' ' C' ' 458' ' ' ASP . 12.9 mtmt -57.13 -42.42 80.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.604 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 13.7 mtmm -72.57 -40.55 66.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.358 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -22.3 65.01 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.882 179.401 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 464' ' ' GLN . . . . . 0.507 ' OE1' ' HA ' ' C' ' 461' ' ' LYS . 64.3 mt-30 -69.92 -44.2 70.12 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 107.949 -1.13 . . . . 10.0 107.949 177.18 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 1.262 ' O ' ' CG ' ' C' ' 469' ' ' LEU . 26.0 mt-10 -68.72 -32.07 71.59 Favored 'General case' 0 C--O 1.226 -0.165 0 N-CA-C 108.895 -0.78 . . . . 10.0 108.895 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -69.78 -55.27 10.31 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.564 -0.743 . . . . 10.0 109.989 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 45.1 tpp -61.26 -56.95 14.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.628 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -63.63 -40.69 97.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.642 0.258 . . . . 10.0 110.478 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 1.262 ' CG ' ' O ' ' C' ' 465' ' ' GLU . 96.4 mt -59.04 -47.4 85.35 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 115.836 -0.62 . . . . 20.0 110.438 179.087 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -68.02 -34.58 76.76 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.493 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -65.89 -43.61 87.78 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.21 -0.663 . . . . 10.0 109.21 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -69.24 -8.77 48.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.076 179.216 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 473' ' ' LYS . . . . . 0.812 ' HG2' HD13 ' A' ' 301' ' ' LEU . 92.5 mttt -101.99 -51.76 3.33 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.048 178.277 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 69.3 t -67.16 -39.87 84.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.599 -0.728 . . . . 10.0 112.876 -178.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -54.4 -58.88 11.92 Favored Pre-proline 0 N--CA 1.464 0.264 0 C-N-CA 120.916 -0.314 . . . . 10.0 111.693 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -68.64 -28.01 31.67 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 121.378 1.385 . . . . 10.0 110.555 178.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 477' ' ' LEU . . . . . 1.034 ' HG ' ' HE2' ' A' ' 297' ' ' LYS . 0.6 OUTLIER -65.76 -40.83 92.46 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.631 -0.507 . . . . 10.0 109.631 179.372 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 478' ' ' ARG . . . . . 0.644 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 17.7 ttm180 -62.95 -34.67 77.99 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.02 -0.733 . . . . 10.0 109.02 179.219 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -70.12 -49.55 49.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.004 -0.543 . . . . 10.0 109.948 178.465 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 480' ' ' GLU . . . . . 0.536 ' CD ' ' HZ3' ' A' ' 297' ' ' LYS . 23.8 mt-10 -62.83 -46.49 87.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.235 179.106 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 31.9 mt -66.08 -32.68 74.28 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.951 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 482' ' ' GLN . . . . . 0.644 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 4.2 tt0 -68.59 -41.46 79.59 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.685 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -70.43 -38.36 74.55 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 178.23 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -67.12 -32.89 81.63 Favored Glycine 0 N--CA 1.442 -0.909 0 N-CA-C 109.757 -1.337 . . . . 10.0 109.757 177.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 485' ' ' ALA . . . . . 0.59 ' HA ' ' HG2' ' C' ' 488' ' ' LYS . . . -73.09 -43.47 61.74 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 178.315 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 64.5 mtt180 -63.28 -38.65 91.99 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.847 -0.797 . . . . 10.0 108.847 178.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 -66.05 -50.41 64.24 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.49 177.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 488' ' ' LYS . . . . . 0.59 ' HG2' ' HA ' ' C' ' 485' ' ' ALA . 52.8 pttt -62.83 -32.7 73.96 Favored 'General case' 0 C--O 1.225 -0.193 0 O-C-N 123.292 0.37 . . . . 10.0 110.252 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 30.9 mt -69.56 -38.39 77.42 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -68.12 -41.97 80.91 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.204 -1.036 . . . . 10.0 108.204 177.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 491' ' ' GLU . . . . . 0.448 ' O ' ' HG3' ' C' ' 495' ' ' LYS . 36.6 mt-10 -61.27 -47.17 87.24 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.134 -0.939 . . . . 10.0 108.63 178.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 43.1 mt -65.79 -40.56 92.07 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.918 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -60.4 -45.5 93.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.013 0.435 . . . . 10.0 110.467 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -80.25 10.9 3.94 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.882 -179.559 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.641 ' HG2' HD22 ' A' ' 279' ' ' LEU . 12.5 mttm -120.13 -46.06 2.43 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.525 -0.761 . . . . 10.0 108.979 177.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 94.1 mt -69.67 -34.82 74.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.701 -0.681 . . . . 10.0 111.719 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 13.3 m -65.3 -58.25 12.75 Favored Pre-proline 0 CA--C 1.537 0.467 0 C-N-CA 120.682 -0.407 . . . . 10.0 111.297 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.56 -47.44 11.49 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 121.727 1.618 . . . . 10.0 111.588 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 499' ' ' LEU . . . . . 0.404 ' HA ' ' HB2' ' C' ' 502' ' ' GLU . 73.3 mt -66.63 -31.51 72.23 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-O 120.679 0.276 . . . . 10.0 111.213 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.29 -48.77 61.68 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 110.038 -1.225 . . . . 10.0 110.038 178.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -65.92 -39.88 90.94 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.244 -0.65 . . . . 10.0 109.244 178.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 502' ' ' GLU . . . . . 0.416 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 10.8 mt-10 -60.31 -52.79 63.77 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.602 178.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 503' ' ' MET . . . . . 0.658 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 42.8 mmm -57.95 -36.45 72.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.679 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 74.4 mtt180 -66.46 -43.48 85.39 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.898 -0.408 . . . . 10.0 109.898 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 505' ' ' ASP . . . . . 0.589 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 0.9 OUTLIER -66.73 -41.16 88.31 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 178.687 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.658 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 41.1 mtt180 -62.01 -42.98 99.74 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 178.281 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -63.79 -36.45 83.92 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.409 -0.814 . . . . 10.0 110.114 178.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 508' ' ' ARG . . . . . 0.589 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 67.5 mtt180 -62.58 -42.59 99.65 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.878 -0.786 . . . . 10.0 108.878 178.135 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -86.5 19.52 2.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.962 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -131.15 -53.43 1.04 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.996 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 86.5 t -68.12 -47.61 77.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.164 -0.471 . . . . 10.0 109.999 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.44 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 0.5 OUTLIER -66.23 -33.44 75.76 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 108.874 -0.788 . . . . 10.0 108.874 178.895 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -64.86 -50.07 68.06 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 107.671 -1.233 . . . . 10.0 107.671 177.36 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 21.2 mt -59.26 -35.52 73.85 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.736 178.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 515' ' ' ARG . . . . . 0.44 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 89.3 mtt180 -59.34 -53.75 54.6 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.779 -0.823 . . . . 10.0 108.779 177.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.59 14.56 0.99 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.608 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 517' ' ' HIS . . . . . 0.478 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 4.6 m-70 -126.43 -38.03 2.14 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 122.136 -0.353 . . . . 10.0 110.363 179.283 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 84.6 mt -87.69 -33.97 18.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.56 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -58.28 -57.88 22.99 Favored Pre-proline 0 C--N 1.33 -0.272 0 C-N-CA 121.174 -0.211 . . . . 10.0 111.499 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.61 -36.52 63.75 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 121.444 1.429 . . . . 10.0 110.613 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 521' ' ' TYR . . . . . 0.478 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 22.1 t80 -61.46 -46.46 89.95 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.895 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 522' ' ' SER . . . . . 0.424 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 6.3 p -67.6 -31.1 70.9 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.969 -0.382 . . . . 10.0 109.969 179.225 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -67.76 -41.92 82.58 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.884 -0.784 . . . . 10.0 108.884 178.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 524' ' ' GLU . . . . . 0.431 ' O ' ' HG3' ' C' ' 528' ' ' ARG . 4.3 mt-10 -67.12 -37.8 84.49 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 177.256 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 525' ' ' LEU . . . . . 0.472 HD23 ' HD2' ' C' ' 528' ' ' ARG . 21.3 mt -62.58 -32.26 73.22 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.401 -0.818 . . . . 10.0 109.809 178.11 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 526' ' ' ARG . . . . . 0.424 ' HG3' ' O ' ' C' ' 522' ' ' SER . 71.4 mtt180 -65.74 -37.99 87.89 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.386 -0.598 . . . . 10.0 109.386 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -68.64 -43.59 75.98 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.593 -0.891 . . . . 10.0 108.593 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 528' ' ' ARG . . . . . 0.472 ' HD2' HD23 ' C' ' 525' ' ' LEU . 80.8 mtt180 -61.54 -43.95 97.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.808 -1.087 . . . . 10.0 109.466 178.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 30.2 mt -65.16 -35.99 82.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.719 -0.673 . . . . 10.0 109.793 178.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.86 -46.65 86.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.095 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.66 -44.65 77.35 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.53 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 10.2 mtt180 -62.14 -46.0 90.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.672 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 47.9 mt -67.52 -32.69 73.66 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.505 -0.316 . . . . 10.0 110.537 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -64.68 -44.62 89.77 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.224 -0.658 . . . . 10.0 109.224 178.369 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.59 -41.53 96.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.428 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 83.9 mt -65.49 -28.97 69.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.67 178.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -77.57 -43.89 30.29 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.86 -0.422 . . . . 10.0 109.86 178.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -62.33 -48.58 79.19 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.714 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -71.21 -35.3 71.48 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 115.479 -0.782 . . . . 10.0 109.458 178.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 540' ' ' GLY . . . . . 0.41 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -60.27 -45.98 95.11 Favored Glycine 0 N--CA 1.445 -0.737 0 N-CA-C 111.279 -0.728 . . . . 10.0 111.279 178.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.85 99.69 Favored Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 111.048 -0.821 . . . . 10.0 111.048 179.255 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.81 -45.26 82.98 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 543' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' C' ' 543' ' ' ARG . 53.4 mtt180 -61.5 -39.7 91.9 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.715 179.314 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 544' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 75.4 mt -60.1 -42.26 94.29 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 178.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -68.51 -45.36 72.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.754 -0.657 . . . . 10.0 109.323 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.03 -51.88 67.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.522 -0.763 . . . . 10.0 110.208 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -60.45 -38.8 85.31 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.162 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -67.66 -41.72 83.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.054 0.454 . . . . 10.0 110.703 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.62 -50.54 64.66 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 550' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' C' ' 554' ' ' HIS . 0.0 OUTLIER -63.01 -32.96 74.44 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.885 179.567 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.21 -43.15 92.45 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.647 -0.501 . . . . 10.0 109.647 178.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 25.3 m -63.52 -45.0 92.62 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.489 -0.56 . . . . 10.0 109.489 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -64.41 -39.62 94.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.46 178.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 554' ' ' HIS . . . . . 0.456 ' HB2' ' O ' ' C' ' 550' ' ' LYS . 16.5 t-80 -64.3 -41.55 96.79 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.616 -0.72 . . . . 10.0 110.124 178.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 79.7 mt -68.6 -38.23 80.44 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.483 -0.326 . . . . 10.0 110.429 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 19.3 m -66.91 -39.05 87.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.396 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 3.2 p -73.95 -25.37 59.91 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.36 179.105 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 558' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' C' ' 554' ' ' HIS . 32.8 mt -75.84 -41.27 52.99 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 108.738 -0.838 . . . . 10.0 108.738 177.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 559' ' ' SER . . . . . 0.58 ' HA ' ' HB3' ' C' ' 562' ' ' ALA . 47.0 m -61.53 -25.95 67.62 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.526 -0.761 . . . . 10.0 110.819 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -61.29 -21.94 64.4 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.839 -0.619 . . . . 10.0 110.51 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -117.43 -21.72 8.52 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.886 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 562' ' ' ALA . . . . . 0.58 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -66.42 -21.72 66.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.87 179.376 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 563' ' ' LYS . . . . . 0.936 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 86.7 mttt -109.89 -67.59 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.596 178.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 564' ' ' PRO . . . . . 0.936 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 31.2 Cg_exo -61.25 -54.56 1.7 Allowed 'Trans proline' 0 C--N 1.357 0.982 0 C-N-CA 122.164 1.91 . . . . 10.0 113.098 -179.337 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 565' ' ' ALA . . . . . 0.422 ' O ' ' HG ' ' C' ' 569' ' ' LEU . . . -63.04 -44.64 95.32 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.925 -0.31 . . . . 10.0 111.685 -179.274 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 566' ' ' LEU . . . . . 0.451 HD23 ' HA ' ' C' ' 566' ' ' LEU . 4.1 mt -60.63 -40.94 93.81 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-O 120.756 0.312 . . . . 10.0 110.356 178.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 567' ' ' GLU . . . . . 0.712 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 20.0 mm-40 -64.79 -37.62 88.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.306 178.559 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.29 -39.96 78.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.942 178.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 569' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' C' ' 565' ' ' ALA . 78.2 mt -61.6 -44.7 96.52 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.25 -0.648 . . . . 10.0 109.25 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -65.0 -38.6 91.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.514 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 571' ' ' GLN . . . . . 0.712 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.3 mt-30 -70.05 -18.24 63.28 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.745 -0.661 . . . . 20.0 112.584 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -94.2 -35.55 5.99 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 108.961 -1.656 . . . . 10.0 108.961 178.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 573' ' ' LEU . . . . . 0.632 ' HA ' HG12 ' C' ' 576' ' ' VAL . 63.5 mt -67.51 -40.92 85.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.366 -0.417 . . . . 10.0 111.82 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 94.5 mt -53.79 -60.75 6.48 Favored Pre-proline 0 CA--C 1.534 0.364 0 N-CA-C 112.418 0.525 . . . . 10.0 112.418 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -66.34 -36.41 27.64 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 121.744 1.629 . . . . 10.0 112.401 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 576' ' ' VAL . . . . . 0.632 HG12 ' HA ' ' C' ' 573' ' ' LEU . 1.9 p -67.3 -37.43 79.05 Favored 'Isoleucine or valine' 0 C--N 1.34 0.165 0 C-N-CA 120.434 -0.506 . . . . 10.0 111.411 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 577' ' ' LEU . . . . . 0.489 ' O ' ' HG3' ' C' ' 581' ' ' LYS . 6.2 mt -63.31 -41.14 98.92 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.178 -0.675 . . . . 10.0 109.178 178.498 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 578' ' ' GLU . . . . . 0.473 ' O ' HG23 ' C' ' 582' ' ' VAL . 43.0 mt-10 -64.5 -45.45 87.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.515 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 3.9 p -67.28 -31.15 71.28 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 121.165 0.507 . . . . 10.0 110.14 178.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.06 -35.98 74.65 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.764 -0.828 . . . . 10.0 108.764 178.276 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 581' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' C' ' 577' ' ' LEU . 87.8 mttt -63.97 -37.92 89.19 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.383 178.409 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 582' ' ' VAL . . . . . 0.473 HG23 ' O ' ' C' ' 578' ' ' GLU . 58.4 t -62.59 -43.26 98.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 N-CA-C 108.895 -0.78 . . . . 10.0 108.895 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 8.6 m -66.07 -40.01 90.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.407 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -69.36 -48.61 60.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.109 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 585' ' ' LEU . . . . . 0.484 ' O ' ' HG3' ' C' ' 589' ' ' GLU . 76.9 mt -57.63 -47.79 81.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.626 -0.261 . . . . 10.0 110.706 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 25.9 p -61.45 -42.39 98.68 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -62.31 -44.0 97.53 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.235 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 91.5 mt -57.63 -44.98 85.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.471 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 589' ' ' GLU . . . . . 0.525 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 45.5 mt-10 -67.08 -53.14 33.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.977 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -58.09 -47.03 84.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.208 -0.451 . . . . 10.0 112.075 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -63.03 -43.68 98.05 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.355 0.502 . . . . 10.0 112.355 -179.574 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 10.2 p -65.11 -29.28 70.13 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.807 -0.357 . . . . 10.0 111.427 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 593' ' ' LYS . . . . . 0.525 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 89.6 mttt -68.67 -22.45 64.38 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.082 0.467 . . . . 10.0 110.371 178.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.06 -4.65 31.93 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.491 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 86.2 mt -95.68 -40.98 9.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.395 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 . . . . . 0 C--O 1.252 1.224 0 CA-C-O 118.411 -0.804 . . . . 10.0 110.468 -179.865 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 5.5 t . . . . . 0 N--CA 1.453 -0.319 0 CA-C-O 120.904 0.383 . . . . 10.0 110.602 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -86.97 118.96 26.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.236 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -108.58 120.02 41.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.021 0.438 . . . . 10.0 111.811 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 2.8 mtmt -109.59 116.2 31.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.53 179.318 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.539 HD22 HD23 ' B' ' 159' ' ' LEU . 45.3 mt -110.73 117.98 34.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.44 -0.345 . . . . 10.0 111.197 -178.655 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 47.6 t -104.69 118.19 51.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.026 0.441 . . . . 10.0 110.686 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 23.4 t -92.21 116.64 33.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 17.2 m -108.47 170.09 2.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.909 0.385 . . . . 10.0 111.256 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 150.39 170.95 18.2 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.901 -0.666 . . . . 10.0 111.581 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.454 ' O ' HG22 ' B' ' 14' ' ' VAL . . . -87.9 -174.24 4.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.878 0.371 . . . . 10.0 111.371 -179.42 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.38 141.58 21.43 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.004 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 108.6 -21.52 28.01 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.647 -0.787 . . . . 10.0 112.18 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' VAL . . . . . 0.51 HG23 ' HG3' ' B' ' 16' ' ' LYS . 21.9 m -80.04 162.4 3.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 120.938 0.399 . . . . 10.0 110.854 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -90.2 52.14 3.47 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.809 -0.71 . . . . 10.0 113.451 -179.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' LYS . . . . . 0.51 ' HG3' HG23 ' B' ' 14' ' ' VAL . 42.1 mtmt -60.73 -58.71 7.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.12 0.486 . . . . 10.0 110.34 179.39 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -65.93 -32.04 73.32 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.266 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.02 -50.21 69.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.908 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 86.0 mt -59.54 -42.27 91.94 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 121.03 0.443 . . . . 10.0 110.076 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' THR . . . . . 0.478 ' O ' HG12 ' B' ' 24' ' ' ILE . 14.4 m -61.37 -53.68 53.54 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.569 -0.741 . . . . 10.0 111.423 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 96.3 mt -61.43 -32.69 54.04 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-O 120.759 0.314 . . . . 10.0 111.115 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.67 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 7.4 tp-100 -67.09 -27.84 67.69 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.142 0.496 . . . . 10.0 110.62 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 23.6 tp -88.58 -33.32 17.73 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.827 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 24' ' ' ILE . . . . . 0.478 HG12 ' O ' ' B' ' 20' ' ' THR . 42.5 mm -81.1 -69.48 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.935 -179.319 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -84.17 -14.19 50.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.77 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.67 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 53.6 m-80 68.18 29.09 6.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.588 0.709 . . . . 10.0 109.129 -178.477 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 74.9 t60 -124.97 144.64 50.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.987 -1.006 . . . . 10.0 110.165 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -103.09 131.71 49.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.657 0.265 . . . . 10.0 110.899 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 4.3 m -91.84 125.76 44.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.144 178.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.35 -11.25 26.07 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.281 0.562 . . . . 10.0 110.689 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -87.5 146.13 25.95 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.877 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -88.5 64.83 7.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.963 0.411 . . . . 10.0 110.224 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.14 140.0 76.39 Favored Pre-proline 0 C--O 1.237 0.432 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.065 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -71.57 -179.51 3.77 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 122.777 2.318 . . . . 10.0 113.007 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 35' ' ' THR . . . . . 0.424 HG22 ' HA ' ' B' ' 59' ' ' ALA . 1.0 OUTLIER -166.9 136.0 2.85 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.846 179.745 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.784 HD11 HG21 ' D' ' 809' ' ' THR . 3.5 mt -117.21 -66.3 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.523 ' O ' HG23 ' D' ' 821' ' ' VAL . 2.8 tm-20 -147.79 94.92 2.42 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 179.138 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 38' ' ' ASP . . . . . 0.457 ' O ' HD12 ' B' ' 56' ' ' LEU . 25.1 m-20 -118.89 150.21 40.25 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.094 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.19 141.02 46.9 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.883 -0.327 . . . . 10.0 111.397 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 40' ' ' TYR . . . . . 0.673 ' CE2' HG22 ' D' ' 840' ' ' VAL . 30.1 m-85 -124.29 147.26 48.25 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.53 -0.304 . . . . 10.0 111.811 -178.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 41' ' ' ARG . . . . . 0.661 ' NH1' ' HB2' ' D' ' 817' ' ' LYS . 0.0 OUTLIER -125.11 136.44 53.64 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 112.891 0.7 . . . . 10.0 112.891 -178.856 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 42' ' ' LYS . . . . . 0.47 ' HD2' HD13 ' B' ' 24' ' ' ILE . 28.8 tttm -158.72 157.89 32.62 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.226 -0.897 . . . . 10.0 109.626 178.5 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -133.86 123.31 24.53 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.142 -0.318 . . . . 10.0 110.142 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 10.0 m -138.36 165.65 24.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.847 0.356 . . . . 10.0 111.101 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.729 HG22 ' HB ' ' B' ' 50' ' ' THR . 16.0 t -90.32 97.06 6.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.667 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 46' ' ' ILE . . . . . 0.575 HD11 HD11 ' B' ' 53' ' ' LEU . 46.1 mt -86.45 120.13 35.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.674 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 51.7 m-20 68.53 -67.26 0.21 Allowed 'General case' 0 N--CA 1.465 0.293 0 O-C-N 123.766 0.667 . . . . 10.0 111.291 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . -155.12 -12.25 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 121.039 -0.6 . . . . 10.0 112.871 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -121.81 132.99 54.9 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 117.145 0.472 . . . . 10.0 111.769 -179.435 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.729 ' HB ' HG22 ' B' ' 45' ' ' VAL . 9.9 t -79.83 130.76 35.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.993 -0.548 . . . . 10.0 110.605 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -142.45 150.79 41.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.888 0.375 . . . . 10.0 111.602 -179.428 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 26.6 tp -79.86 129.29 34.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.158 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.575 HD11 HD11 ' B' ' 46' ' ' ILE . 82.6 mt -111.99 123.03 49.38 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.939 -179.174 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -103.04 103.16 13.23 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.027 -1.101 . . . . 10.0 108.027 177.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.475 HD12 HD11 ' B' ' 24' ' ' ILE . 26.9 mt -92.94 138.86 19.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.959 -0.564 . . . . 10.0 111.502 -177.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.457 HD12 ' O ' ' B' ' 38' ' ' ASP . 37.2 tp -114.01 121.14 42.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.882 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.436 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 6.5 t70 -98.72 96.22 7.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.433 -0.803 . . . . 10.0 108.888 179.403 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 47.5 p -80.64 163.52 23.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.721 -0.672 . . . . 10.0 112.689 -178.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 59' ' ' ALA . . . . . 0.424 ' HA ' HG22 ' B' ' 35' ' ' THR . . . -66.73 158.37 30.39 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.734 -0.666 . . . . 10.0 111.102 179.402 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -83.62 -53.58 3.35 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.8 -0.714 . . . . 10.0 111.776 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -113.31 135.51 53.77 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.054 -0.35 . . . . 20.0 110.054 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -158.66 -178.26 7.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.687 0.279 . . . . 10.0 110.843 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -113.94 -91.77 0.5 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.153 0.501 . . . . 10.0 109.968 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -159.85 78.99 0.7 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.652 -0.704 . . . . 10.0 109.915 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 48.6 m -91.46 130.86 37.24 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.586 -0.734 . . . . 10.0 111.056 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.36 -34.5 73.96 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 121.245 0.545 . . . . 10.0 109.834 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 83.9 mmm -62.7 -40.29 96.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.412 -0.813 . . . . 10.0 109.81 178.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.65 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 0.4 OUTLIER -66.18 -44.97 82.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.437 179.793 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -58.4 -32.24 68.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.811 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -61.67 -58.36 8.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.998 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 71' ' ' TYR . . . . . 0.65 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 21.0 p90 -70.61 -11.95 61.26 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 113.146 0.795 . . . . 10.0 113.146 -178.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 66.3 mmm -75.6 -16.52 60.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.27 -0.423 . . . . 10.0 109.992 178.682 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 73' ' ' ARG . . . . . 0.718 ' HG2' ' HB ' ' B' ' 103' ' ' VAL . 20.0 mtt180 -95.18 -17.5 21.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.44 . . . . 10.0 111.245 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -87.18 13.33 9.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.319 -0.4 . . . . 10.0 111.68 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -104.73 138.25 14.06 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.61 -0.805 . . . . 10.0 111.656 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -91.38 -37.4 13.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.268 0.556 . . . . 10.0 110.74 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -132.09 143.55 15.14 Favored Glycine 0 N--CA 1.444 -0.782 0 N-CA-C 110.82 -0.912 . . . . 10.0 110.82 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -124.62 123.35 39.86 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.242 0.544 . . . . 10.0 112.111 -178.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.627 ' HG ' HD22 ' B' ' 159' ' ' LEU . 97.5 mt -92.18 115.77 28.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.602 -0.726 . . . . 10.0 109.666 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 80' ' ' CYS . . . . . 0.426 ' HB3' HD12 ' B' ' 93' ' ' ILE . 9.8 m -86.37 85.59 7.33 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.783 -0.451 . . . . 10.0 109.783 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 39.6 t -82.93 119.36 32.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.005 -0.543 . . . . 10.0 112.099 -178.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.795 ' HB3' HD11 ' B' ' 93' ' ' ILE . 19.3 p90 -133.81 135.34 43.75 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.047 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -79.07 128.46 33.3 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.652 -0.249 . . . . 10.0 110.437 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 84' ' ' ILE . . . . . 0.678 HD11 ' HA ' ' B' ' 118' ' ' CYS . 34.0 pt -70.89 -13.26 16.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.815 0.34 . . . . 10.0 111.899 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 85' ' ' ASN . . . . . 0.51 ' OD1' ' HD2' ' B' ' 117' ' ' LYS . 3.7 p-10 -94.17 -2.76 52.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.05 0.453 . . . . 10.0 110.023 179.419 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -126.25 102.51 7.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.034 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.29 -37.39 69.81 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.094 -0.503 . . . . 10.0 112.331 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 23.5 tptp -57.87 -34.94 70.3 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 111.928 0.344 . . . . 10.0 111.928 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 62.1 m -66.56 -35.63 80.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.652 -0.249 . . . . 10.0 111.015 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -68.22 -39.18 82.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.246 0.546 . . . . 10.0 109.971 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -73.55 -34.42 65.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.922 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.84 -14.02 62.62 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.959 -0.564 . . . . 10.0 111.965 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 93' ' ' ILE . . . . . 0.795 HD11 ' HB3' ' B' ' 82' ' ' PHE . 32.9 mm -58.6 -42.48 84.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.903 0.382 . . . . 10.0 110.322 179.417 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -66.7 -32.49 73.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.252 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -66.98 -38.14 85.51 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.193 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -80.41 -32.27 37.51 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.123 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -56.96 -48.03 79.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.766 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -65.78 -35.74 81.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.224 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -62.05 -44.55 96.45 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.476 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 53.0 mt -66.86 -39.21 83.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.277 0.561 . . . . 10.0 110.337 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 101' ' ' LYS . . . . . 0.672 ' HE3' ' HG2' ' B' ' 107' ' ' GLU . 45.2 mtpt -68.54 -20.95 64.58 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.465 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 1.6 ttp-105 -84.48 -38.94 19.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.607 -0.27 . . . . 10.0 111.589 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.718 ' HB ' ' HG2' ' B' ' 73' ' ' ARG . 34.7 m -71.79 -26.02 25.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 112.391 0.515 . . . . 10.0 112.391 -179.211 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.444 ' HG2' HG23 ' B' ' 103' ' ' VAL . 66.5 mmtt -107.27 -9.6 16.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.447 179.46 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 5.8 t70 54.06 38.15 28.4 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.514 -0.766 . . . . 10.0 112.351 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 22.7 t -156.49 156.66 34.1 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.421 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 107' ' ' GLU . . . . . 0.672 ' HG2' ' HE3' ' B' ' 101' ' ' LYS . 24.9 mt-10 -95.42 -17.17 21.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.051 -0.522 . . . . 10.0 109.647 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 108' ' ' ASP . . . . . 0.43 ' OD1' ' HE2' ' B' ' 169' ' ' LYS . 12.8 t70 -85.71 74.78 10.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.352 -0.84 . . . . 10.0 110.298 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 44.4 t -129.37 132.82 24.52 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.795 -0.639 . . . . 10.0 109.903 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -64.04 103.3 0.41 Allowed 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.935 2.424 . . . . 10.0 112.241 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 111' ' ' MET . . . . . 0.402 ' HB2' HG21 ' B' ' 139' ' ' ILE . 38.3 mtt -126.29 153.27 45.03 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.305 -0.628 . . . . 10.0 109.305 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 112' ' ' VAL . . . . . 0.458 ' HB ' HD23 ' B' ' 79' ' ' LEU . 96.9 t -135.5 130.56 50.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 18.2 tp -80.75 114.42 19.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.496 -0.927 . . . . 10.0 108.496 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 19.4 t -111.66 110.83 33.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.073 0.463 . . . . 10.0 112.185 -177.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -82.75 136.19 15.0 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 109.011 -1.635 . . . . 10.0 109.011 177.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -121.55 153.52 37.89 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 117.557 0.679 . . . . 10.0 112.366 -178.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 117' ' ' LYS . . . . . 0.51 ' HD2' ' OD1' ' B' ' 85' ' ' ASN . 90.4 mttt 69.65 44.19 0.91 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.256 -0.884 . . . . 10.0 112.615 178.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 118' ' ' CYS . . . . . 0.678 ' HA ' HD11 ' B' ' 84' ' ' ILE . 18.7 p -79.58 -4.12 50.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.376 0.608 . . . . 10.0 110.172 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -93.39 1.31 56.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.342 -0.845 . . . . 10.0 110.19 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 120' ' ' LEU . . . . . 0.412 HD12 ' HB3' ' B' ' 117' ' ' LYS . 40.5 mt -99.92 141.5 22.88 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.172 -0.467 . . . . 10.0 109.741 178.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -81.19 7.99 4.63 Favored 'Trans proline' 0 CA--C 1.529 0.25 0 C-N-CA 122.701 2.267 . . . . 10.0 112.284 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.49 35.43 1.64 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.943 0.402 . . . . 10.0 111.042 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 4.7 ttt180 -60.92 105.28 0.45 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.136 0.493 . . . . 10.0 112.296 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.1 m -94.56 -41.62 9.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.902 -0.59 . . . . 10.0 109.617 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 38.3 t -93.93 111.24 24.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.695 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.16 158.08 36.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.055 0.455 . . . . 10.0 111.272 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 127' ' ' THR . . . . . 0.503 ' O ' ' HG3' ' B' ' 131' ' ' GLN . 0.2 OUTLIER -56.93 -40.11 75.74 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.768 -0.651 . . . . 10.0 112.381 -179.373 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 19.8 tptt -59.85 -46.41 89.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.497 0.189 . . . . 10.0 111.239 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -55.67 -43.12 76.05 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.205 0.526 . . . . 10.0 110.438 178.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.48 -44.32 83.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.545 -0.752 . . . . 10.0 111.539 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.503 ' HG3' ' O ' ' B' ' 127' ' ' THR . 71.1 mt-30 -64.61 -35.13 79.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.802 0.334 . . . . 10.0 110.992 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -61.05 -49.72 76.23 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.74 -0.663 . . . . 10.0 110.656 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 13.7 tp -67.24 -42.2 84.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.766 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.23 74.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.673 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 21.5 tpt180 -60.3 -38.24 83.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.354 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 38.2 m -70.79 -24.57 62.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.655 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -93.72 -7.97 42.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.019 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 72.25 26.78 71.32 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.825 -0.625 . . . . 10.0 111.697 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 139' ' ' ILE . . . . . 0.402 HG21 ' HB2' ' B' ' 111' ' ' MET . 47.7 pt -122.83 149.76 57.11 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.668 0.27 . . . . 10.0 110.672 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -77.34 151.81 29.94 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.629 2.219 . . . . 10.0 111.602 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -111.78 126.83 55.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.367 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 41.3 mm -126.22 126.18 68.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.061 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 143' ' ' GLU . . . . . 0.537 ' HG2' ' HB3' ' B' ' 118' ' ' CYS . 4.0 tt0 -90.46 125.3 35.53 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 144' ' ' THR . . . . . 0.638 ' HA ' ' O ' ' B' ' 150' ' ' GLN . 74.0 p -132.29 160.26 36.73 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.662 0.986 . . . . 10.0 113.662 -177.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -155.36 123.68 5.9 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.224 -1.353 . . . . 10.0 107.98 178.096 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -74.28 -30.39 62.08 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.344 0.498 . . . . 10.0 112.344 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 33.1 tttp -64.93 -45.92 83.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.485 -0.325 . . . . 10.0 111.458 -179.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.75 -0.93 36.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.956 -179.52 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 149' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' B' ' 149' ' ' ARG . 16.9 ttt85 57.28 47.49 16.71 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.426 0.631 . . . . 10.0 110.924 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 150' ' ' GLN . . . . . 0.638 ' O ' ' HA ' ' B' ' 144' ' ' THR . 33.8 tp60 -83.53 106.52 15.33 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.054 -179.297 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 59.05 22.13 54.6 Favored Glycine 0 CA--C 1.52 0.377 0 N-CA-C 114.742 0.657 . . . . 10.0 114.742 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 60.9 t -64.69 -48.28 85.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 117.273 0.536 . . . . 10.0 110.23 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -64.49 -46.36 83.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.186 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -63.61 -31.23 72.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.57 -0.741 . . . . 10.0 112.525 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.68 -44.12 85.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.069 0.462 . . . . 10.0 110.444 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -72.02 -37.31 69.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.55 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -64.47 -40.44 95.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.969 0.414 . . . . 10.0 110.782 179.659 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 46.9 m -61.54 -40.56 95.14 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.004 179.055 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.627 HD22 ' HG ' ' B' ' 79' ' ' LEU . 30.9 tp -62.17 -45.57 92.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.396 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 160' ' ' VAL . . . . . 0.485 HG21 HD13 ' B' ' 46' ' ' ILE . 89.7 t -60.21 -41.97 88.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.308 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 67.6 mtm-85 -62.66 -37.92 88.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.108 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -67.71 -39.09 84.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.914 0.388 . . . . 10.0 110.284 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 163' ' ' ILE . . . . . 0.534 HG22 ' HE2' ' B' ' 167' ' ' LYS . 71.7 mt -66.75 -39.57 83.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 178.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -61.99 -42.74 99.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.183 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 21.9 mtmm -67.68 -32.68 73.51 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.123 179.074 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 -61.99 -45.61 92.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.355 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 167' ' ' LYS . . . . . 0.534 ' HE2' HG22 ' B' ' 163' ' ' ILE . 59.1 mttm -63.8 -36.14 82.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.479 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -63.24 -41.83 99.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.781 -0.645 . . . . 10.0 109.397 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 169' ' ' LYS . . . . . 0.43 ' HE2' ' OD1' ' B' ' 108' ' ' ASP . 56.7 tttp -68.34 -39.71 81.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.965 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 97.2 mtp -65.15 -20.81 66.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.969 0.414 . . . . 10.0 111.524 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 13.5 m . . . . . 0 C--N 1.325 -0.488 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.735 179.795 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.248 0 N-CA-C 112.031 -0.427 . . . . 10.0 112.031 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' D' D ' 809' ' ' THR . . . . . 0.784 HG21 HD11 ' B' ' 36' ' ' ILE . 9.6 p -136.97 146.73 45.74 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.707 0.289 . . . . 10.0 110.958 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 810' ' ' VAL . . . . . 0.424 HG23 HG22 ' D' ' 824' ' ' VAL . 92.5 t -106.74 133.15 52.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.283 -0.417 . . . . 10.0 109.888 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 811' ' ' LYS . . . . . 0.417 ' HB2' ' HG3' ' D' ' 874' ' ' GLU . 7.2 mtmp? -85.98 106.87 17.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.285 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 46.9 t -95.84 124.21 48.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.334 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -101.56 130.93 47.96 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.969 -0.382 . . . . 10.0 109.969 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 45.2 mt -103.42 155.98 36.08 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.555 -178.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 815' ' ' PRO . . . . . 0.499 ' HB3' ' HA ' ' D' ' 878' ' ' GLU . 74.4 Cg_endo -74.58 53.38 3.13 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 123.424 2.75 . . . . 10.0 112.036 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -152.63 31.86 0.51 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 817' ' ' LYS . . . . . 0.661 ' HB2' ' NH1' ' B' ' 41' ' ' ARG . 88.4 mttt 53.96 32.54 15.56 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 114.675 -1.148 . . . . 10.0 111.439 -179.293 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 818' ' ' GLN . . . . . 0.409 HE22 ' C ' ' B' ' 40' ' ' TYR . 73.5 mt-30 -136.99 -179.2 5.56 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 114.13 1.159 . . . . 10.0 114.13 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.02 171.44 15.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.16 -0.927 . . . . 10.0 112.178 -178.377 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 45.2 m -155.01 131.52 10.51 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.623 -1.251 . . . . 10.0 107.623 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 821' ' ' VAL . . . . . 0.684 HG12 ' HB ' ' D' ' 809' ' ' THR . 4.0 t -97.28 113.26 31.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 120.562 -0.455 . . . . 10.0 111.081 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 26.1 t -105.61 137.82 33.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.883 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 823' ' ' THR . . . . . 0.743 ' HA ' HG22 ' D' ' 809' ' ' THR . 1.2 m -72.95 144.62 47.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.766 179.482 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 824' ' ' VAL . . . . . 0.424 HG22 HG23 ' D' ' 810' ' ' VAL . 45.2 t -76.19 119.47 24.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.552 -0.295 . . . . 10.0 110.403 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -114.08 130.42 56.57 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.917 0.389 . . . . 10.0 111.063 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -75.28 129.86 38.13 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.979 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 82.88 2.2 90.65 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.971 -0.558 . . . . 10.0 112.582 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 7.1 ttt -89.44 126.97 35.78 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 122.726 -0.279 . . . . 10.0 110.39 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 829' ' ' SER . . . . . 0.644 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 1.0 OUTLIER -82.11 150.68 27.36 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.391 -0.226 . . . . 10.0 110.391 179.592 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 92.9 t -54.05 -38.85 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 O-C-N 123.228 0.33 . . . . 10.0 110.885 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 831' ' ' TYR . . . . . 0.614 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 80.8 t80 -57.13 -31.05 64.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.319 -0.4 . . . . 10.0 111.396 179.519 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -82.98 -45.67 13.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.509 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.33 -42.68 78.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.031 0.443 . . . . 10.0 111.352 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 834' ' ' LEU . . . . . 0.482 HD13 ' HB3' ' D' ' 837' ' ' ALA . 1.3 mm? -80.28 -8.57 59.53 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.855 -179.252 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 835' ' ' ASP . . . . . 0.608 ' O ' ' HG2' ' D' ' 839' ' ' LYS . 29.7 t70 -61.45 -61.19 2.71 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 110.051 -0.352 . . . . 10.0 110.051 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 39.3 mttt -62.77 -29.81 70.98 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.885 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 837' ' ' ALA . . . . . 0.482 ' HB3' HD13 ' D' ' 834' ' ' LEU . . . -69.05 -25.77 64.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.942 0.401 . . . . 10.0 110.762 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 838' ' ' LEU . . . . . 0.579 HD12 ' HG3' ' D' ' 845' ' ' GLN . 40.0 mt -93.07 -44.3 8.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.149 179.307 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 839' ' ' LYS . . . . . 0.608 ' HG2' ' O ' ' D' ' 835' ' ' ASP . 10.5 mmtt -61.27 -23.63 65.81 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.668 179.625 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 840' ' ' VAL . . . . . 0.673 HG22 ' CE2' ' B' ' 40' ' ' TYR . 1.4 p -49.66 -20.88 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 N-CA-C 112.916 0.71 . . . . 10.0 112.916 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 841' ' ' ARG . . . . . 0.43 ' HG3' ' HG ' ' D' ' 843' ' ' LEU . 13.9 ptp180 -140.59 23.17 2.31 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.368 0.604 . . . . 10.0 111.721 177.645 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 75.59 28.41 61.4 Favored Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 115.601 -0.727 . . . . 10.0 114.654 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 843' ' ' LEU . . . . . 0.43 ' HG ' ' HG3' ' D' ' 841' ' ' ARG . 96.6 mt -92.4 154.26 18.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 117.598 0.699 . . . . 10.0 110.215 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -121.68 143.28 49.44 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.815 0.341 . . . . 10.0 111.602 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 845' ' ' GLN . . . . . 0.579 ' HG3' HD12 ' D' ' 838' ' ' LEU . 21.5 mp0 -60.64 -28.69 68.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.813 -0.63 . . . . 10.0 111.822 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -76.81 -4.34 43.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.468 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 2.2 t -131.95 18.16 4.61 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 120.966 0.412 . . . . 10.0 110.972 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 79.6 m -142.65 153.29 43.3 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.485 -0.325 . . . . 10.0 110.472 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 14.6 p -130.6 141.81 45.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.42 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 850' ' ' VAL . . . . . 0.449 HG21 ' HG ' ' D' ' 834' ' ' LEU . 26.0 t -109.75 122.96 65.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.351 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 851' ' ' TYR . . . . . 0.602 ' HE1' HG22 ' D' ' 860' ' ' VAL . 48.9 m-85 -103.8 142.85 33.66 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.953 179.662 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 42.3 mmm-85 -82.89 164.78 20.27 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.333 -0.849 . . . . 10.0 109.819 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 853' ' ' LEU . . . . . 0.566 HD13 HD11 ' D' ' 876' ' ' ILE . 16.2 tp -124.52 62.07 1.13 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.469 0.652 . . . . 10.0 110.551 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 44.3 mt -84.4 102.25 10.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.28 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp 61.44 17.07 8.07 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.431 -0.804 . . . . 10.0 112.194 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 105.05 -18.32 42.99 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.94 -0.648 . . . . 10.0 112.412 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -81.35 138.45 35.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.968 0.413 . . . . 10.0 110.897 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 858' ' ' LYS . . . . . 0.447 ' HE3' ' CD1' ' D' ' 876' ' ' ILE . 12.5 mptt -88.34 122.36 31.77 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.466 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 3.7 m -122.53 136.1 54.8 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.037 -0.529 . . . . 10.0 109.787 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 860' ' ' VAL . . . . . 0.602 HG22 ' HE1' ' D' ' 851' ' ' TYR . 6.4 t -75.74 123.91 32.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 110.391 -0.225 . . . . 10.0 110.391 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 3.2 t -104.6 160.7 14.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.544 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -99.1 149.63 22.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.569 -0.287 . . . . 10.0 110.914 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 863' ' ' TRP . . . . . 0.614 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 99.4 m95 -70.55 -27.42 64.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.924 -179.142 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.16 1.61 39.63 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.532 0.567 . . . . 10.0 112.532 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 23.5 m -84.98 148.2 26.32 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 179.003 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 866' ' ' ALA . . . . . 0.644 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -82.48 150.33 27.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.026 0.441 . . . . 10.0 111.622 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 867' ' ' ILE . . . . . 0.475 HD12 HD13 ' D' ' 870' ' ' LEU . 8.8 tp -84.7 -10.32 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.845 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 868' ' ' ALA . . . . . 0.618 ' HB3' ' HD3' ' D' ' 869' ' ' PRO . . . -58.11 -55.6 43.64 Favored Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 113.024 0.75 . . . . 10.0 113.024 -179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 869' ' ' PRO . . . . . 0.618 ' HD3' ' HB3' ' D' ' 868' ' ' ALA . 3.4 Cg_exo -77.81 13.21 1.74 Allowed 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 122.345 2.03 . . . . 10.0 112.161 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 870' ' ' LEU . . . . . 0.475 HD13 HD12 ' D' ' 867' ' ' ILE . 0.2 OUTLIER -103.83 -8.0 20.1 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.094 -0.503 . . . . 10.0 109.983 179.785 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -58.01 127.28 31.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.78 -0.646 . . . . 10.0 111.285 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 121.85 -16.43 8.87 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.479 -0.867 . . . . 10.0 113.402 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -126.95 -170.58 2.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.11 0.455 . . . . 10.0 112.115 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 874' ' ' GLU . . . . . 0.417 ' HG3' ' HB2' ' D' ' 811' ' ' LYS . 4.4 mp0 -113.26 170.24 8.37 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.991 -0.549 . . . . 10.0 110.784 -178.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 36.8 mt -130.83 129.74 42.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.671 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 876' ' ' ILE . . . . . 0.566 HD11 HD13 ' D' ' 853' ' ' LEU . 17.5 mt -114.38 112.73 41.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.312 -179.568 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 877' ' ' VAL . . . . . 0.516 HG11 HD21 ' D' ' 838' ' ' LEU . 24.4 t -97.74 137.08 26.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 120.728 0.299 . . . . 10.0 110.615 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 878' ' ' GLU . . . . . 0.499 ' HA ' ' HB3' ' D' ' 815' ' ' PRO . 0.0 OUTLIER -140.55 171.05 14.66 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.091 -0.504 . . . . 10.0 109.909 179.233 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 5.8 m -105.11 149.15 8.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.076 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 92.3 mt . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.739 -0.648 . . . . 10.0 111.495 -179.197 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 239' ' ' LEU . . . . . 0.5 ' HA ' ' HB2' ' A' ' 242' ' ' GLU . 94.3 mt . . . . . 0 C--O 1.223 -0.319 0 CA-C-O 120.527 0.204 . . . . 10.0 111.167 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 49.2 mtt180 -66.18 -41.13 90.7 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.484 -0.562 . . . . 10.0 109.484 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -78.52 -25.01 45.46 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.259 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 242' ' ' GLU . . . . . 0.5 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 8.1 mt-10 -76.68 -62.62 1.57 Allowed 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.473 -0.785 . . . . 10.0 110.199 178.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 243' ' ' MET . . . . . 0.593 ' HA ' ' HB3' ' A' ' 246' ' ' ASP . 93.1 mmm -56.79 -30.56 63.8 Favored 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 113.25 0.833 . . . . 10.0 113.25 -178.502 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 3.1 p -63.38 -50.97 67.82 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.404 -0.518 . . . . 10.0 109.761 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -74.98 -33.1 61.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.044 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 246' ' ' ASP . . . . . 0.593 ' HB3' ' HA ' ' A' ' 243' ' ' MET . 11.6 t70 -59.74 -59.38 5.53 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.125 178.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.25 -35.42 78.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.878 -0.601 . . . . 10.0 111.114 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -61.89 -45.82 92.09 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 120.67 0.271 . . . . 10.0 110.585 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -72.19 -38.36 69.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.05 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 250' ' ' VAL . . . . . 0.645 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 41.3 t -61.81 -39.33 83.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.92 -0.4 . . . . 10.0 109.92 178.429 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -75.29 -46.61 32.4 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.869 0.366 . . . . 10.0 110.769 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.33 74.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.526 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -90.2 -20.08 23.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.327 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.645 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -62.23 -29.9 47.67 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.206 0 N-CA-C 109.997 -0.371 . . . . 10.0 109.997 179.317 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -64.2 3.36 Favored Pre-proline 0 C--O 1.219 -0.513 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.147 178.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -59.87 -31.76 94.29 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 121.73 1.62 . . . . 10.0 111.548 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -61.21 -57.7 11.35 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.008 0.432 . . . . 10.0 109.895 178.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 96.3 mt -73.1 -38.56 66.3 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.822 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -58.42 -49.18 78.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.761 0.315 . . . . 10.0 110.448 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.48 -45.53 92.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.839 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 261' ' ' PHE . . . . . 0.403 ' HD1' ' HA ' ' A' ' 261' ' ' PHE . 6.1 m-85 -63.72 -37.56 87.83 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 116.059 -0.518 . . . . 10.0 111.106 179.33 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -69.6 -39.94 76.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.682 0.277 . . . . 10.0 110.266 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 48.7 mttp -64.27 -42.88 96.24 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 177.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.479 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 14.1 mptt -65.05 -44.5 88.8 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 178.167 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 6.7 t90 -60.6 -36.62 79.01 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.685 -0.689 . . . . 10.0 110.24 179.555 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -61.99 -49.89 74.27 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.733 -0.84 . . . . 10.0 108.733 178.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -59.85 -43.79 94.45 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.753 -0.658 . . . . 10.0 109.344 178.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 268' ' ' GLU . . . . . 0.479 ' HG3' ' O ' ' A' ' 264' ' ' LYS . 27.4 mt-10 -61.09 -47.24 87.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.596 -0.729 . . . . 10.0 111.258 179.766 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 95.6 mmm -71.43 -43.66 66.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.811 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -61.61 -48.16 82.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.903 0.382 . . . . 10.0 110.248 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 69.4 mt -67.23 -23.59 65.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.5 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 272' ' ' TYR . . . . . 0.455 ' O ' HG23 ' A' ' 276' ' ' VAL . 0.1 OUTLIER -74.75 -51.51 13.98 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 177.971 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 45.0 mtt85 -60.4 -41.28 93.54 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.668 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.05 -20.54 58.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.611 -0.722 . . . . 10.0 111.063 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.666 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 47.5 mttp -103.19 -41.09 6.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.643 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 276' ' ' VAL . . . . . 0.568 ' O ' ' HB2' ' A' ' 280' ' ' ARG . 38.5 t -47.11 -43.18 7.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 112.432 0.531 . . . . 10.0 112.432 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 63.9 mt-10 -64.3 -63.78 3.45 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 112.755 0.65 . . . . 10.0 112.755 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.37 -36.15 88.27 Favored 'Trans proline' 0 C--N 1.357 0.982 0 C-N-CA 121.807 1.671 . . . . 10.0 111.998 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.681 HD22 ' HE2' ' C' ' 495' ' ' LYS . 23.1 mt -67.63 -31.57 71.68 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 110.005 -0.368 . . . . 10.0 110.005 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 280' ' ' ARG . . . . . 0.568 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 5.9 mtt180 -72.89 -35.85 67.19 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -58.96 -46.66 87.5 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.5 -0.555 . . . . 10.0 109.5 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -65.0 -40.63 95.23 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 178.674 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -43.41 97.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.42 -0.809 . . . . 10.0 109.696 179.327 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 284' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 280' ' ' ARG . 79.0 mt-30 -69.6 -44.93 69.74 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.536 179.577 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -60.79 -49.73 76.3 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 110.177 -0.305 . . . . 10.0 110.177 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -59.47 -42.43 97.58 Favored Glycine 0 N--CA 1.443 -0.843 0 N-CA-C 110.863 -0.895 . . . . 10.0 110.863 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -66.1 -44.58 83.94 Favored 'General case' 0 C--O 1.223 -0.334 0 O-C-N 123.539 0.199 . . . . 10.0 110.814 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 37.1 mtt180 -58.89 -46.74 87.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.906 0.384 . . . . 10.0 110.194 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -61.72 -47.55 84.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.525 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 290' ' ' LYS . . . . . 0.518 ' HE3' ' HA2' ' C' ' 484' ' ' GLY . 0.1 OUTLIER -59.97 -44.06 94.71 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.266 179.306 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 291' ' ' LEU . . . . . 0.478 ' O ' ' HG3' ' A' ' 295' ' ' GLN . 77.0 mt -60.25 -40.23 89.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.275 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -64.62 -47.68 77.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.015 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -64.52 -31.0 72.03 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.072 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 39.6 mt -72.2 -40.97 67.48 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.881 -0.6 . . . . 10.0 109.575 178.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 295' ' ' GLN . . . . . 0.478 ' HG3' ' O ' ' A' ' 291' ' ' LEU . 69.2 mt-30 -60.55 -36.18 77.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.234 0.54 . . . . 10.0 109.666 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -72.4 3.77 4.44 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.667 179.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 297' ' ' LYS . . . . . 0.6 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 45.2 mttp -126.24 -24.69 3.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.567 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 82.6 mt -76.54 -33.08 58.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.631 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 299' ' ' SER . . . . . 0.778 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 4.5 m -89.66 -61.6 0.22 Allowed Pre-proline 0 CA--C 1.538 0.513 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.815 179.128 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 300' ' ' PRO . . . . . 0.778 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 52.7 Cg_exo -59.05 -63.86 0.12 Allowed 'Trans proline' 0 C--N 1.357 0.986 0 C-N-CA 122.4 2.067 . . . . 10.0 112.244 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.6 ' HB2' ' O ' ' A' ' 297' ' ' LYS . 88.4 mt -63.17 -25.86 68.54 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.414 179.293 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -68.17 -49.03 49.43 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 110.1 -1.2 . . . . 10.0 110.1 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -63.44 -35.75 81.47 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.912 -0.403 . . . . 10.0 109.912 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -64.3 -45.12 89.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.095 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.7 ttt -67.47 -33.77 75.79 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.094 -0.706 . . . . 10.0 109.094 178.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 306' ' ' ARG . . . . . 0.471 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 95.3 mtt180 -64.19 -44.2 92.72 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.165 -0.68 . . . . 10.0 109.165 178.038 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 307' ' ' ASP . . . . . 0.428 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 18.4 t70 -65.58 -42.42 91.78 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.269 179.262 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 308' ' ' ARG . . . . . 1.103 ' HG3' HD21 ' C' ' 469' ' ' LEU . 11.4 mmt180 -62.6 -37.57 86.76 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 178.156 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 309' ' ' ALA . . . . . 0.533 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -67.22 -35.99 80.76 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 115.844 -0.616 . . . . 10.0 109.713 178.101 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 310' ' ' ARG . . . . . 0.471 ' HG3' ' O ' ' A' ' 306' ' ' ARG . 54.5 mtt180 -60.92 -50.86 71.71 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.72 -0.844 . . . . 10.0 108.72 178.461 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.33 -37.51 87.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.741 178.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 312' ' ' HIS . . . . . 0.681 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 0.3 OUTLIER -57.85 -55.29 36.81 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.202 178.758 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 87.5 t -71.28 -40.04 73.34 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.264 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.608 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 314' ' ' ASP . . . . . 0.639 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 36.7 t70 -60.57 -47.82 84.5 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.978 -0.289 . . . . 10.0 110.366 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -64.95 -28.32 69.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.358 0.599 . . . . 10.0 109.398 178.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 316' ' ' LEU . . . . . 0.537 ' HG ' ' HE3' ' C' ' 462' ' ' LYS . 8.9 mt -71.2 -39.88 71.52 Favored 'General case' 0 C--O 1.216 -0.698 0 N-CA-C 108.744 -0.836 . . . . 10.0 108.744 177.881 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 317' ' ' ARG . . . . . 0.639 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 81.5 mtt180 -61.45 -43.92 98.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.356 -0.383 . . . . 10.0 110.398 179.524 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -15.66 63.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.847 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -106.17 -39.08 6.07 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.504 -0.317 . . . . 10.0 111.756 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 50.2 mt -60.15 -36.25 77.11 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 122.251 0.22 . . . . 10.0 111.132 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 321' ' ' ALA . . . . . 0.401 ' HB3' ' CD ' ' A' ' 322' ' ' PRO . . . -60.75 -62.06 6.72 Favored Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.657 179.064 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 322' ' ' PRO . . . . . 0.401 ' CD ' ' HB3' ' A' ' 321' ' ' ALA . 15.7 Cg_endo -60.78 -33.83 92.41 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.709 1.606 . . . . 10.0 110.899 178.028 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 323' ' ' TYR . . . . . 0.473 ' O ' ' HG ' ' A' ' 327' ' ' LEU . 6.7 m-30 -60.33 -49.77 76.26 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 178.632 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 32.6 m -66.59 -37.77 85.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.172 179.362 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 325' ' ' ASP . . . . . 0.525 ' O ' ' HG3' ' A' ' 329' ' ' GLN . 0.8 OUTLIER -65.41 -41.26 93.78 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.919 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 326' ' ' GLU . . . . . 0.483 ' HB3' ' OE1' ' C' ' 447' ' ' GLU . 56.5 mt-10 -66.0 -37.38 85.79 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.778 -0.823 . . . . 10.0 108.778 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 327' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 323' ' ' TYR . 51.4 mt -61.77 -37.08 82.98 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.03 178.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -64.32 -40.79 96.61 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 329' ' ' GLN . . . . . 0.525 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 77.8 mt-30 -62.16 -42.67 99.48 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 178.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 330' ' ' ARG . . . . . 0.645 ' O ' ' HG2' ' A' ' 334' ' ' ARG . 59.8 mtt180 -65.48 -50.6 64.74 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 115.512 -0.767 . . . . 10.0 109.671 178.324 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 331' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 331' ' ' LEU . 1.9 mm? -55.87 -40.5 73.02 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.923 -0.581 . . . . 10.0 110.587 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.24 -45.46 94.42 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -64.42 -45.83 85.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.267 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 334' ' ' ARG . . . . . 0.694 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 7.6 mmt85 -61.35 -46.19 91.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.54 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 335' ' ' LEU . . . . . 0.435 ' O ' ' HG3' ' A' ' 339' ' ' LYS . 64.5 mt -62.18 -41.99 98.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.962 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -61.08 -42.38 98.4 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 178.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.26 -40.39 86.2 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 338' ' ' LEU . . . . . 0.584 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 78.2 mt -67.75 -20.72 65.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.125 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 339' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 335' ' ' LEU . 71.4 mttt -87.35 -47.68 8.6 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 178.648 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -67.97 -62.33 1.45 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.958 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -68.76 -39.09 80.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.285 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 342' ' ' GLY . . . . . 0.584 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -60.5 -43.63 98.61 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.934 -0.65 . . . . 10.0 111.74 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -64.79 -43.36 96.31 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 110.415 -1.074 . . . . 10.0 110.415 178.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -62.93 -40.43 97.6 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.413 -0.588 . . . . 10.0 109.413 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -60.21 -44.48 95.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.073 -0.967 . . . . 10.0 109.863 178.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 73.7 mt -64.68 -40.48 95.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.121 179.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -63.31 -45.81 89.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.73 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.02 -42.74 97.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.934 -0.576 . . . . 10.0 109.837 178.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -62.43 -41.67 98.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.114 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -65.37 -41.66 93.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.382 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.89 -48.46 80.37 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.642 -0.503 . . . . 10.0 109.642 178.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 352' ' ' LYS . . . . . 0.683 ' NZ ' ' HB2' ' C' ' 425' ' ' GLU . 47.6 mttm -62.43 -41.51 98.76 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.494 -0.775 . . . . 10.0 110.295 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 353' ' ' ALA . . . . . 0.406 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -62.78 -45.76 91.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.196 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 28.8 m -61.38 -45.51 94.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.892 -0.594 . . . . 10.0 110.67 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 355' ' ' GLU . . . . . 0.519 ' HA ' ' OE1' ' A' ' 355' ' ' GLU . 7.2 mm-40 -71.53 -31.19 66.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.003 0.43 . . . . 10.0 111.366 179.247 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 356' ' ' HIS . . . . . 0.427 ' HA ' ' OG1' ' A' ' 359' ' ' THR . 38.5 t-80 -72.39 -25.39 61.48 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 40.9 mt -71.88 -39.84 69.35 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.252 -0.648 . . . . 10.0 109.252 178.336 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -44.12 88.03 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 178.419 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 359' ' ' THR . . . . . 0.427 ' OG1' ' HA ' ' A' ' 356' ' ' HIS . 1.1 p -70.71 -20.57 62.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.723 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 360' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 360' ' ' LEU . 9.3 mt -80.38 -39.24 28.79 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.642 -0.873 . . . . 10.0 108.642 177.459 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 16.2 m -66.54 -31.78 72.71 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.534 -0.913 . . . . 10.0 108.534 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 362' ' ' GLU . . . . . 0.51 ' HB3' ' HD3' ' C' ' 414' ' ' LYS . 46.0 mm-40 -75.06 9.01 2.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.086 -0.961 . . . . 10.0 110.782 178.565 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.58 ' HG2' HG22 ' C' ' 411' ' ' THR . 63.1 mttp -128.33 -46.69 1.33 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.268 -1.012 . . . . 10.0 108.268 178.186 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -67.61 -7.3 25.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.458 -0.792 . . . . 10.0 112.518 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.488 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 96.4 mttt -106.42 -66.96 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.526 0 C-N-CA 120.95 -0.3 . . . . 10.0 111.806 178.679 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.488 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 40.1 Cg_endo -66.28 -47.59 3.16 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 121.58 1.52 . . . . 10.0 112.557 -178.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 367' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -65.08 -38.98 92.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.506 0.193 . . . . 10.0 111.122 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 1.5 mt -68.47 -39.85 81.24 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.701 -0.4 . . . . 10.0 110.065 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 369' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 27.5 mt-10 -68.96 -35.38 76.68 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.557 -0.535 . . . . 10.0 109.557 178.577 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -47.21 81.82 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.855 -1.165 . . . . 10.0 107.855 177.574 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 371' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 367' ' ' ALA . 65.3 mt -62.28 -41.19 98.27 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.311 -0.859 . . . . 10.0 110.775 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 372' ' ' ARG . 52.4 mtt180 -63.39 -43.34 97.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.114 0.483 . . . . 10.0 110.035 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.5 mt-30 -68.13 -21.06 64.95 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.439 -0.8 . . . . 20.0 111.869 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -93.24 -37.35 5.66 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.821 -0.912 . . . . 10.0 110.821 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 18.5 mt -59.52 -37.52 78.55 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.306 0.484 . . . . 10.0 112.306 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 376' ' ' LEU . . . . . 0.447 ' HB2' ' CD ' ' A' ' 377' ' ' PRO . 81.8 mt -58.85 -62.33 5.97 Favored Pre-proline 0 CA--C 1.535 0.378 0 N-CA-C 111.734 0.272 . . . . 10.0 111.734 179.805 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 377' ' ' PRO . . . . . 0.447 ' CD ' ' HB2' ' A' ' 376' ' ' LEU . 29.6 Cg_endo -63.68 -35.17 59.75 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.012 1.808 . . . . 10.0 112.044 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 15.6 t -64.46 -47.25 90.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-O 120.645 0.26 . . . . 10.0 110.581 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 18.3 mt -63.92 -32.3 73.78 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.655 -0.498 . . . . 10.0 109.655 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -69.87 -46.96 64.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.429 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.1 p -62.49 -36.85 83.82 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.187 -0.672 . . . . 10.0 109.187 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -68.47 -45.85 71.33 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.339 -0.846 . . . . 10.0 109.845 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 25.3 mtmt -60.17 -45.44 93.09 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.991 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 70.8 t -59.7 -44.63 94.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 109.752 -0.462 . . . . 10.0 109.752 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 27.9 m -65.93 -40.55 91.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.493 178.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 386' ' ' PHE . . . . . 0.443 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 7.4 m-30 -65.23 -48.0 74.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.764 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 75.1 mt -58.77 -48.67 80.43 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.256 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 388' ' ' SER . . . . . 0.406 ' HB2' ' NZ ' ' C' ' 594' ' ' LYS . 18.3 p -66.44 -25.52 66.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.519 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -82.0 -42.07 19.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.41 179.161 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 390' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 84.5 mt -58.48 -41.37 85.14 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.41 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -64.45 -36.36 83.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.245 178.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.79 -43.28 84.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.039 0.447 . . . . 10.0 110.954 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -56.84 -52.43 65.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.761 -0.654 . . . . 10.0 111.009 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -69.32 -22.47 63.77 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.838 0.352 . . . . 10.0 111.234 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt . . . . . 0 C--N 1.325 -0.47 0 CA-C-N 116.324 -0.398 . . . . 10.0 111.069 -179.943 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 6.8 mp . . . . . 0 N--CA 1.453 -0.286 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 402' ' ' LEU . . . . . 0.44 HD23 ' H ' ' C' ' 402' ' ' LEU . 0.3 OUTLIER -65.43 -37.34 86.63 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.392 -0.822 . . . . 10.0 110.386 179.617 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.4 -38.6 74.69 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -68.22 -36.34 79.35 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.118 -0.697 . . . . 10.0 109.118 178.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 68.9 t90 -66.49 -36.7 83.38 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.419 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -60.68 -46.39 90.53 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.939 -0.573 . . . . 10.0 109.96 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -32.81 74.69 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.129 0.49 . . . . 10.0 109.979 179.19 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 36.0 t -67.9 -37.61 78.7 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.089 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 177.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 21.8 m -68.52 -42.13 78.93 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.684 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.98 -43.36 88.03 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.897 -0.321 . . . . 10.0 110.538 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 411' ' ' THR . . . . . 0.58 HG22 ' HG2' ' A' ' 363' ' ' LYS . 7.4 p -65.7 -38.14 88.4 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.409 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.58 -40.1 88.77 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.156 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 30.8 m -62.52 -44.67 95.79 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 178.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 414' ' ' LYS . . . . . 0.51 ' HD3' ' HB3' ' A' ' 362' ' ' GLU . 89.8 mttt -69.43 -25.29 64.04 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.137 178.649 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.0 -36.38 67.01 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.998 -1.112 . . . . 10.0 107.998 177.648 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -72.68 -23.6 60.9 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.235 -0.893 . . . . 10.0 110.191 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 417' ' ' GLU . . . . . 0.512 ' O ' ' HD2' ' C' ' 421' ' ' PRO . 78.4 mt-10 -64.33 -38.83 92.41 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 107.923 -1.14 . . . . 10.0 107.923 176.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 418' ' ' GLN . . . . . 0.73 ' O ' ' HB ' ' C' ' 422' ' ' VAL . 1.4 mt-30 -69.36 -30.19 68.14 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 115.103 -0.953 . . . . 10.0 109.057 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 88.5 mt -72.3 -1.74 16.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.633 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -92.82 -93.29 1.47 Allowed Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.748 -0.739 . . . . 10.0 111.483 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 421' ' ' PRO . . . . . 0.512 ' HD2' ' O ' ' C' ' 417' ' ' GLU . 9.6 Cg_endo -52.94 -46.03 36.73 Favored 'Trans proline' 0 N--CA 1.473 0.3 0 C-N-CA 123.321 2.681 . . . . 10.0 113.172 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 422' ' ' VAL . . . . . 0.73 ' HB ' ' O ' ' C' ' 418' ' ' GLN . 67.6 t -55.08 -42.47 65.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.429 0.157 . . . . 10.0 111.178 -179.153 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 2.8 m -72.71 -34.42 67.11 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.962 0.411 . . . . 10.0 110.069 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -61.7 -52.84 62.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.946 -0.57 . . . . 10.0 109.782 178.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 425' ' ' GLU . . . . . 0.683 ' HB2' ' NZ ' ' A' ' 352' ' ' LYS . 0.4 OUTLIER -68.51 -19.38 64.52 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.925 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -70.8 -42.79 69.86 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.292 -1.003 . . . . 10.0 108.292 178.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 18.9 m0 -69.4 -33.71 73.41 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.691 -0.855 . . . . 10.0 108.691 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 428' ' ' ASP . . . . . 0.478 ' O ' ' HB2' ' C' ' 431' ' ' GLU . 12.6 t70 -67.89 -41.83 82.13 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.772 -0.825 . . . . 10.0 108.772 177.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -63.95 -38.79 92.37 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.572 -0.899 . . . . 10.0 108.572 177.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 30.1 mt -66.6 -27.78 67.98 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.707 -0.678 . . . . 10.0 109.986 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 431' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' C' ' 428' ' ' ASP . 18.3 mm-40 -68.18 -38.81 82.44 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 107.705 -1.22 . . . . 10.0 107.705 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -68.57 -41.83 79.18 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.52 -0.919 . . . . 10.0 108.52 177.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 56.3 mm-40 -58.96 -53.76 54.78 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 115.353 -0.84 . . . . 10.0 109.886 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 16.4 p -63.52 -37.05 85.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 10.0 112.073 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -69.59 -45.4 68.72 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -63.95 -48.47 75.7 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.271 -1.132 . . . . 10.0 110.271 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 20.4 mt -62.58 -28.47 69.9 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 109.974 -0.38 . . . . 10.0 109.974 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 438' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' C' ' 438' ' ' ARG . 7.6 mtt180 -65.3 -42.88 92.63 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 178.512 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -65.22 -44.34 88.55 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 440' ' ' GLU . . . . . 0.694 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 45.5 mt-10 -62.65 -55.17 29.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.434 -0.803 . . . . 10.0 110.375 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 87.0 mmm -59.61 -45.7 91.15 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 112.972 0.73 . . . . 10.0 112.972 -179.108 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 15.8 p -57.28 -51.18 70.39 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.913 -0.315 . . . . 10.0 111.08 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -65.84 -46.18 79.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.726 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 444' ' ' ASP . . . . . 0.654 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 0.1 OUTLIER -60.18 -43.57 95.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.214 -179.808 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 445' ' ' LEU . . . . . 0.467 ' O ' HG12 ' C' ' 448' ' ' VAL . 63.3 mt -70.69 -45.06 65.7 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.673 0.273 . . . . 10.0 111.175 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -59.98 -45.21 93.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.126 0.488 . . . . 10.0 110.345 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 447' ' ' GLU . . . . . 0.503 ' OE1' ' HE2' ' C' ' 451' ' ' LYS . 4.5 tt0 -74.87 -26.8 59.93 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.454 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 448' ' ' VAL . . . . . 0.654 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.3 OUTLIER -66.91 -35.0 73.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.769 0.319 . . . . 10.0 110.383 179.488 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -70.47 -34.0 71.91 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.48 -0.933 . . . . 10.0 108.48 177.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -82.2 -1.45 49.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.034 -0.984 . . . . 10.0 109.95 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 451' ' ' LYS . . . . . 0.503 ' HE2' ' OE1' ' C' ' 447' ' ' GLU . 14.3 mttm -105.5 -44.41 4.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.603 -0.726 . . . . 10.0 109.055 178.753 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 452' ' ' VAL . . . . . 0.431 HG23 ' O ' ' C' ' 448' ' ' VAL . 53.6 t -61.07 -34.95 62.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.894 -0.593 . . . . 10.0 110.376 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -56.99 -62.46 5.11 Favored Pre-proline 0 CA--C 1.537 0.469 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.148 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -65.5 -29.25 53.23 Favored 'Trans proline' 0 C--N 1.36 1.164 0 C-N-CA 121.6 1.534 . . . . 10.0 111.08 178.148 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 455' ' ' TYR . . . . . 0.403 ' HB2' ' HA ' ' C' ' 452' ' ' VAL . 0.4 OUTLIER -61.32 -56.0 25.34 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 178.67 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 41.9 mt -61.05 -40.86 95.22 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.424 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -59.59 -50.31 74.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.804 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -72.12 -37.29 69.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.776 -178.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -65.17 -47.62 76.34 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -67.11 -32.33 73.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.26 -0.427 . . . . 10.0 109.948 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 461' ' ' LYS . . . . . 0.409 ' HE3' ' HB2' ' C' ' 461' ' ' LYS . 0.4 OUTLIER -63.15 -52.16 63.57 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.979 -0.748 . . . . 10.0 108.979 178.444 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 462' ' ' LYS . . . . . 0.537 ' HE3' ' HG ' ' A' ' 316' ' ' LEU . 22.7 mttm -66.34 -34.32 77.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.188 -0.915 . . . . 10.0 110.108 179.146 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 6.9 m95 -68.64 -32.54 72.46 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.239 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 464' ' ' GLN . . . . . 0.454 ' O ' ' HG3' ' C' ' 468' ' ' GLU . 13.6 mm-40 -66.85 -44.26 81.48 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 107.875 -1.157 . . . . 10.0 107.875 177.591 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 0.681 ' HB2' ' HE1' ' A' ' 312' ' ' HIS . 29.6 mt-10 -62.78 -41.79 99.4 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.833 -0.802 . . . . 10.0 108.833 177.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.55 -44.03 95.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.971 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 9.0 mmt -61.26 -44.44 97.24 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.57 -0.53 . . . . 10.0 109.57 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 468' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' C' ' 464' ' ' GLN . 50.9 mt-10 -61.89 -52.55 63.64 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.955 -0.757 . . . . 10.0 108.955 178.112 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 1.103 HD21 ' HG3' ' A' ' 308' ' ' ARG . 96.2 mt -54.6 -49.21 70.99 Favored 'General case' 0 C--O 1.225 -0.187 0 CA-C-N 115.62 -0.718 . . . . 20.0 111.474 179.4 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -60.49 -45.7 92.83 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 116.42 -0.355 . . . . 10.0 111.093 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -68.17 -46.16 71.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.608 0.242 . . . . 10.0 111.286 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -69.07 -15.94 63.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.798 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 473' ' ' LYS . . . . . 0.619 ' O ' ' HB2' ' C' ' 477' ' ' LEU . 65.2 mttt -97.31 -51.96 3.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.154 178.595 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 24.7 t -59.44 -39.08 78.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.107 -0.497 . . . . 10.0 112.049 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -54.86 -63.77 2.61 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 112.238 0.458 . . . . 10.0 112.238 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -68.86 -27.49 30.9 Favored 'Trans proline' 0 C--N 1.354 0.866 0 C-N-CA 121.823 1.682 . . . . 10.0 111.141 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 477' ' ' LEU . . . . . 0.619 ' HB2' ' O ' ' C' ' 473' ' ' LYS . 10.4 tp -65.3 -51.5 60.28 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 478' ' ' ARG . . . . . 0.508 ' HA ' ' HB2' ' C' ' 481' ' ' LEU . 61.0 mtt180 -67.21 -31.61 72.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.607 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -63.85 -45.49 89.27 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.381 -0.6 . . . . 10.0 109.381 178.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.84 -30.46 56.35 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.298 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 481' ' ' LEU . . . . . 0.508 ' HB2' ' HA ' ' C' ' 478' ' ' ARG . 20.4 mt -69.47 -40.77 76.9 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 109.679 -0.489 . . . . 10.0 109.679 178.558 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -67.02 -46.07 75.61 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.826 -0.435 . . . . 10.0 109.826 178.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -64.6 -41.46 96.2 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.798 -0.816 . . . . 10.0 108.798 178.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 484' ' ' GLY . . . . . 0.518 ' HA2' ' HE3' ' A' ' 290' ' ' LYS . . . -64.42 -40.07 97.45 Favored Glycine 0 N--CA 1.443 -0.869 0 N-CA-C 110.88 -0.888 . . . . 10.0 110.88 178.674 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.39 -38.62 81.49 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 109.465 -0.569 . . . . 10.0 109.465 178.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -63.41 -43.71 96.71 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 108.797 -0.816 . . . . 10.0 108.797 178.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -65.04 -41.66 95.0 Favored 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 109.203 -0.666 . . . . 10.0 109.203 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 488' ' ' LYS . . . . . 0.479 ' HD2' ' HA ' ' C' ' 488' ' ' LYS . 28.4 tptt -65.41 -42.4 92.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.085 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 67.7 mt -65.87 -43.66 87.73 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -61.55 -45.88 92.28 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.497 -0.927 . . . . 10.0 108.497 178.353 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 491' ' ' GLU . . . . . 0.76 ' HG2' ' HE3' ' C' ' 495' ' ' LYS . 6.8 tt0 -57.19 -51.96 67.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.875 -1.057 . . . . 10.0 109.03 178.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 78.6 mt -63.93 -42.22 97.42 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.865 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -61.36 -44.28 97.45 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.612 0.244 . . . . 10.0 111.233 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -72.08 -2.05 17.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.009 0.433 . . . . 10.0 111.253 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.76 ' HE3' ' HG2' ' C' ' 491' ' ' GLU . 93.1 mttt -111.31 -47.42 3.19 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.91 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 93.7 mt -64.93 -28.29 69.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.729 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 497' ' ' SER . . . . . 0.506 ' O ' ' HG3' ' C' ' 501' ' ' GLU . 46.8 m -68.25 -62.17 3.35 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 120.791 -0.363 . . . . 10.0 110.832 178.601 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -62.19 -38.42 55.62 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.63 1.554 . . . . 10.0 111.288 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 499' ' ' LEU . . . . . 0.522 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 13.0 mt -70.58 -32.39 69.76 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.581 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -63.65 -48.18 79.8 Favored Glycine 0 N--CA 1.449 -0.441 0 N-CA-C 110.807 -0.917 . . . . 10.0 110.807 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 501' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' C' ' 497' ' ' SER . 27.6 mt-10 -63.05 -39.94 96.24 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 178.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 502' ' ' GLU . . . . . 0.808 ' HG2' ' HE ' ' C' ' 506' ' ' ARG . 27.4 tt0 -64.61 -45.53 86.51 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.039 179.128 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 503' ' ' MET . . . . . 0.663 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 85.2 mmm -60.62 -35.74 76.91 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.624 -0.51 . . . . 10.0 109.624 178.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 55.4 mtt180 -67.66 -41.58 83.56 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -63.13 -42.42 99.51 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.999 -0.741 . . . . 10.0 108.999 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.808 ' HE ' ' HG2' ' C' ' 502' ' ' GLU . 43.5 mtt180 -62.43 -47.32 84.6 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.148 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.45 -46.14 89.6 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 115.318 -0.856 . . . . 10.0 110.479 179.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -61.45 -46.03 91.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.784 0.326 . . . . 10.0 110.19 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 509' ' ' ALA . . . . . 0.452 ' HB1' ' CE ' ' A' ' 264' ' ' LYS . . . -63.96 -36.15 83.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.634 179.421 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -76.0 -45.9 32.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.839 179.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 76.3 t -67.45 -43.38 87.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.619 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.402 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 8.4 t70 -64.56 -35.84 82.29 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.025 -0.732 . . . . 10.0 109.025 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.62 -44.39 86.66 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 107.316 -1.365 . . . . 10.0 107.316 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 50.9 mt -59.8 -35.42 74.64 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.24 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 515' ' ' ARG . . . . . 0.402 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 67.6 mtt180 -62.02 -49.35 76.36 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.638 -0.504 . . . . 10.0 109.638 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 4.7 p -81.81 6.15 16.48 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.899 -0.591 . . . . 10.0 111.865 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 517' ' ' HIS . . . . . 0.504 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 2.2 m-70 -116.96 -45.86 2.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.857 0.36 . . . . 10.0 110.954 179.712 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 97.8 mt -76.04 -38.23 57.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.481 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -58.47 -58.66 17.41 Favored Pre-proline 0 CA--C 1.533 0.315 0 N-CA-C 111.658 0.244 . . . . 10.0 111.658 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.55 -37.5 58.08 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 121.518 1.479 . . . . 10.0 111.094 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 521' ' ' TYR . . . . . 0.504 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 16.4 t80 -60.58 -47.54 85.76 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.802 0.334 . . . . 10.0 110.28 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 34.9 m -69.4 -32.35 71.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.066 -0.515 . . . . 10.0 109.94 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 523' ' ' ASP . . . . . 0.675 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 22.6 t70 -67.31 -41.65 85.0 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.288 -0.634 . . . . 10.0 109.288 178.283 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -63.74 -38.82 92.52 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 107.971 -1.122 . . . . 10.0 107.971 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 525' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' C' ' 521' ' ' TYR . 79.7 mt -65.15 -31.64 72.93 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 115.142 -0.935 . . . . 10.0 110.061 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 526' ' ' ARG . . . . . 0.675 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 66.3 mtt180 -63.39 -34.24 77.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.169 0.509 . . . . 10.0 109.706 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -80.04 -48.0 13.99 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.023 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 50.8 mtt180 -64.84 -50.86 64.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.738 -0.665 . . . . 10.0 111.835 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 70.5 mt -60.62 -33.03 72.16 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.329 -0.249 . . . . 10.0 110.329 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -66.55 -39.58 88.61 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.944 -0.761 . . . . 10.0 108.944 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.27 -41.39 81.11 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 109.216 -0.661 . . . . 10.0 109.216 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -60.89 -43.99 97.73 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.33 -0.85 . . . . 10.0 108.8 178.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 60.0 mt -67.97 -34.62 76.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.679 -0.692 . . . . 10.0 110.078 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.41 -42.63 99.58 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.179 -0.675 . . . . 10.0 109.179 178.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -66.92 -43.6 82.86 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.176 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 88.5 mt -66.02 -24.8 66.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.758 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -80.18 -42.85 22.61 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.78 -0.452 . . . . 10.0 109.78 178.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -67.68 -47.76 68.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.366 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -74.22 -35.87 63.9 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.426 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -63.94 -46.59 91.12 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.423 -1.071 . . . . 10.0 110.423 178.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.62 -41.96 99.75 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 110.5 -1.04 . . . . 10.0 110.5 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 542' ' ' ALA . . . . . 0.469 ' O ' ' HG3' ' C' ' 546' ' ' GLU . . . -62.73 -53.07 59.99 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 543' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' C' ' 543' ' ' ARG . 54.3 mtt85 -52.99 -46.81 68.49 Favored 'General case' 0 C--O 1.221 -0.427 0 O-C-N 123.781 0.676 . . . . 10.0 110.784 179.135 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 544' ' ' LEU . . . . . 0.648 ' O ' ' HB2' ' C' ' 548' ' ' HIS . 54.6 mt -59.34 -42.77 92.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.462 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -71.86 -42.85 66.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.756 0.312 . . . . 10.0 110.842 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 546' ' ' GLU . . . . . 0.577 ' O ' ' HD2' ' C' ' 550' ' ' LYS . 52.0 mt-10 -66.81 -52.72 40.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.633 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 547' ' ' TYR . . . . . 0.839 ' HA ' ' HB2' ' C' ' 550' ' ' LYS . 21.2 m-30 -65.45 -20.25 66.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.643 0.259 . . . . 10.0 111.174 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 548' ' ' HIS . . . . . 0.648 ' HB2' ' O ' ' C' ' 544' ' ' LEU . 2.8 t-80 -68.33 -39.4 81.96 Favored 'General case' 0 CA--C 1.519 -0.25 0 N-CA-C 107.619 -1.252 . . . . 10.0 107.619 177.561 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 549' ' ' ALA . . . . . 0.574 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -78.13 -32.74 50.53 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.15 -0.932 . . . . 10.0 108.768 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 550' ' ' LYS . . . . . 0.839 ' HB2' ' HA ' ' C' ' 547' ' ' TYR . 0.2 OUTLIER -64.11 -33.89 76.81 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.441 -0.8 . . . . 10.0 109.492 178.448 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.83 -45.51 89.26 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.443 -0.798 . . . . 10.0 109.103 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -33.76 76.48 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.262 179.135 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 553' ' ' GLU . . . . . 0.574 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 89.0 mt-10 -60.8 -37.28 81.41 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 108.49 -0.929 . . . . 10.0 108.49 178.072 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -80.14 -36.19 35.56 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.216 -0.902 . . . . 10.0 110.998 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 65.4 mt -63.75 -41.89 97.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.843 0.354 . . . . 10.0 111.072 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 2.7 p -67.43 -39.68 85.47 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.986 0.422 . . . . 10.0 110.342 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 7.5 p -74.21 -24.75 59.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.919 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 20.5 mt -74.89 -33.05 62.0 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.992 -0.744 . . . . 10.0 108.992 177.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 49.2 m -61.95 -26.82 68.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.298 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -65.34 -17.37 64.47 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-O 121.383 0.611 . . . . 10.0 110.26 178.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 561' ' ' LYS . . . . . 0.408 ' HA ' ' HB3' ' C' ' 565' ' ' ALA . 3.8 mptt -111.15 -35.08 5.99 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.899 179.078 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -63.96 -22.6 66.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.64 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 563' ' ' LYS . . . . . 0.964 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 75.9 mttt -114.15 -70.6 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.49 0 CA-C-O 119.313 -0.375 . . . . 10.0 111.951 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 564' ' ' PRO . . . . . 0.964 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 50.8 Cg_exo -58.43 -51.76 6.8 Favored 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 122.151 1.901 . . . . 10.0 113.2 -179.433 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 565' ' ' ALA . . . . . 0.408 ' HB3' ' HA ' ' C' ' 561' ' ' LYS . . . -63.82 -41.5 97.85 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.065 -0.254 . . . . 10.0 111.408 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 1.1 mt -63.88 -38.52 91.39 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.829 -0.348 . . . . 10.0 110.107 178.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 567' ' ' GLU . . . . . 0.47 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 26.6 mm-40 -66.84 -39.03 87.5 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 178.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.66 -41.16 96.29 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.726 -0.842 . . . . 10.0 108.726 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 51.5 mt -63.15 -42.97 99.54 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.762 178.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -64.9 -43.03 94.2 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.021 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 571' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.6 mt-30 -65.36 -20.53 66.43 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.733 -0.667 . . . . 20.0 111.591 179.107 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -92.86 -38.37 5.5 Favored Glycine 0 CA--C 1.523 0.548 0 N-CA-C 109.397 -1.481 . . . . 10.0 109.397 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 26.4 mt -54.78 -42.71 72.08 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.36 0.504 . . . . 10.0 112.36 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 574' ' ' LEU . . . . . 0.791 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 96.0 mt -58.99 -62.05 6.6 Favored Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 120.811 -0.356 . . . . 10.0 111.709 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 575' ' ' PRO . . . . . 0.791 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 53.0 Cg_exo -58.36 -38.64 89.59 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.231 1.954 . . . . 10.0 111.741 178.723 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 27.3 t -63.31 -46.75 94.73 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-O 120.722 0.296 . . . . 10.0 110.413 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 24.1 mt -64.61 -39.57 93.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.252 -0.277 . . . . 10.0 110.252 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 578' ' ' GLU . . . . . 0.499 ' O ' HG23 ' C' ' 582' ' ' VAL . 24.2 mt-10 -63.15 -48.95 76.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.33 -0.395 . . . . 10.0 110.631 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 23.1 p -65.79 -39.79 91.31 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.768 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.14 -40.77 96.87 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 116.22 -0.445 . . . . 10.0 109.831 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -61.26 -37.77 84.31 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.515 178.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 582' ' ' VAL . . . . . 0.499 HG23 ' O ' ' C' ' 578' ' ' GLU . 86.0 t -62.98 -46.21 96.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.21 -0.45 . . . . 10.0 109.874 179.127 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.17 -34.84 77.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.104 -0.498 . . . . 10.0 111.079 179.288 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -73.62 -44.77 56.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.158 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 15.8 mt -58.41 -47.38 84.1 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.393 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 14.1 p -64.11 -39.89 95.03 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.312 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -62.81 -50.71 69.91 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.998 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 67.9 mt -62.79 -28.64 70.13 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.166 0.432 . . . . 10.0 112.166 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -86.57 -33.15 20.32 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.556 0.576 . . . . 10.0 112.556 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -85.13 -38.7 18.76 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.65 0.611 . . . . 10.0 112.65 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -67.1 -29.24 68.94 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 112.25 0.463 . . . . 10.0 112.25 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.28 -30.21 70.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.848 0.356 . . . . 10.0 110.905 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -63.47 -26.62 68.81 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.928 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 594' ' ' LYS . . . . . 0.406 ' NZ ' ' HB2' ' A' ' 388' ' ' SER . 0.1 OUTLIER -94.97 -4.59 46.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.594 -179.103 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 82.8 mt -98.5 -15.79 19.44 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.359 -0.382 . . . . 10.0 111.398 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 42.8 t30 . . . . . 0 C--O 1.246 0.877 0 CA-C-O 118.412 -0.804 . . . . 10.0 110.229 179.927 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.235 0.301 0 CA-C-O 120.793 0.33 . . . . 10.0 110.468 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -99.65 116.32 31.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.45 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -109.51 119.61 39.96 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.582 -179.453 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 6.8 mptt -93.86 122.89 36.81 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.617 HD22 HD23 ' B' ' 159' ' ' LEU . 42.4 mt -117.93 124.37 48.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.836 0.351 . . . . 10.0 111.232 -178.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 29.2 t -107.86 114.14 45.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.226 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 26.0 t -91.15 117.09 33.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.36 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 19.1 m -113.68 161.41 12.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.719 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 152.57 172.03 20.65 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 111.321 -0.711 . . . . 10.0 111.321 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.562 ' HB3' HG13 ' B' ' 14' ' ' VAL . . . -66.74 167.05 11.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.189 0.519 . . . . 10.0 112.081 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -67.66 -16.57 67.98 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 115.863 -0.608 . . . . 10.0 113.94 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -115.0 18.72 16.08 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.398 -0.906 . . . . 10.0 113.73 -179.357 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 14' ' ' VAL . . . . . 0.562 HG13 ' HB3' ' B' ' 11' ' ' ALA . 35.8 m -80.27 -32.27 13.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 117.691 0.746 . . . . 10.0 112.184 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.69 39.34 2.76 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.782 -0.723 . . . . 10.0 113.129 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -61.14 -47.99 83.67 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.9 p -62.49 -43.28 99.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.517 0.199 . . . . 10.0 111.106 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.01 -47.47 85.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.126 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 35.8 mt -61.82 -44.99 95.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.391 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' THR . . . . . 0.425 ' O ' HG12 ' B' ' 24' ' ' ILE . 6.7 m -65.82 -51.4 59.26 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.041 -0.527 . . . . 10.0 112.283 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 50.3 mt -62.48 -30.27 48.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-O 120.932 0.396 . . . . 10.0 110.688 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.55 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 28.4 tp60 -66.28 -25.1 66.71 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.753 179.181 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 36.2 tp -95.15 -32.97 12.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.066 0.46 . . . . 10.0 110.219 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 24' ' ' ILE . . . . . 0.425 HG12 ' O ' ' B' ' 20' ' ' THR . 48.8 mm -73.27 -63.48 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.997 -0.547 . . . . 10.0 112.058 -179.543 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -110.04 -3.6 16.36 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 -178.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.55 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 20.1 m-80 66.57 38.51 4.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.4 0.619 . . . . 10.0 109.703 -178.848 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 21.2 t60 -123.52 114.21 19.77 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.55 -179.256 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -85.1 134.82 34.18 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.592 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 m -98.96 115.19 38.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 N-CA-C 109.668 -0.493 . . . . 10.0 109.668 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -85.84 -7.07 58.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.081 -0.508 . . . . 10.0 111.65 -178.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -101.39 161.61 13.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.077 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -85.81 91.7 8.41 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.084 0.469 . . . . 10.0 110.854 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.11 135.16 37.5 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.097 179.097 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.3 172.29 14.38 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.605 2.203 . . . . 10.0 112.364 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 35' ' ' THR . . . . . 0.802 HG22 ' HA ' ' B' ' 59' ' ' ALA . 0.9 OUTLIER -165.6 136.13 3.68 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.398 -179.779 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 4.2 mp -130.56 -62.54 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 107.398 -1.334 . . . . 10.0 107.398 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.94 85.36 1.68 Allowed 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.029 -0.987 . . . . 10.0 109.031 178.515 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -120.86 110.41 16.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.611 -0.722 . . . . 10.0 111.006 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 39' ' ' SER . . . . . 0.416 ' HB2' ' NE2' ' D' ' 818' ' ' GLN . 0.0 OUTLIER -100.51 149.1 24.05 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.464 -0.789 . . . . 10.0 112.292 -179.158 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -124.54 176.39 6.55 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.245 -0.888 . . . . 10.0 109.129 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 41' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' B' ' 41' ' ' ARG . 40.6 ttm180 -163.09 130.56 3.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.571 0.224 . . . . 10.0 111.268 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -157.49 158.02 34.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.401 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -120.83 128.0 52.44 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 7.9 m -139.53 173.52 10.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.999 0.428 . . . . 10.0 110.96 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 21.9 t -103.43 106.03 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.545 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 58.9 mt -102.99 114.42 42.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.684 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.829 ' HB2' HH22 ' B' ' 164' ' ' ARG . 29.7 m-20 61.32 27.19 16.89 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.947 -0.57 . . . . 10.0 111.571 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.63 -9.25 73.92 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.566 -0.826 . . . . 10.0 113.035 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -105.43 124.33 49.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.858 0.361 . . . . 10.0 110.903 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 12.7 t -80.85 136.91 36.17 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.723 -0.473 . . . . 10.0 109.723 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -154.68 161.0 41.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.727 0.299 . . . . 10.0 111.18 -179.256 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 29.7 tp -96.45 130.15 43.66 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 86.7 mt -109.3 115.86 30.78 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.925 0.393 . . . . 10.0 112.012 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -101.15 97.32 7.87 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.044 -1.095 . . . . 10.0 108.044 178.124 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 27.5 mt -93.5 129.24 44.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.897 -0.592 . . . . 10.0 112.496 -177.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 48.3 tp -119.26 115.59 24.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.861 -0.608 . . . . 10.0 109.91 178.543 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -89.59 119.31 29.9 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.793 -0.639 . . . . 10.0 110.293 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 40.2 p -75.74 156.83 34.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.881 -0.6 . . . . 10.0 112.074 -178.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 59' ' ' ALA . . . . . 0.802 ' HA ' HG22 ' B' ' 35' ' ' THR . . . -57.38 155.17 9.56 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.488 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.52 -53.14 26.22 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.636 -0.792 . . . . 10.0 111.587 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -132.77 128.79 37.59 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.854 -0.424 . . . . 20.0 109.854 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.476 ' HG2' ' H ' ' B' ' 63' ' ' GLU . 2.2 tt0 -140.09 171.41 14.21 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.152 -0.476 . . . . 10.0 109.77 -179.739 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 63' ' ' GLU . . . . . 0.476 ' H ' ' HG2' ' B' ' 62' ' ' GLU . 20.5 mt-10 -108.18 -86.54 0.51 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.198 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -164.38 93.29 0.67 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.029 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 31.5 t -118.42 153.56 33.89 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.894 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.93 -28.76 69.75 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.179 0.514 . . . . 10.0 110.188 179.187 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 11.2 mmm -64.08 -31.59 72.83 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.06 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.559 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 48.8 ttt85 -67.17 -52.47 40.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.397 -0.82 . . . . 10.0 110.572 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -31.77 67.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.602 -0.727 . . . . 10.0 110.099 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -61.71 -57.59 11.36 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.31 -0.859 . . . . 10.0 112.313 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 71' ' ' TYR . . . . . 0.559 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 4.9 p90 -71.07 -18.71 62.54 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.373 0.879 . . . . 10.0 113.373 -178.362 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 84.9 mtp -89.39 -5.51 57.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.09 0.472 . . . . 10.0 111.016 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 11.0 ttm105 -89.18 -33.1 17.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.671 -179.203 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -47.48 62.19 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.837 0.68 . . . . 10.0 112.837 -178.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.49 148.38 45.29 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.678 -0.772 . . . . 10.0 113.897 -178.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -107.52 -45.65 4.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.192 0.52 . . . . 10.0 109.795 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -92.05 133.77 11.91 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.239 -0.744 . . . . 10.0 111.239 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -125.69 132.1 52.47 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.329 0.492 . . . . 10.0 112.329 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.726 ' HG ' HD22 ' B' ' 159' ' ' LEU . 78.0 mt -97.3 114.35 26.1 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.762 179.31 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 80' ' ' CYS . . . . . 0.499 ' HB3' HD12 ' B' ' 93' ' ' ILE . 21.1 m -87.31 89.94 8.18 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 21.9 t -91.14 123.48 43.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.78 -0.645 . . . . 10.0 111.417 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.639 ' HB3' HD11 ' B' ' 93' ' ' ILE . 38.5 p90 -132.95 168.73 17.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.822 -0.626 . . . . 10.0 109.668 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -102.8 120.89 41.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 110.022 -0.362 . . . . 10.0 110.022 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 84' ' ' ILE . . . . . 0.924 HD11 ' HA ' ' B' ' 118' ' ' CYS . 42.2 pt -68.99 -7.75 8.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 112.124 0.416 . . . . 10.0 112.124 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -102.92 7.12 39.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.279 0.562 . . . . 10.0 110.603 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -141.77 100.54 3.77 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.065 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.9 -27.04 64.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.886 -0.597 . . . . 10.0 112.16 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 9.2 tmtm? -58.28 -47.58 83.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.515 -0.311 . . . . 10.0 110.939 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 71.1 p -67.75 -31.0 70.61 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.26 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -67.19 -40.74 86.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.091 0.472 . . . . 10.0 110.142 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -71.88 -29.36 64.27 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.727 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.57 -11.64 61.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.914 -0.584 . . . . 10.0 112.006 -179.511 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 93' ' ' ILE . . . . . 0.639 HD11 ' HB3' ' B' ' 82' ' ' PHE . 33.3 mm -59.46 -40.93 83.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.887 0.375 . . . . 10.0 110.086 179.119 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -64.18 -39.9 94.97 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 108.692 -0.855 . . . . 10.0 108.692 178.599 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 8.2 t-160 -63.26 -39.33 94.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.227 -0.897 . . . . 10.0 110.132 179.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 96' ' ' TYR . . . . . 0.401 ' O ' HG13 ' B' ' 100' ' ' ILE . 21.0 m-85 -69.88 -52.22 26.62 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.529 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 97' ' ' ARG . . . . . 0.573 ' NH1' ' HB3' ' B' ' 137' ' ' TYR . 8.6 ttt180 -54.1 -43.11 70.13 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.629 0.252 . . . . 10.0 111.435 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -65.39 -38.03 88.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.343 -0.389 . . . . 10.0 111.267 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.21 -36.45 77.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.965 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 100' ' ' ILE . . . . . 0.401 HG13 ' O ' ' B' ' 96' ' ' TYR . 73.8 mt -70.99 -37.86 69.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.344 178.68 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 101' ' ' LYS . . . . . 0.876 ' HD2' ' HG3' ' B' ' 107' ' ' GLU . 33.4 ttpt -60.39 -32.17 71.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.663 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 1.2 ttp-105 -68.01 -29.97 69.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.667 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.825 HG23 ' HE2' ' B' ' 104' ' ' LYS . 22.3 m -95.57 -9.35 9.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.541 -0.3 . . . . 10.0 111.536 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.825 ' HE2' HG23 ' B' ' 103' ' ' VAL . 14.0 mmtt -103.96 -18.22 14.68 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.572 -0.286 . . . . 10.0 110.861 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 15.2 t70 75.87 -39.0 0.36 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.644 -0.707 . . . . 10.0 112.527 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 5.0 m -107.73 156.29 19.26 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.726 0.298 . . . . 10.0 111.026 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 107' ' ' GLU . . . . . 0.876 ' HG3' ' HD2' ' B' ' 101' ' ' LYS . 35.1 mp0 -81.18 -19.66 42.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.944 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -79.16 84.12 5.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.522 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 19.8 t -127.39 132.6 24.41 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.858 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -65.53 99.23 0.36 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.581 2.188 . . . . 10.0 111.322 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 111' ' ' MET . . . . . 0.441 ' HB2' HG21 ' B' ' 139' ' ' ILE . 66.9 mtt -121.56 153.79 37.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.592 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 112' ' ' VAL . . . . . 0.609 ' HB ' HD23 ' B' ' 79' ' ' LEU . 99.1 t -134.62 130.67 53.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 179.197 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 113' ' ' LEU . . . . . 0.486 ' HG ' ' HE1' ' B' ' 82' ' ' PHE . 14.6 tp -85.35 114.67 22.59 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.644 -0.502 . . . . 10.0 109.644 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 66.2 t -109.34 112.05 38.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.784 -178.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -93.93 97.82 2.26 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 110.339 -1.104 . . . . 10.0 110.339 178.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 116' ' ' ASN . . . . . 0.557 ' HA ' ' O ' ' B' ' 144' ' ' THR . 65.3 t30 -87.07 162.67 17.45 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.139 0.422 . . . . 10.0 112.139 -178.414 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 92.8 mttt 74.15 34.95 0.8 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.207 -0.906 . . . . 10.0 112.455 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 118' ' ' CYS . . . . . 0.924 ' HA ' HD11 ' B' ' 84' ' ' ILE . 5.4 p -71.74 -7.47 48.29 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.983 0.42 . . . . 10.0 111.457 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -90.33 -5.12 56.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.785 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 68.0 mt -96.52 129.22 33.76 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.267 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.79 1.1 8.47 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 123.191 2.594 . . . . 10.0 112.136 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.35 16.16 5.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.419 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -56.8 122.29 11.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.65 -0.705 . . . . 10.0 111.902 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.71 -22.54 11.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.318 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 38.9 t -98.55 118.18 44.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.56 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 126' ' ' ASP . . . . . 0.578 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 31.7 t70 -72.12 151.24 43.16 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.263 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 2.0 m -58.59 -42.55 88.31 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.243 0.46 . . . . 10.0 112.243 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -67.13 -34.67 78.09 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.678 0.251 . . . . 10.0 111.678 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 129' ' ' GLN . . . . . 0.578 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 50.6 mt-30 -61.36 -43.34 99.03 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.232 0.539 . . . . 10.0 109.931 179.493 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.53 -42.78 64.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.643 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -59.86 -43.97 94.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.053 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -61.25 -43.48 98.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.718 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 31.2 tp -65.04 -40.41 94.76 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.232 -0.44 . . . . 10.0 109.897 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.32 -46.43 88.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.707 -0.678 . . . . 10.0 110.402 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.425 HH11 ' HD3' ' B' ' 135' ' ' ARG . 7.0 tpt180 -64.54 -32.9 74.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.242 -0.436 . . . . 10.0 110.482 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 44.0 m -70.61 -18.31 62.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.593 179.001 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 137' ' ' TYR . . . . . 0.573 ' HB3' ' NH1' ' B' ' 97' ' ' ARG . 8.1 m-30 -106.08 1.11 26.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.852 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 66.69 28.93 74.01 Favored Glycine 0 CA--C 1.517 0.199 0 CA-C-N 115.914 -0.584 . . . . 10.0 112.801 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 139' ' ' ILE . . . . . 0.441 HG21 ' HB2' ' B' ' 111' ' ' MET . 49.4 pt -123.21 153.84 65.02 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.593 0.235 . . . . 10.0 110.874 -179.306 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -83.29 149.22 13.25 Favored 'Trans proline' 0 C--O 1.235 0.332 0 C-N-CA 122.435 2.09 . . . . 10.0 112.019 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -109.46 128.22 54.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.253 -0.431 . . . . 10.0 110.12 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 24.7 mm -126.48 123.99 64.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.085 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 143' ' ' GLU . . . . . 0.528 ' HG2' ' HB3' ' B' ' 118' ' ' CYS . 4.3 tt0 -83.01 127.01 33.17 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 107.792 -1.188 . . . . 10.0 107.792 178.191 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 144' ' ' THR . . . . . 0.557 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 11.1 m -133.58 160.6 36.99 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.136 0.493 . . . . 10.0 112.21 -177.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 145' ' ' SER . . . . . 0.437 ' HA ' ' OD1' ' B' ' 116' ' ' ASN . 12.7 t -157.58 123.53 4.72 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.025 -0.731 . . . . 10.0 109.025 178.085 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -76.89 -21.39 54.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.074 0.464 . . . . 10.0 110.065 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -73.06 -48.4 36.32 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.173 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 34.2 p -92.04 -6.21 51.48 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.032 0.444 . . . . 10.0 111.205 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 149' ' ' ARG . . . . . 0.41 ' HG3' ' CG ' ' B' ' 22' ' ' GLN . 3.4 ttt-85 58.86 38.13 24.64 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.354 -0.839 . . . . 10.0 111.484 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -107.22 136.07 47.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.057 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 76.44 -10.09 18.38 Favored Glycine 0 CA--C 1.518 0.254 0 O-C-N 123.531 0.519 . . . . 10.0 114.332 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 22.5 t -55.52 -54.82 21.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 112.117 0.414 . . . . 10.0 112.117 -178.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.91 -47.7 82.14 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.994 -178.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -62.46 -36.55 82.8 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.255 0.465 . . . . 10.0 112.255 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -59.42 -47.19 86.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.935 0.398 . . . . 10.0 110.48 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -68.81 -42.55 77.13 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.644 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 17.2 m-30 -61.67 -43.69 98.37 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.658 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.523 ' O ' ' HG2' ' B' ' 162' ' ' GLU . 97.0 m -59.11 -40.45 85.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.26 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.726 HD22 ' HG ' ' B' ' 79' ' ' LEU . 30.1 tp -57.5 -44.69 85.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.289 0.566 . . . . 10.0 109.56 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 44.5 t -65.73 -38.23 81.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.179 179.126 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 161' ' ' ARG . . . . . 0.516 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 76.6 mtt180 -63.04 -35.68 81.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.843 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 162' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' B' ' 158' ' ' THR . 10.3 mm-40 -69.83 -41.4 75.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.05 0.452 . . . . 10.0 110.004 179.121 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 163' ' ' ILE . . . . . 0.541 ' O ' ' HG2' ' B' ' 167' ' ' LYS . 85.1 mt -62.85 -43.64 99.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.31 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 164' ' ' ARG . . . . . 0.829 HH22 ' HB2' ' B' ' 47' ' ' ASP . 0.2 OUTLIER -55.34 -48.44 74.21 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.707 179.327 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 29.1 mtmm -64.77 -37.58 88.1 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.238 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -61.25 -43.05 99.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.845 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 167' ' ' LYS . . . . . 0.541 ' HG2' ' O ' ' B' ' 163' ' ' ILE . 72.3 mmtt -65.97 -46.6 77.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.39 179.63 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.63 -47.82 83.68 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.384 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -62.9 -34.92 78.45 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.014 0.376 . . . . 10.0 112.014 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 15.1 mmt -71.74 -34.92 69.92 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.901 0.381 . . . . 10.0 110.583 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 21.6 m . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.2 -0.455 . . . . 10.0 111.409 -179.929 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.036 -0.426 . . . . 10.0 112.036 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.28 131.75 53.78 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.806 0.336 . . . . 10.0 110.694 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 49.0 t -118.64 140.83 40.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.996 -178.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.96 123.11 34.2 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.353 178.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 812' ' ' VAL . . . . . 0.828 HG11 HD11 ' D' ' 834' ' ' LEU . 47.0 t -107.6 136.96 41.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 116.11 -0.496 . . . . 10.0 109.952 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -90.58 133.3 35.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.933 0.397 . . . . 10.0 111.487 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 83.7 mt -101.67 147.63 34.13 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.766 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 815' ' ' PRO . . . . . 0.487 ' HD3' ' HB ' ' D' ' 877' ' ' VAL . 60.4 Cg_endo -72.72 45.16 0.84 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 123.247 2.631 . . . . 10.0 113.458 -178.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -148.98 27.58 0.86 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.117 0.484 . . . . 10.0 109.998 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 49.3 mttm 60.37 44.16 12.57 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.176 -0.92 . . . . 10.0 111.826 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 818' ' ' GLN . . . . . 0.416 ' NE2' ' HB2' ' B' ' 39' ' ' SER . 76.8 mt-30 -147.91 177.1 9.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.952 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 819' ' ' ARG . . . . . 0.402 ' HD2' HH11 ' D' ' 819' ' ' ARG . 0.0 OUTLIER -143.97 168.46 19.92 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.858 0.361 . . . . 10.0 111.287 -178.975 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 12.0 t -147.63 151.55 36.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.737 -0.665 . . . . 10.0 109.283 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 4.2 t -104.9 117.46 50.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.809 0.338 . . . . 10.0 111.016 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 21.1 t -112.68 140.81 30.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.716 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.22 137.03 33.71 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.71 179.614 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 22.0 t -87.43 120.88 37.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.824 0.345 . . . . 10.0 110.15 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 825' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' D' ' 825' ' ' ARG . 16.5 mtp180 -129.34 135.11 48.32 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.698 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -78.84 49.37 0.9 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.92 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . -161.04 25.98 0.27 Allowed Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 120.457 -0.878 . . . . 10.0 112.34 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 11.6 ptm -151.94 159.06 43.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.626 0.25 . . . . 10.0 111.128 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 829' ' ' SER . . . . . 0.72 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 93.9 p -100.98 -179.71 4.13 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.737 -179.407 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 830' ' ' VAL . . . . . 0.543 HG11 HG21 ' D' ' 850' ' ' VAL . 98.6 t -67.1 -33.39 62.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 108.898 -0.779 . . . . 10.0 108.898 178.63 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 831' ' ' TYR . . . . . 0.47 ' O ' ' HB2' ' D' ' 835' ' ' ASP . 73.4 t80 -59.38 -43.14 92.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.463 -0.789 . . . . 10.0 110.546 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -68.73 -56.07 9.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.115 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 1.7 m -57.59 -37.22 72.84 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.383 0.883 . . . . 10.0 113.383 -178.339 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 834' ' ' LEU . . . . . 0.828 HD11 HG11 ' D' ' 812' ' ' VAL . 3.4 mm? -91.89 -8.98 44.87 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.915 0.709 . . . . 10.0 112.915 -178.341 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 835' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' D' ' 831' ' ' TYR . 24.2 t70 -62.07 -56.81 15.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.956 0.407 . . . . 10.0 110.499 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -59.93 -33.16 71.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.82 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -67.75 -36.57 80.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.491 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 838' ' ' LEU . . . . . 0.708 HD21 HG11 ' D' ' 877' ' ' VAL . 88.0 mt -86.13 -43.31 13.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.42 -0.355 . . . . 10.0 111.913 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 839' ' ' LYS . . . . . 0.493 ' HA ' ' HD3' ' D' ' 839' ' ' LYS . 16.1 mmtp -61.64 -30.71 70.89 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.16 0.429 . . . . 10.0 112.16 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 5.1 p -71.11 -17.82 20.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.926 0.394 . . . . 10.0 111.226 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 841' ' ' ARG . . . . . 0.444 ' HA ' ' HD2' ' D' ' 841' ' ' ARG . 0.6 OUTLIER -108.93 -2.85 18.01 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.893 0.331 . . . . 10.0 111.893 -179.758 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 83.91 33.52 20.98 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 120.934 -0.651 . . . . 10.0 113.057 179.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 64.3 mt -121.27 154.78 35.89 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -123.15 152.56 41.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.855 0.36 . . . . 10.0 111.035 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -66.73 -6.24 15.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.592 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -74.13 -27.1 60.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.691 -0.686 . . . . 10.0 111.599 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 1.9 m -124.38 20.57 8.79 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.655 0.264 . . . . 10.0 111.697 -178.525 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 82.6 m -143.9 157.34 44.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.926 0.393 . . . . 10.0 110.721 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 849' ' ' VAL . . . . . 0.551 ' HB ' HD11 ' D' ' 880' ' ' LEU . 4.4 p -144.43 156.54 14.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.87 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 850' ' ' VAL . . . . . 0.691 HG12 HG22 ' D' ' 877' ' ' VAL . 3.8 m -100.62 127.95 53.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.168 0.508 . . . . 10.0 112.3 -179.144 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 851' ' ' TYR . . . . . 0.475 ' CE1' HG22 ' D' ' 860' ' ' VAL . 74.5 m-85 -107.03 117.28 33.64 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.673 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 852' ' ' ARG . . . . . 0.671 ' HD2' ' OE1' ' D' ' 873' ' ' GLU . 12.7 mtm180 -75.93 127.39 32.89 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 110.126 -0.324 . . . . 10.0 110.126 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 853' ' ' LEU . . . . . 0.459 HD22 ' HA ' ' D' ' 853' ' ' LEU . 0.5 OUTLIER -90.66 87.66 6.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.008 0.433 . . . . 10.0 110.883 -179.243 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 54.1 mt -99.67 103.1 14.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.353 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt 52.91 28.7 6.83 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.42 0.896 . . . . 10.0 113.42 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 98.53 6.37 56.47 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.535 -0.841 . . . . 10.0 113.318 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 857' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' D' ' 857' ' ' ARG . 45.0 mmt-85 -113.99 117.03 30.18 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.387 -0.478 . . . . 10.0 111.143 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -73.43 109.59 7.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.819 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 4.0 m -104.42 117.4 34.08 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.422 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 860' ' ' VAL . . . . . 0.475 HG22 ' CE1' ' D' ' 851' ' ' TYR . 2.1 t -67.55 132.86 32.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.742 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 28.7 m -136.27 146.75 47.03 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.118 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -81.4 170.03 16.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.508 -179.469 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -83.26 -18.49 38.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.04 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.04 -16.41 63.15 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.702 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.19 148.38 43.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.273 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 866' ' ' ALA . . . . . 0.72 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -82.16 161.57 22.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.385 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 9.2 tp -89.32 -0.48 8.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.499 0.666 . . . . 10.0 110.861 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 868' ' ' ALA . . . . . 0.491 ' HB3' ' HD3' ' D' ' 869' ' ' PRO . . . -62.42 -51.33 74.1 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 113.193 0.812 . . . . 10.0 113.193 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 869' ' ' PRO . . . . . 0.491 ' HD3' ' HB3' ' D' ' 868' ' ' ALA . 2.9 Cg_exo -78.08 31.8 0.44 Allowed 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 122.491 2.127 . . . . 10.0 112.864 -179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 870' ' ' LEU . . . . . 0.5 HD11 ' HD3' ' D' ' 852' ' ' ARG . 3.4 mm? -117.62 25.96 10.04 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.239 0.542 . . . . 10.0 110.108 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -71.78 105.38 3.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.915 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 90.17 13.16 60.74 Favored Glycine 0 CA--C 1.517 0.217 0 C-N-CA 120.842 -0.694 . . . . 10.0 113.095 178.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 873' ' ' GLU . . . . . 0.671 ' OE1' ' HD2' ' D' ' 852' ' ' ARG . 5.1 tt0 -114.43 156.15 25.04 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 122.709 -0.289 . . . . 10.0 110.648 -179.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -114.4 154.5 28.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.577 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 875' ' ' LEU . . . . . 0.476 HD23 ' HG2' ' D' ' 852' ' ' ARG . 6.3 mt -128.21 135.56 49.87 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.409 -0.359 . . . . 10.0 111.696 -178.426 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 63.9 mt -118.88 118.28 57.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 108.488 -0.93 . . . . 10.0 108.488 178.016 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 877' ' ' VAL . . . . . 0.708 HG11 HD21 ' D' ' 838' ' ' LEU . 11.9 t -90.02 124.3 42.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.566 0.222 . . . . 10.0 110.58 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -127.0 155.29 43.44 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.014 0.435 . . . . 10.0 111.045 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 13.5 t -76.28 143.55 12.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.426 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 880' ' ' LEU . . . . . 0.551 HD11 ' HB ' ' D' ' 849' ' ' VAL . 79.7 mt . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.438 -0.791 . . . . 10.0 111.313 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 46.8 mt . . . . . 0 C--O 1.213 -0.824 0 N-CA-C 111.166 0.062 . . . . 10.0 111.166 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 69.9 mtt180 -70.72 -44.38 66.98 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 178.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -64.78 -29.64 70.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.318 -0.856 . . . . 10.0 109.757 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 242' ' ' GLU . . . . . 0.634 ' HB3' HH21 ' C' ' 532' ' ' ARG . 15.5 mt-10 -86.93 -38.83 16.32 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.716 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 243' ' ' MET . . . . . 0.478 ' HA ' ' HB2' ' A' ' 246' ' ' ASP . 1.7 mmt -62.01 -36.64 82.13 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.827 -0.17 . . . . 10.0 111.329 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 2.0 p -62.0 -39.99 94.11 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.79 -0.819 . . . . 10.0 108.79 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -73.35 -45.57 54.3 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.201 178.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 246' ' ' ASP . . . . . 0.478 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.4 OUTLIER -53.91 -54.26 41.25 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 115.892 -0.595 . . . . 10.0 109.462 179.048 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.58 ' HB3' ' HE2' ' A' ' 251' ' ' LYS . 75.7 mt -63.52 -44.17 95.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.142 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -58.69 -55.18 38.45 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 120.746 0.308 . . . . 10.0 110.815 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -63.89 -50.09 70.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.821 -0.627 . . . . 10.0 111.603 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 250' ' ' VAL . . . . . 0.644 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 46.1 t -59.55 -45.58 93.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 112.057 0.391 . . . . 10.0 112.057 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 251' ' ' LYS . . . . . 0.58 ' HE2' ' HB3' ' A' ' 247' ' ' LEU . 57.6 mtmt -72.48 -40.52 66.87 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.348 0.499 . . . . 10.0 112.348 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -68.68 -33.35 73.82 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.892 0.377 . . . . 10.0 110.696 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -88.12 -24.51 23.36 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.498 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.644 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.6 OUTLIER -63.45 -24.25 35.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.016 0.436 . . . . 10.0 110.005 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 255' ' ' GLN . . . . . 0.552 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 15.9 mt-30 -62.45 -64.5 2.98 Favored Pre-proline 0 N--CA 1.451 -0.419 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.43 178.258 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 256' ' ' PRO . . . . . 0.552 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 20.0 Cg_endo -63.59 -29.19 70.05 Favored 'Trans proline' 0 C--N 1.361 1.193 0 C-N-CA 121.802 1.668 . . . . 10.0 111.363 177.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 257' ' ' TYR . . . . . 0.494 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 5.0 m-30 -59.58 -57.77 11.52 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 109.424 -0.584 . . . . 10.0 109.424 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 72.7 mt -72.35 -32.86 66.85 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 115.686 -0.688 . . . . 10.0 111.003 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 259' ' ' ASP . . . . . 0.484 ' HB3' ' HA ' ' A' ' 256' ' ' PRO . 25.1 t70 -60.98 -49.06 78.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.748 0.309 . . . . 10.0 110.585 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -63.31 -44.97 93.48 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -61.41 -43.65 98.5 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.805 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -62.64 -46.23 89.19 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 110.258 -0.275 . . . . 10.0 110.258 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 263' ' ' LYS . . . . . 0.542 ' O ' ' HG3' ' A' ' 267' ' ' GLU . 71.0 mttt -59.6 -45.57 91.52 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.089 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.513 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 14.1 mptt -65.8 -46.02 80.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.0 179.078 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 4.0 m0 -58.51 -41.14 84.76 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.39 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -59.86 -48.12 82.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.817 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 267' ' ' GLU . . . . . 0.542 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 31.3 mt-10 -64.12 -41.63 97.16 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 268' ' ' GLU . . . . . 0.601 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 30.9 mt-10 -60.9 -40.1 91.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.861 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 96.2 mmm -75.6 -39.25 58.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.742 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -62.05 -52.58 63.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.286 0.565 . . . . 10.0 109.612 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.54 -22.44 66.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.504 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 272' ' ' TYR . . . . . 0.601 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 1.0 OUTLIER -78.63 -46.44 19.24 Favored 'General case' 0 C--O 1.221 -0.406 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 178.305 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 43.0 mtt85 -62.98 -33.96 76.52 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.271 0.558 . . . . 10.0 109.78 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -70.63 -7.02 41.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.338 -0.846 . . . . 10.0 110.477 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.714 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 49.5 mttp -112.62 -36.38 5.23 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.493 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 276' ' ' VAL . . . . . 0.6 ' O ' ' HB2' ' A' ' 280' ' ' ARG . 53.5 t -48.96 -49.08 15.96 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.673 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 277' ' ' GLU . . . . . 0.74 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 65.3 mt-10 -62.7 -59.04 13.77 Favored Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 111.747 0.277 . . . . 10.0 111.747 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 278' ' ' PRO . . . . . 0.74 ' HD3' ' HB2' ' A' ' 277' ' ' GLU . 53.3 Cg_exo -56.26 -44.05 50.11 Favored 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 122.032 1.821 . . . . 10.0 111.932 178.681 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.719 ' HB3' ' HE3' ' C' ' 495' ' ' LYS . 34.8 mt -64.74 -40.06 94.69 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 116.578 -0.283 . . . . 10.0 110.304 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 280' ' ' ARG . . . . . 0.6 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 5.5 ttt180 -65.9 -35.36 80.42 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 109.214 -0.661 . . . . 10.0 109.214 178.53 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.94 -44.18 90.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.738 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -61.98 -48.24 81.24 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.9 -43.85 97.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.32 -0.855 . . . . 10.0 110.584 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -63.62 -50.55 68.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.745 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 285' ' ' GLU . . . . . 0.635 ' HA ' ' HD2' ' A' ' 288' ' ' ARG . 8.4 mm-40 -59.15 -45.86 89.87 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.899 0.38 . . . . 10.0 110.139 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.38 -44.64 96.54 Favored Glycine 0 N--CA 1.442 -0.921 0 N-CA-C 111.015 -0.834 . . . . 10.0 111.015 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -62.22 -38.29 88.62 Favored 'General case' 0 C--O 1.221 -0.441 0 N-CA-C 110.438 -0.208 . . . . 10.0 110.438 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 288' ' ' ARG . . . . . 0.635 ' HD2' ' HA ' ' A' ' 285' ' ' GLU . 75.5 mtt180 -58.24 -43.61 87.88 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -71.16 -49.98 38.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.144 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 59.9 mttt -57.48 -49.34 76.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.538 -0.756 . . . . 10.0 111.507 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 69.8 mt -66.46 -34.35 77.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.519 -0.31 . . . . 10.0 110.986 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 292' ' ' HIS . . . . . 0.473 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 0.2 OUTLIER -62.77 -53.25 57.14 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.682 -0.488 . . . . 10.0 109.682 179.194 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.4 -37.55 81.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.633 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 60.8 mt -64.57 -48.63 74.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.8 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -69.74 -33.36 72.35 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.84 0.353 . . . . 10.0 111.037 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.5 -11.2 60.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.148 178.618 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 297' ' ' LYS . . . . . 0.438 ' HE3' HD11 ' A' ' 301' ' ' LEU . 9.8 mttp -103.3 -38.64 7.14 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.94 -0.573 . . . . 10.0 109.84 177.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 298' ' ' LEU . . . . . 0.418 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 59.0 mt -63.73 -19.9 65.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.727 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 299' ' ' SER . . . . . 0.542 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 14.8 m -80.63 -64.7 0.29 Allowed Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 116.578 -0.283 . . . . 10.0 111.736 179.33 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 300' ' ' PRO . . . . . 0.542 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 40.7 Cg_endo -68.72 -51.3 0.51 Allowed 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.954 1.769 . . . . 10.0 111.964 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.616 HD13 ' HG2' ' C' ' 473' ' ' LYS . 93.0 mt -66.81 -25.09 66.28 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.938 0.399 . . . . 10.0 110.193 179.538 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 302' ' ' GLY . . . . . 0.418 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -72.88 -41.19 50.06 Favored Glycine 0 N--CA 1.444 -0.822 0 N-CA-C 109.075 -1.61 . . . . 10.0 109.075 177.392 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -64.41 -41.79 96.44 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 178.067 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -64.11 -31.87 73.23 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.156 -0.475 . . . . 10.0 109.851 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 11.0 tpt -67.68 -42.3 82.34 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.741 -0.837 . . . . 10.0 108.741 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 306' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 306' ' ' ARG . 61.6 mtt180 -69.82 -40.11 76.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.449 -0.796 . . . . 10.0 109.801 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 307' ' ' ASP . . . . . 0.518 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 7.1 t0 -62.37 -43.26 99.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.497 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 308' ' ' ARG . . . . . 1.128 ' HG3' HD11 ' C' ' 469' ' ' LEU . 23.1 mmt180 -70.06 -32.03 69.92 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.547 178.112 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -67.18 -38.65 85.77 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.738 -0.838 . . . . 10.0 108.738 178.18 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 310' ' ' ARG . . . . . 0.518 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 82.3 mtt180 -56.74 -54.68 43.47 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 108.993 -0.743 . . . . 10.0 108.993 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -64.13 -39.82 94.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.498 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 312' ' ' HIS . . . . . 0.408 ' HB2' ' O ' ' A' ' 308' ' ' ARG . 0.1 OUTLIER -57.37 -54.98 40.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.89 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 31.5 t -73.68 -36.2 46.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.636 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 314' ' ' ASP . . . . . 0.723 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 6.0 t70 -63.55 -44.52 93.92 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.874 -0.33 . . . . 10.0 110.553 179.38 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -63.95 -31.97 73.35 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.492 -0.929 . . . . 10.0 108.492 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 316' ' ' LEU . . . . . 0.847 ' HG ' ' HE3' ' C' ' 462' ' ' LYS . 7.3 mt -69.44 -37.36 77.33 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.276 -0.874 . . . . 10.0 109.044 178.125 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 317' ' ' ARG . . . . . 0.723 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 70.2 mtt180 -62.11 -47.2 85.69 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.997 -0.372 . . . . 10.0 109.997 178.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 1.6 m -69.16 -9.24 51.91 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.148 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -104.21 -46.57 4.39 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.642 179.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 96.4 mt -64.17 -34.51 78.23 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.42 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.71 -60.67 8.65 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-O 119.668 -0.206 . . . . 10.0 111.422 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -66.76 -31.29 39.84 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 121.632 1.554 . . . . 10.0 111.494 178.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 323' ' ' TYR . . . . . 0.402 ' CE1' ' HG2' ' C' ' 451' ' ' LYS . 4.6 m-30 -64.84 -42.01 95.26 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.824 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 324' ' ' SER . . . . . 0.473 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 11.9 p -71.93 -38.54 69.83 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 178.793 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 325' ' ' ASP . . . . . 0.439 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 30.4 t0 -62.95 -44.27 96.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.192 0.52 . . . . 10.0 109.638 178.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -71.18 -31.23 67.39 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.42 -32.04 73.36 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.201 -0.666 . . . . 10.0 109.201 178.111 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 328' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' A' ' 324' ' ' SER . 80.9 mtt180 -64.62 -39.44 93.71 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.589 -0.893 . . . . 10.0 108.589 177.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -66.7 -40.43 88.47 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.956 -0.757 . . . . 10.0 108.956 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -63.83 -49.15 73.95 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.459 178.423 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 69.9 mt -58.81 -42.15 88.46 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.878 -0.601 . . . . 10.0 109.607 178.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -62.8 -50.42 71.07 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.591 178.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -56.28 -42.7 77.91 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.889 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 334' ' ' ARG . . . . . 0.451 ' HD3' ' HB3' ' C' ' 440' ' ' GLU . 35.9 mmt180 -71.34 -54.46 10.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.057 -0.52 . . . . 10.0 111.348 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 335' ' ' LEU . . . . . 0.547 ' O ' ' HG3' ' A' ' 339' ' ' LYS . 94.1 mt -63.22 -44.45 95.22 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.78 0.659 . . . . 10.0 112.78 -178.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -63.25 -42.24 99.15 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.543 0.211 . . . . 10.0 110.659 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.39 -38.77 91.0 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.778 -0.823 . . . . 10.0 108.778 178.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 39.5 mt -67.93 -18.85 64.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.955 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 339' ' ' LYS . . . . . 0.547 ' HG3' ' O ' ' A' ' 335' ' ' LEU . 82.5 mttt -75.84 -47.49 25.35 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.934 -0.765 . . . . 10.0 108.934 178.301 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -69.97 -50.35 42.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.545 -0.752 . . . . 10.0 109.3 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 341' ' ' ASN . . . . . 0.649 HD21 ' HA ' ' C' ' 433' ' ' GLU . 8.0 t-20 -61.85 -47.77 83.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.008 -0.996 . . . . 10.0 109.796 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -64.23 -41.25 98.37 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.961 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -58.46 -41.16 95.18 Favored Glycine 0 N--CA 1.45 -0.38 0 N-CA-C 111.05 -0.82 . . . . 10.0 111.05 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -70.36 -39.98 74.3 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 345' ' ' ARG . . . . . 0.518 ' O ' ' HB2' ' A' ' 349' ' ' TYR . 68.7 mtt180 -60.94 -44.24 97.52 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.368 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 66.6 mt -65.67 -44.0 87.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.502 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.65 -48.9 79.72 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 348' ' ' GLU . . . . . 0.423 ' HB3' ' NZ ' ' A' ' 352' ' ' LYS . 12.4 mt-10 -66.17 -33.24 75.33 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.399 -0.819 . . . . 10.0 110.75 179.21 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 349' ' ' TYR . . . . . 0.518 ' HB2' ' O ' ' A' ' 345' ' ' ARG . 1.3 t80 -62.94 -45.3 93.1 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.453 -0.573 . . . . 10.0 109.453 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 -69.33 -38.5 78.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.485 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.63 94.96 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.108 0.48 . . . . 10.0 110.083 178.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 352' ' ' LYS . . . . . 0.423 ' NZ ' ' HB3' ' A' ' 348' ' ' GLU . 14.4 mtmm -81.12 -18.36 46.74 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.117 178.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 353' ' ' ALA . . . . . 0.508 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -72.76 -42.29 64.16 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.259 -0.645 . . . . 10.0 109.259 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -62.39 -36.2 81.57 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.395 -0.595 . . . . 10.0 109.395 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -66.32 -34.57 78.29 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.941 -0.572 . . . . 10.0 109.465 178.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -69.1 -42.94 75.45 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.081 -1.081 . . . . 10.0 108.081 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 86.1 mt -65.15 -40.94 95.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.278 -0.873 . . . . 10.0 112.42 -179.026 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 1.7 p -61.74 -45.75 92.6 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.879 0.371 . . . . 10.0 110.844 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.4 p -70.97 -33.98 70.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.967 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 16.1 mt -66.35 -43.63 85.53 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.625 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 1.8 p -68.55 -28.87 67.35 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.101 0.477 . . . . 10.0 109.877 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -78.11 2.23 18.61 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-O 121.616 0.722 . . . . 10.0 110.034 178.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.451 ' O ' ' HB3' ' A' ' 367' ' ' ALA . 82.5 tttt -117.81 -36.83 3.55 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.401 -0.963 . . . . 10.0 108.401 177.322 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -72.1 -13.06 61.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.613 -0.722 . . . . 10.0 111.688 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.933 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 96.1 mttt -111.91 -70.1 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.552 0 C-N-CA 120.834 -0.346 . . . . 10.0 111.117 178.688 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.933 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 36.0 Cg_exo -60.04 -55.2 1.73 Allowed 'Trans proline' 0 C--N 1.355 0.868 0 C-N-CA 121.928 1.752 . . . . 10.0 112.302 -179.498 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 367' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -64.95 -41.07 95.81 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.304 0.483 . . . . 10.0 112.304 -179.28 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 368' ' ' LEU . . . . . 0.513 HD23 ' HA ' ' A' ' 368' ' ' LEU . 10.9 mt -66.01 -40.65 91.28 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.588 -0.445 . . . . 10.0 111.253 179.314 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -69.92 -32.34 70.59 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.886 -0.783 . . . . 10.0 108.886 178.279 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.78 -42.25 95.23 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.049 -1.093 . . . . 10.0 108.049 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 371' ' ' LEU . . . . . 0.434 HD12 HD23 ' A' ' 368' ' ' LEU . 51.6 mt -66.33 -34.4 77.9 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.154 -0.93 . . . . 10.0 109.936 178.274 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 368' ' ' LEU . 97.9 mtt180 -63.41 -44.87 93.4 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.05 -0.722 . . . . 10.0 109.05 178.164 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -73.03 -5.44 38.9 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.467 -0.788 . . . . 20.0 112.076 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -102.76 -41.15 2.36 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 109.748 -1.341 . . . . 10.0 109.748 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 375' ' ' LEU . . . . . 0.414 ' O ' HG12 ' A' ' 378' ' ' VAL . 89.1 mt -71.34 -37.99 71.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.463 -0.369 . . . . 10.0 111.439 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 58.5 mt -56.43 -59.64 11.49 Favored Pre-proline 0 CA--C 1.534 0.365 0 N-CA-C 112.212 0.449 . . . . 10.0 112.212 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -62.77 -35.37 68.88 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 121.84 1.693 . . . . 10.0 111.718 179.506 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 378' ' ' VAL . . . . . 0.414 HG12 ' O ' ' A' ' 375' ' ' LEU . 0.3 OUTLIER -67.16 -33.71 64.8 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 C-N-CA 120.652 -0.419 . . . . 10.0 110.643 179.646 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.73 -36.2 81.91 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 380' ' ' GLU . . . . . 0.433 ' O ' HG23 ' A' ' 384' ' ' VAL . 14.2 mt-10 -67.72 -44.17 78.25 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.92 -0.582 . . . . 10.0 109.74 178.833 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 13.7 m -62.25 -40.85 97.55 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.058 -0.719 . . . . 10.0 109.058 178.064 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -65.4 -43.01 91.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.247 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -57.78 -50.1 74.38 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.598 -0.274 . . . . 10.0 110.91 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 384' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 380' ' ' GLU . 81.7 t -59.07 -46.32 91.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.347 179.519 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 14.7 m -66.91 -40.67 87.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.914 -0.584 . . . . 10.0 111.682 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -68.44 -45.96 71.11 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.012 0.375 . . . . 10.0 112.012 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 37.4 mt -59.88 -43.29 94.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.034 0.445 . . . . 10.0 110.627 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 388' ' ' SER . . . . . 0.437 ' O ' ' HB2' ' A' ' 392' ' ' GLU . 34.0 p -75.95 -16.2 60.04 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.502 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -87.0 -48.63 7.95 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.985 -0.376 . . . . 10.0 109.985 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 77.9 mt -59.9 -42.45 93.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.051 0.453 . . . . 10.0 109.834 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -64.75 -36.35 84.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.639 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 392' ' ' GLU . . . . . 0.47 ' OE1' ' HA ' ' A' ' 392' ' ' GLU . 0.0 OUTLIER -66.88 -49.56 65.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.533 -179.831 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -55.79 -50.03 71.57 Favored 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.743 0.652 . . . . 10.0 111.643 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 5.0 m -60.92 -32.73 72.22 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.589 -0.732 . . . . 10.0 111.089 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt . . . . . 0 CA--C 1.529 0.143 0 CA-C-O 120.658 0.266 . . . . 10.0 111.209 179.98 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 58.7 mt . . . . . 0 N--CA 1.455 -0.225 0 CA-C-O 120.631 0.253 . . . . 10.0 111.664 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -62.33 -23.84 67.0 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.061 0.457 . . . . 10.0 111.073 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -79.01 -50.07 11.69 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.118 -0.697 . . . . 10.0 109.118 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -58.79 -44.72 90.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.243 -0.89 . . . . 10.0 110.394 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 25.9 m0 -64.76 -32.58 74.32 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.953 -0.567 . . . . 10.0 111.419 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -61.67 -50.27 73.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.452 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -37.51 87.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.21 0.528 . . . . 10.0 110.602 179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 74.9 t -67.99 -41.86 84.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.964 178.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 81.9 m -62.71 -48.08 80.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.795 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 2.5 p -60.86 -46.2 91.55 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.683 0.278 . . . . 10.0 111.206 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 12.1 p -66.19 -39.01 89.36 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.906 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -66.24 -40.03 89.95 Favored 'General case' 0 CA--C 1.522 -0.106 0 CA-C-N 116.552 -0.295 . . . . 10.0 110.402 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 413' ' ' SER . . . . . 0.407 ' O ' ' HG3' ' C' ' 417' ' ' GLU . 30.8 m -63.15 -48.22 79.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.438 . . . . 10.0 110.012 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -66.62 -29.11 69.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.681 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 53.0 tp -67.31 -46.38 73.71 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.309 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 61.2 mtt180 -62.59 -40.49 97.07 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.669 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 417' ' ' GLU . . . . . 0.624 ' O ' ' HD2' ' C' ' 421' ' ' PRO . 27.6 mt-10 -61.77 -48.6 79.93 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.778 -0.646 . . . . 10.0 109.813 178.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -60.18 -42.67 95.49 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.768 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 49.0 mt -57.48 -26.77 61.76 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.612 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -56.57 -78.09 0.14 Allowed Glycine 0 CA--C 1.52 0.377 0 C-N-CA 120.957 -0.64 . . . . 10.0 111.613 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 421' ' ' PRO . . . . . 0.624 ' HD2' ' O ' ' C' ' 417' ' ' GLU . 12.4 Cg_endo -57.64 -33.4 96.6 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.901 2.401 . . . . 10.0 111.95 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 422' ' ' VAL . . . . . 0.401 HG22 ' HG2' ' A' ' 352' ' ' LYS . 21.9 t -61.72 -49.15 85.49 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 CA-C-N 116.717 -0.22 . . . . 10.0 111.004 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 19.7 m -69.78 -34.7 74.11 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 110.075 -0.342 . . . . 10.0 110.075 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -61.92 -49.99 73.94 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.221 -0.659 . . . . 10.0 109.221 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 425' ' ' GLU . . . . . 0.421 ' HB3' ' NZ ' ' A' ' 352' ' ' LYS . 59.4 mt-10 -63.63 -40.79 97.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.703 -0.68 . . . . 10.0 109.212 178.371 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -58.27 -43.07 87.8 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.937 179.2 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 28.5 m0 -67.87 -36.48 80.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.865 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 428' ' ' ASP . . . . . 0.418 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 15.1 t70 -70.53 -30.13 66.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.504 0.668 . . . . 10.0 109.429 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 429' ' ' ASN . . . . . 0.452 HD21 ' HA ' ' A' ' 345' ' ' ARG . 7.0 t-20 -73.46 -38.95 65.3 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.232 -1.025 . . . . 10.0 108.232 177.588 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 430' ' ' LEU . . . . . 0.447 ' HA ' ' HB2' ' C' ' 433' ' ' GLU . 42.0 mt -68.31 -24.02 64.8 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 177.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -67.01 -47.94 69.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.118 -1.438 . . . . 10.0 107.118 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 432' ' ' LYS . . . . . 0.418 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 49.6 mttp -65.65 -36.73 84.52 Favored 'General case' 0 C--N 1.333 -0.11 0 N-CA-C 108.576 -0.898 . . . . 10.0 108.576 178.597 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 433' ' ' GLU . . . . . 0.649 ' HA ' HD21 ' A' ' 341' ' ' ASN . 3.7 tm-20 -59.47 -57.67 11.94 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.105 -0.952 . . . . 10.0 109.454 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 33.8 m -63.48 -42.93 98.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.59 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -63.15 -41.2 99.23 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.782 0.325 . . . . 10.0 110.457 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -66.54 -48.56 61.94 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 110.013 -1.235 . . . . 10.0 110.013 178.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 14.9 mt -59.82 -33.63 72.0 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 120.499 0.19 . . . . 10.0 110.527 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 27.7 mtt180 -62.62 -38.91 92.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.464 -0.335 . . . . 10.0 110.769 179.059 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -67.64 -40.19 84.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.341 0.591 . . . . 10.0 109.697 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 440' ' ' GLU . . . . . 0.451 ' HB3' ' HD3' ' A' ' 334' ' ' ARG . 35.8 mt-10 -72.04 -50.08 31.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.301 -0.863 . . . . 10.0 110.91 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 92.1 mmm -63.49 -37.53 87.66 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.795 1.035 . . . . 10.0 113.795 -178.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 4.4 p -59.47 -45.65 91.04 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 443' ' ' LYS . . . . . 0.419 ' O ' ' HB2' ' C' ' 447' ' ' GLU . 80.6 mttt -70.46 -42.13 71.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.461 -0.79 . . . . 10.0 109.82 178.35 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -58.23 -48.17 81.22 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.739 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 78.2 mt -61.86 -50.11 73.54 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.678 0.251 . . . . 10.0 111.678 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -62.82 -42.94 99.93 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.822 0.344 . . . . 10.0 110.412 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 447' ' ' GLU . . . . . 0.594 ' O ' ' HB2' ' C' ' 451' ' ' LYS . 3.1 mt-10 -66.05 -43.13 88.4 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.31 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 2.8 p -66.76 -33.95 66.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 121.087 -0.245 . . . . 10.0 111.204 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -73.93 -43.58 57.85 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.996 0.426 . . . . 10.0 110.069 178.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -72.01 -11.8 60.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.915 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 451' ' ' LYS . . . . . 0.594 ' HB2' ' O ' ' C' ' 447' ' ' GLU . 0.2 OUTLIER -104.09 -30.41 10.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.975 179.399 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 5.4 p -69.76 -29.9 42.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.746 0.308 . . . . 10.0 110.567 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 453' ' ' GLN . . . . . 0.804 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 50.7 mt-30 -62.84 -59.6 12.1 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.198 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 454' ' ' PRO . . . . . 0.804 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 37.2 Cg_exo -63.58 -29.56 70.29 Favored 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 122.079 1.853 . . . . 10.0 110.952 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 455' ' ' TYR . . . . . 0.545 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.1 OUTLIER -69.3 -48.08 62.64 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.264 179.528 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 18.0 mt -64.77 -38.39 90.81 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 178.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -63.57 -50.24 70.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.903 -0.589 . . . . 10.0 109.816 178.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 458' ' ' ASP . . . . . 0.546 ' O ' ' HG3' ' C' ' 462' ' ' LYS . 19.0 t70 -62.07 -45.66 92.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.824 -0.626 . . . . 10.0 109.691 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -62.24 -41.24 98.25 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.841 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -64.09 -40.06 95.41 Favored 'General case' 0 C--O 1.225 -0.225 0 N-CA-C 109.562 -0.533 . . . . 10.0 109.562 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 43.0 mttp -61.08 -41.91 97.53 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 108.703 -0.851 . . . . 10.0 108.703 178.115 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 462' ' ' LYS . . . . . 0.847 ' HE3' ' HG ' ' A' ' 316' ' ' LEU . 35.1 mttm -66.6 -42.05 87.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.358 -0.837 . . . . 10.0 109.906 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 13.8 m0 -64.2 -35.18 79.95 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.043 178.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -67.49 -46.06 74.05 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 1.088 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 42.2 mt-10 -60.24 -44.25 95.4 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 121.191 0.52 . . . . 10.0 109.901 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -71.61 -48.09 50.31 Favored 'General case' 0 C--O 1.217 -0.652 0 CA-C-N 115.486 -0.779 . . . . 10.0 112.402 -179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 11.3 mmt -60.17 -43.94 95.43 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.802 -0.359 . . . . 10.0 110.582 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -65.33 -46.53 79.89 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.793 -0.817 . . . . 10.0 108.793 178.338 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 1.128 HD11 ' HG3' ' A' ' 308' ' ' ARG . 96.2 mt -59.64 -46.3 89.42 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 115.39 -0.823 . . . . 20.0 111.499 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 19.3 m-30 -63.87 -44.14 93.99 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.99 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 19.5 ttm105 -65.23 -47.06 78.15 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.621 0.248 . . . . 10.0 111.219 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -65.01 -9.2 19.96 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.274 -0.421 . . . . 10.0 112.055 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 473' ' ' LYS . . . . . 0.616 ' HG2' HD13 ' A' ' 301' ' ' LEU . 87.4 mttt -111.84 -43.67 3.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.648 -0.251 . . . . 10.0 111.188 179.108 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 42.4 t -64.95 -38.57 83.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.79 -0.186 . . . . 10.0 110.848 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -58.13 -59.7 12.47 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 120.879 -0.328 . . . . 10.0 111.311 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -65.32 -35.67 39.24 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 121.649 1.566 . . . . 10.0 111.384 178.319 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 477' ' ' LEU . . . . . 0.42 ' HB2' ' O ' ' C' ' 473' ' ' LYS . 10.2 mt -62.08 -41.95 98.7 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 109.82 -0.437 . . . . 10.0 109.82 179.069 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -63.16 -35.05 79.01 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 479' ' ' ALA . . . . . 0.606 ' O ' ' HG2' ' C' ' 483' ' ' GLU . . . -68.71 -51.33 42.74 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.767 -0.652 . . . . 10.0 109.298 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -62.93 -36.87 84.85 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.335 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 35.9 mt -66.09 -35.25 80.02 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -69.84 -36.71 75.8 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.165 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 483' ' ' GLU . . . . . 0.606 ' HG2' ' O ' ' C' ' 479' ' ' ALA . 61.1 mm-40 -63.57 -48.83 75.81 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 107.699 -1.223 . . . . 10.0 107.699 177.65 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -65.85 -33.37 85.6 Favored Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 114.999 -1.0 . . . . 10.0 111.319 178.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.63 -44.79 73.48 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 110.356 -0.239 . . . . 10.0 110.356 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -63.83 -39.57 94.53 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.125 -0.694 . . . . 10.0 109.125 178.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -65.33 -49.35 69.75 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.659 -0.867 . . . . 10.0 108.659 177.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -59.04 -38.99 80.62 Favored 'General case' 0 CA--C 1.522 -0.11 0 CA-C-N 115.943 -0.572 . . . . 10.0 110.613 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 39.3 mt -63.32 -44.23 95.54 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -69.61 -37.24 76.78 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.666 -0.494 . . . . 10.0 109.666 178.416 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -60.16 -43.84 95.48 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 177.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 58.2 mt -71.6 -37.56 70.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.569 179.05 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -61.6 -40.41 94.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.646 0.26 . . . . 10.0 110.305 179.059 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -75.66 9.59 2.19 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.081 -0.509 . . . . 10.0 111.009 178.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.719 ' HE3' ' HB3' ' A' ' 279' ' ' LEU . 56.8 mttp -123.2 -55.14 1.78 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.621 -0.718 . . . . 10.0 109.192 178.413 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 91.5 mt -61.23 -33.71 73.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.855 -0.612 . . . . 10.0 112.39 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 497' ' ' SER . . . . . 0.452 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 13.6 m -69.8 -61.04 3.25 Favored Pre-proline 0 CA--C 1.536 0.417 0 C-N-CA 120.734 -0.387 . . . . 10.0 111.668 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 498' ' ' PRO . . . . . 0.452 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 37.1 Cg_endo -65.17 -48.09 3.9 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 121.708 1.606 . . . . 10.0 111.801 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 499' ' ' LEU . . . . . 0.633 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 12.4 mt -66.26 -34.01 77.03 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-N 116.908 -0.133 . . . . 10.0 110.983 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.87 -50.94 55.74 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.524 -0.846 . . . . 10.0 111.002 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -67.0 -34.28 77.4 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.931 0.396 . . . . 10.0 110.337 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 502' ' ' GLU . . . . . 0.512 ' HG2' ' HE ' ' C' ' 506' ' ' ARG . 27.7 tt0 -69.2 -46.66 66.88 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 178.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 503' ' ' MET . . . . . 0.707 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 58.4 mmm -61.22 -32.26 72.03 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 178.584 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -64.97 -44.5 89.17 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 505' ' ' ASP . . . . . 0.505 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 1.1 t0 -68.15 -38.53 82.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.887 -0.597 . . . . 10.0 109.872 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.707 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 52.0 mtt180 -61.26 -45.28 95.18 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 107.963 -1.125 . . . . 10.0 107.963 177.582 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -62.25 -42.93 99.76 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.342 -0.844 . . . . 10.0 109.596 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 508' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' C' ' 512' ' ' ASP . 63.7 mtt180 -58.86 -49.44 77.74 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.596 -0.52 . . . . 10.0 109.596 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -61.41 -38.52 87.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.69 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 510' ' ' HIS . . . . . 0.497 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 5.7 m-70 -70.18 -51.41 31.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.778 179.784 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 66.7 t -65.29 -42.17 93.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.667 -179.155 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.531 ' HB2' ' O ' ' C' ' 508' ' ' ARG . 0.1 OUTLIER -64.62 -34.56 78.57 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.589 -0.523 . . . . 10.0 109.589 179.24 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -69.97 -39.82 75.75 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.548 -1.279 . . . . 10.0 107.548 177.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 514' ' ' LEU . . . . . 0.505 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 81.9 mt -64.61 -28.67 69.78 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.901 -0.591 . . . . 10.0 109.899 178.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 515' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' C' ' 512' ' ' ASP . 28.8 mtt180 -62.37 -30.93 71.54 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.568 -0.53 . . . . 10.0 109.568 178.297 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.13 2.23 24.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.691 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 517' ' ' HIS . . . . . 0.505 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 50.7 m170 -115.07 -16.4 11.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.505 -179.797 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 93.2 mt -111.95 -55.0 2.56 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.652 -0.249 . . . . 10.0 111.448 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -50.71 -60.19 5.94 Favored Pre-proline 0 N--CA 1.468 0.465 0 N-CA-C 113.134 0.79 . . . . 10.0 113.134 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -66.5 -29.22 44.96 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.44 1.426 . . . . 10.0 110.98 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 521' ' ' TYR . . . . . 0.438 ' HA ' ' OE1' ' C' ' 524' ' ' GLU . 63.9 t80 -66.19 -45.03 82.23 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.188 -0.46 . . . . 10.0 109.992 179.517 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 522' ' ' SER . . . . . 0.465 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 11.1 p -66.83 -29.22 69.1 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.882 -0.414 . . . . 10.0 109.882 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 523' ' ' ASP . . . . . 0.793 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 12.7 t70 -70.76 -41.02 72.31 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 178.56 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 524' ' ' GLU . . . . . 0.438 ' OE1' ' HA ' ' C' ' 521' ' ' TYR . 72.7 mt-10 -63.22 -39.54 94.91 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 107.704 -1.221 . . . . 10.0 107.704 177.219 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 32.9 mt -64.0 -36.25 83.35 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.151 -0.931 . . . . 10.0 109.426 177.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 526' ' ' ARG . . . . . 0.793 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 78.6 mtt180 -60.59 -38.78 85.78 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -65.28 -45.37 84.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.24 0.543 . . . . 10.0 109.694 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -68.25 -41.31 81.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.443 -0.799 . . . . 10.0 110.121 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 53.3 mt -65.21 -35.08 79.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.204 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 530' ' ' ALA . . . . . 0.537 ' O ' ' HG2' ' C' ' 534' ' ' GLU . . . -61.36 -46.4 90.37 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.38 -39.39 89.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.821 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 532' ' ' ARG . . . . . 0.634 HH21 ' HB3' ' A' ' 242' ' ' GLU . 4.4 ttm180 -60.79 -39.69 89.79 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 178.393 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 533' ' ' LEU . . . . . 0.404 ' O ' ' HG3' ' C' ' 537' ' ' LYS . 71.5 mt -72.05 -33.96 68.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.575 -0.738 . . . . 10.0 109.914 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 534' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' C' ' 530' ' ' ALA . 71.1 mm-40 -59.36 -43.91 92.76 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 178.711 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.61 -40.88 98.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.366 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 94.9 mt -69.66 -11.37 60.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.778 -0.646 . . . . 10.0 111.171 179.262 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 537' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' C' ' 533' ' ' LEU . 77.9 mttt -94.18 -51.87 4.63 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.924 -0.769 . . . . 10.0 108.924 178.303 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -59.28 -54.75 43.28 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.585 -0.734 . . . . 10.0 110.044 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -75.83 -23.97 55.81 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.725 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.22 -54.33 24.53 Favored Glycine 0 N--CA 1.449 -0.484 0 N-CA-C 111.176 -0.769 . . . . 10.0 111.176 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.7 -34.34 89.37 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 110.988 -0.845 . . . . 10.0 110.988 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -66.28 -53.21 39.4 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 55.2 mtt85 -59.57 -34.89 73.27 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.378 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 58.7 mt -63.27 -41.09 98.99 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.142 0.496 . . . . 10.0 109.775 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -72.83 -40.84 65.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.611 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 546' ' ' GLU . . . . . 0.404 ' O ' ' HD2' ' C' ' 550' ' ' LYS . 44.2 mt-10 -60.65 -50.49 73.29 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.816 -0.629 . . . . 10.0 109.544 178.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -58.92 -38.61 79.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.062 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.55 -43.17 94.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.155 179.003 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 549' ' ' ALA . . . . . 0.45 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -66.15 -49.77 66.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.753 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 550' ' ' LYS . . . . . 0.404 ' HD2' ' O ' ' C' ' 546' ' ' GLU . 0.0 OUTLIER -61.4 -36.64 80.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.851 179.491 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.06 -40.84 95.28 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 71.0 m -62.54 -49.17 76.39 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.944 -0.761 . . . . 10.0 108.944 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 553' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 44.3 mt-10 -60.49 -38.71 85.19 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.175 178.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -66.45 -38.37 87.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.278 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 75.2 mt -67.44 -35.69 79.73 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 178.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 16.9 m -70.01 -37.69 75.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.259 0.552 . . . . 10.0 109.796 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 3.1 p -78.55 -5.0 51.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.519 0.676 . . . . 10.0 110.156 179.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 19.7 mt -98.88 -30.42 12.39 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.25 -0.886 . . . . 10.0 109.64 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.97 -30.33 69.59 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.027 0.441 . . . . 10.0 110.117 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -71.36 -5.76 34.96 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 121.505 0.669 . . . . 10.0 110.06 178.417 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 561' ' ' LYS . . . . . 0.479 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 11.3 mptt -113.12 -35.17 5.46 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.516 -0.766 . . . . 10.0 109.175 177.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -65.65 -24.91 67.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.248 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 563' ' ' LYS . . . . . 0.957 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 39.6 mtmt -102.89 -73.14 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.463 0 CA-C-O 119.208 -0.425 . . . . 10.0 111.969 179.167 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 564' ' ' PRO . . . . . 0.957 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 31.2 Cg_exo -58.95 -51.38 6.96 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 122.444 2.096 . . . . 10.0 113.735 -178.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 565' ' ' ALA . . . . . 0.479 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -64.13 -52.28 59.85 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.617 0.228 . . . . 10.0 111.617 -179.55 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 566' ' ' LEU . . . . . 0.599 HD23 HD12 ' C' ' 569' ' ' LEU . 16.5 mt -59.88 -40.73 89.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.864 -0.153 . . . . 10.0 111.4 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 567' ' ' GLU . . . . . 0.536 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 22.1 mm-40 -63.06 -45.43 92.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.719 0.295 . . . . 10.0 110.709 178.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -66.67 -32.57 73.96 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.732 -0.387 . . . . 10.0 110.382 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 569' ' ' LEU . . . . . 0.599 HD12 HD23 ' C' ' 566' ' ' LEU . 38.1 mt -63.2 -39.09 93.63 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 177.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 570' ' ' ARG . . . . . 0.434 ' HA ' ' HB2' ' C' ' 573' ' ' LEU . 84.4 mtt180 -71.95 -36.92 70.02 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.154 -0.684 . . . . 10.0 109.154 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 571' ' ' GLN . . . . . 0.536 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.7 mt-30 -64.01 -23.38 67.31 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.218 -0.901 . . . . 20.0 111.292 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -94.91 -33.0 6.84 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 109.317 -1.513 . . . . 10.0 109.317 178.034 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 573' ' ' LEU . . . . . 0.588 ' HA ' HG12 ' C' ' 576' ' ' VAL . 13.9 mt -62.46 -41.0 98.45 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.938 0.347 . . . . 10.0 111.938 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 574' ' ' LEU . . . . . 0.402 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 90.0 mt -58.26 -60.12 11.2 Favored Pre-proline 0 C--N 1.327 -0.389 0 C-N-CA 121.145 -0.222 . . . . 10.0 111.543 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 575' ' ' PRO . . . . . 0.402 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 30.0 Cg_endo -65.08 -31.42 54.99 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 122.052 1.835 . . . . 10.0 112.155 178.65 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 576' ' ' VAL . . . . . 0.588 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.8 OUTLIER -68.13 -36.51 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 C-N-CA 120.7 -0.4 . . . . 10.0 110.251 179.145 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 34.5 mt -71.26 -35.77 71.52 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 578' ' ' GLU . . . . . 0.456 ' O ' HG23 ' C' ' 582' ' ' VAL . 68.7 mt-10 -64.8 -50.35 67.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.125 178.855 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 2.7 p -64.6 -42.1 95.78 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.424 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 580' ' ' PHE . . . . . 0.519 ' HB2' ' O ' ' C' ' 576' ' ' VAL . 0.5 OUTLIER -60.48 -42.05 95.49 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 178.964 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 581' ' ' LYS . . . . . 0.442 ' O ' ' HG ' ' C' ' 585' ' ' LEU . 66.3 mttt -65.38 -38.86 91.3 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-N 115.932 -0.577 . . . . 10.0 110.679 178.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 582' ' ' VAL . . . . . 0.456 HG23 ' O ' ' C' ' 578' ' ' GLU . 49.0 t -59.38 -49.56 83.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 N-CA-C 109.437 -0.579 . . . . 10.0 109.437 178.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 4.6 m -62.78 -40.12 96.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.876 178.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 584' ' ' PHE . . . . . 0.462 ' O ' ' HG ' ' C' ' 588' ' ' LEU . 0.8 OUTLIER -63.59 -45.63 89.54 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.958 -0.565 . . . . 10.0 111.066 179.425 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 585' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' C' ' 581' ' ' LYS . 52.7 mt -59.97 -42.3 93.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.306 -0.407 . . . . 10.0 110.272 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 586' ' ' SER . . . . . 0.504 ' O ' ' HG3' ' C' ' 590' ' ' GLU . 20.8 m -67.56 -46.91 71.35 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.01 -0.737 . . . . 10.0 109.01 178.528 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -55.9 -50.92 69.34 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.596 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 588' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' C' ' 584' ' ' PHE . 97.0 mt -55.41 -54.0 49.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.845 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 589' ' ' GLU . . . . . 0.407 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 18.4 mt-10 -65.07 -50.08 67.55 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.941 0.348 . . . . 10.0 111.941 -179.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 590' ' ' GLU . . . . . 0.504 ' HG3' ' O ' ' C' ' 586' ' ' SER . 35.7 mt-10 -60.38 -37.44 80.78 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -179.147 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -71.18 -39.85 71.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.536 0.207 . . . . 10.0 111.069 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 83.8 m -59.52 -33.81 71.84 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.963 0.411 . . . . 10.0 110.401 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 593' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 93.8 mttt -63.93 -22.36 66.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.833 -0.621 . . . . 10.0 111.583 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 594' ' ' LYS . . . . . 0.408 ' NZ ' ' HB2' ' A' ' 388' ' ' SER . 0.0 OUTLIER -101.67 -24.62 14.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.896 0.379 . . . . 10.0 110.699 179.093 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 81.3 mt -75.95 -31.19 58.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.326 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 . . . . . 0 C--O 1.245 0.823 0 CA-C-O 118.566 -0.731 . . . . 10.0 110.495 179.823 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 2.7 m . . . . . 0 C--O 1.234 0.24 0 CA-C-O 121.126 0.488 . . . . 10.0 111.085 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -81.39 144.51 31.38 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.292 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -128.93 109.48 11.28 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.661 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 40.8 mmtt -93.41 106.07 18.07 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.356 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.536 ' HB3' HD23 ' B' ' 159' ' ' LEU . 8.7 mt -102.6 108.4 19.66 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.733 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 49.9 t -99.89 115.04 40.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.189 0.518 . . . . 10.0 110.61 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.495 HG22 HD12 ' B' ' 79' ' ' LEU . 39.3 t -87.73 112.35 23.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.594 HG21 HD11 ' B' ' 100' ' ' ILE . 17.6 m -108.95 160.16 7.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.826 0.346 . . . . 10.0 111.038 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 158.35 171.86 24.76 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.596 -0.812 . . . . 10.0 111.938 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.41 -176.82 3.31 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.156 0.503 . . . . 10.0 112.13 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -92.51 111.41 4.06 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.005 -0.617 . . . . 10.0 112.489 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 124.08 -20.28 7.16 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.905 -0.664 . . . . 10.0 111.959 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 14' ' ' VAL . . . . . 0.446 HG23 ' HG3' ' B' ' 16' ' ' LYS . 24.8 m -53.38 -51.67 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 112.658 0.614 . . . . 10.0 112.658 -179.459 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.55 29.54 1.41 Allowed Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.461 -0.876 . . . . 10.0 113.944 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 16' ' ' LYS . . . . . 0.446 ' HG3' HG23 ' B' ' 14' ' ' VAL . 49.8 mtmt -58.73 -51.21 70.92 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.258 0.551 . . . . 10.0 110.715 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.09 -44.66 91.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.325 -0.852 . . . . 10.0 111.484 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.32 -46.22 89.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.35 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 46.4 mt -62.6 -39.15 92.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.837 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 18.6 m -67.8 -45.86 73.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.791 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 67.5 mt -65.48 -31.67 54.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.173 0.511 . . . . 10.0 110.087 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.484 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 6.4 tp-100 -69.58 -20.53 63.65 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.332 179.002 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 6.8 tp -92.16 -46.74 7.6 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.415 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 24' ' ' ILE . . . . . 0.455 HD11 HD13 ' B' ' 55' ' ' ILE . 40.8 mm -75.73 -63.8 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 112.781 0.66 . . . . 10.0 112.781 -178.548 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -87.79 -15.86 35.73 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.025 0.38 . . . . 10.0 112.025 -178.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.484 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 64.6 t30 66.21 47.67 1.8 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.629 0.728 . . . . 10.0 110.046 -179.373 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 51.6 t60 -143.14 134.62 26.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.458 -0.792 . . . . 10.0 110.388 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -93.35 133.65 36.38 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.381 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 6.1 m -98.19 137.45 25.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.095 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -94.26 -18.15 21.95 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.359 0.599 . . . . 10.0 110.467 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -93.2 175.88 6.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.692 -0.686 . . . . 10.0 111.684 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.615 ' O ' ' HD3' ' B' ' 34' ' ' PRO . 70.5 t80 -94.95 133.99 38.1 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.872 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -101.31 95.81 5.35 Favored Pre-proline 0 C--O 1.235 0.298 0 N-CA-C 110.113 -0.328 . . . . 10.0 110.113 178.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 34' ' ' PRO . . . . . 0.615 ' HD3' ' O ' ' B' ' 32' ' ' TYR . 23.0 Cg_exo -66.31 103.97 0.7 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.545 2.163 . . . . 10.0 108.509 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 87.8 m -120.32 141.12 50.32 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 114.117 1.154 . . . . 10.0 114.117 -176.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.463 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 5.0 mp -113.82 -28.58 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 N-CA-C 106.583 -1.636 . . . . 10.0 106.583 176.307 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.434 ' HB3' HG23 ' D' ' 821' ' ' VAL . 30.1 tt0 -176.65 103.5 0.06 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 114.651 -1.159 . . . . 10.0 110.378 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 38' ' ' ASP . . . . . 1.034 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 52.6 m-20 -114.35 139.03 49.8 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.034 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 39' ' ' SER . . . . . 0.558 ' HB2' ' HB3' ' D' ' 818' ' ' GLN . 4.0 m -116.01 131.0 57.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.91 0.385 . . . . 10.0 111.8 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 40' ' ' TYR . . . . . 0.401 ' HB3' HG13 ' B' ' 24' ' ' ILE . 93.2 m-85 -129.81 150.06 51.27 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.111 -0.7 . . . . 10.0 109.111 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 41' ' ' ARG . . . . . 0.483 ' HB2' ' NE2' ' D' ' 818' ' ' GLN . 35.4 ttp180 -165.1 136.98 4.23 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.08 -0.248 . . . . 10.0 111.436 -178.813 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 7.4 tttm -150.58 162.9 39.75 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.376 -0.601 . . . . 10.0 109.376 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -103.09 118.15 36.16 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.886 -0.412 . . . . 10.0 109.886 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 9.1 m -139.36 166.99 20.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-O 121.056 0.455 . . . . 10.0 111.303 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.555 ' HA ' ' HA ' ' B' ' 50' ' ' THR . 10.9 t -96.93 129.23 47.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 109.122 -0.696 . . . . 10.0 109.122 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 46' ' ' ILE . . . . . 0.727 HD13 HG11 ' B' ' 160' ' ' VAL . 9.6 mt -113.29 94.38 3.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.752 0.311 . . . . 10.0 111.095 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 61.56 41.17 12.74 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.521 -0.763 . . . . 10.0 111.744 178.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.56 -33.19 6.04 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.532 -0.758 . . . . 10.0 112.284 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -91.87 111.67 23.29 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.778 0.323 . . . . 10.0 110.928 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.555 ' HA ' ' HA ' ' B' ' 45' ' ' VAL . 3.8 m -76.74 132.3 39.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.782 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 73.5 m -148.75 175.64 11.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.749 0.309 . . . . 10.0 111.368 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 22.3 tp -106.56 126.27 52.05 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.596 -0.52 . . . . 10.0 109.596 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.462 HD22 HD11 ' B' ' 6' ' ' LEU . 66.7 mt -105.76 126.82 52.61 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.5 0.556 . . . . 10.0 112.5 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -106.56 117.04 33.0 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.129 -1.063 . . . . 10.0 108.129 178.57 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.455 HD13 HD11 ' B' ' 24' ' ' ILE . 4.0 mp -113.5 143.53 23.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 120.598 0.237 . . . . 10.0 111.125 -178.841 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 12.4 tp -128.1 122.71 32.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.895 0.378 . . . . 10.0 111.823 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 1.034 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 12.6 t0 -88.51 105.95 17.96 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 107.429 -1.323 . . . . 10.0 107.429 178.447 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 27.1 p -80.9 164.65 22.47 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.539 0.94 . . . . 10.0 113.539 -177.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 59' ' ' ALA . . . . . 0.463 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -73.22 140.0 46.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.218 179.045 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.68 -9.78 60.95 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.607 -0.806 . . . . 10.0 112.413 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -141.13 79.21 1.68 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.198 0.523 . . . . 20.0 110.241 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -134.62 152.83 52.06 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.057 -179.197 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -103.42 -154.45 0.5 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.319 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -82.79 103.0 11.95 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.3 -0.56 . . . . 10.0 111.099 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -123.14 143.07 50.24 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.708 -0.678 . . . . 10.0 109.84 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.37 -30.98 71.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.949 0.404 . . . . 10.0 110.396 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 1.1 mmt -61.42 -45.95 92.15 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.561 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.446 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 14.4 ttm180 -64.21 -43.58 94.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.545 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.444 ' O ' ' HB2' ' B' ' 73' ' ' ARG . 0.1 OUTLIER -62.4 -19.2 63.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.761 -0.654 . . . . 10.0 111.357 179.921 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -97.03 -45.75 6.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.298 179.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 71' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' B' ' 68' ' ' ARG 0.282 0.6 OUTLIER -69.05 -25.44 64.47 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 113.124 0.787 . . . . 10.0 113.124 -179.077 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 34.0 mtp -93.72 2.25 56.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.237 0.541 . . . . 10.0 110.134 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 73' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' B' ' 69' ' ' ASP . 10.8 ttm180 -95.54 -25.86 16.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.731 -179.634 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.44 -4.17 58.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.7 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -83.81 156.53 33.08 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.752 -0.737 . . . . 10.0 112.687 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -113.88 -46.49 3.02 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.188 0.518 . . . . 10.0 109.693 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 77' ' ' GLY . . . . . 0.426 ' HA3' HD11 ' B' ' 163' ' ' ILE . . . -111.63 137.26 14.16 Favored Glycine 0 N--CA 1.444 -0.797 0 N-CA-C 110.161 -1.176 . . . . 10.0 110.161 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -122.02 124.11 43.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.26 0.552 . . . . 10.0 112.406 -178.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.929 ' HG ' HD22 ' B' ' 159' ' ' LEU . 70.2 mt -97.18 110.27 22.85 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.472 -0.785 . . . . 10.0 109.685 179.068 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 80' ' ' CYS . . . . . 0.54 ' HB3' HD12 ' B' ' 93' ' ' ILE . 26.3 m -85.94 92.81 8.78 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.491 HG22 ' HB ' ' B' ' 114' ' ' VAL . 47.1 t -91.36 121.96 42.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.847 -0.615 . . . . 10.0 112.203 -178.493 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.736 ' HB3' HD11 ' B' ' 93' ' ' ILE . 29.7 p90 -128.33 158.95 36.8 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.419 -0.81 . . . . 10.0 109.066 178.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -100.13 126.05 46.33 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 110.088 -0.338 . . . . 10.0 110.088 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 84' ' ' ILE . . . . . 0.769 HD11 ' HA ' ' B' ' 118' ' ' CYS . 32.0 pt -69.49 -9.98 12.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.394 0.616 . . . . 10.0 110.288 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 85' ' ' ASN . . . . . 0.415 ' HA ' ' O ' ' B' ' 122' ' ' SER . 0.0 OUTLIER -87.68 -11.83 47.18 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.095 -0.957 . . . . 10.0 110.353 179.298 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -133.08 106.86 7.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.028 -178.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.26 -31.67 70.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.698 -0.683 . . . . 10.0 112.357 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -61.42 -35.58 77.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.696 0.284 . . . . 10.0 110.493 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 15.6 m -66.5 -32.69 74.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.475 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 90' ' ' PHE . . . . . 0.439 ' CE1' ' HA ' ' B' ' 130' ' ' ALA . 51.5 t80 -68.64 -39.08 80.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.55 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -76.67 -25.76 54.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.259 0.552 . . . . 10.0 110.621 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -68.63 -17.64 64.15 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.841 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 93' ' ' ILE . . . . . 0.736 HD11 ' HB3' ' B' ' 82' ' ' PHE . 34.2 mm -57.92 -39.53 72.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.742 179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 67.0 t60 -67.5 -37.5 82.93 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.61 -0.515 . . . . 10.0 109.61 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -63.45 -36.09 82.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.577 -0.738 . . . . 10.0 110.022 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 96' ' ' TYR . . . . . 0.483 ' CD1' ' HB ' ' B' ' 9' ' ' VAL . 1.1 m-85 -80.01 -40.41 27.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.435 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 97' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' B' ' 97' ' ' ARG . 1.9 ttm180 -56.65 -45.25 81.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.558 -0.292 . . . . 10.0 111.177 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 63.1 mm-40 -64.35 -38.76 92.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.906 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -62.71 -42.49 99.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.0 -0.545 . . . . 10.0 109.718 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 100' ' ' ILE . . . . . 0.594 HD11 HG21 ' B' ' 9' ' ' VAL . 57.9 mt -66.26 -47.47 84.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.757 179.417 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 101' ' ' LYS . . . . . 0.886 ' HG2' ' HA ' ' B' ' 107' ' ' GLU . 49.6 mtpt -57.15 -41.38 79.02 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.86 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 55.4 ttp85 -68.45 -46.55 69.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.909 -0.587 . . . . 10.0 112.313 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 35.1 m -68.27 -30.78 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.177 0 N-CA-C 112.551 0.575 . . . . 10.0 112.551 -179.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -87.15 -9.34 55.51 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 121.152 -0.219 . . . . 10.0 111.14 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 5.9 t70 63.06 29.91 16.27 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 123.803 0.69 . . . . 10.0 111.25 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 53.1 m -163.48 145.08 9.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.486 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 107' ' ' GLU . . . . . 0.886 ' HA ' ' HG2' ' B' ' 101' ' ' LYS . 0.0 OUTLIER -90.29 -11.34 41.1 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.541 0.686 . . . . 10.0 109.271 178.574 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -91.24 72.63 6.22 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.794 -1.094 . . . . 10.0 109.532 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.455 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 58.6 t -123.09 133.43 24.51 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.361 -179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 110' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 26.8 Cg_exo -63.0 107.89 0.69 Allowed 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.819 2.346 . . . . 10.0 111.555 179.138 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 54.4 mtt -127.0 153.15 46.29 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.118 -0.492 . . . . 10.0 109.91 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 112' ' ' VAL . . . . . 0.705 ' HB ' HD23 ' B' ' 79' ' ' LEU . 92.6 t -134.11 132.57 55.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 109.307 -0.627 . . . . 10.0 109.307 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 20.1 tp -85.89 117.94 25.06 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 114' ' ' VAL . . . . . 0.491 ' HB ' HG22 ' B' ' 81' ' ' VAL . 23.2 t -114.52 117.88 56.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.972 0.415 . . . . 10.0 111.496 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -101.14 110.51 3.9 Favored Glycine 0 N--CA 1.45 -0.407 0 N-CA-C 110.517 -1.033 . . . . 10.0 110.517 178.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -97.75 166.38 11.51 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.031 0.382 . . . . 10.0 112.031 -178.477 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 36.8 mttm 72.55 35.05 1.17 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 123.702 0.801 . . . . 10.0 112.187 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 118' ' ' CYS . . . . . 0.769 ' HA ' HD11 ' B' ' 84' ' ' ILE . 31.7 p -71.47 -13.36 61.79 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.064 0.394 . . . . 10.0 112.064 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -88.99 2.53 53.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.967 0.413 . . . . 10.0 111.172 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 38.0 mt -98.07 137.51 20.86 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.044 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -74.73 -14.14 21.9 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.768 2.312 . . . . 10.0 111.899 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 122' ' ' SER . . . . . 0.415 ' O ' ' HA ' ' B' ' 85' ' ' ASN . 0.6 OUTLIER -79.25 37.25 0.32 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.295 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -71.21 110.43 5.86 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.378 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.58 -18.22 14.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.063 179.136 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 40.4 t -105.68 113.9 43.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 115.658 -0.701 . . . . 10.0 109.543 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -76.39 152.43 36.28 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.662 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.5 -44.05 93.19 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.768 -0.651 . . . . 10.0 112.401 -179.489 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 8.4 tmtm? -61.25 -40.1 92.8 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.946 0.403 . . . . 10.0 110.908 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -63.45 -44.48 94.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.683 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 130' ' ' ALA . . . . . 0.439 ' HA ' ' CE1' ' B' ' 90' ' ' PHE . . . -66.63 -44.93 80.68 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.236 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -62.35 -36.16 81.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.748 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.47 -47.87 80.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.778 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 18.9 tp -63.96 -41.84 97.45 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.501 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.69 -47.1 86.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.436 179.459 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -62.95 -34.96 78.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.977 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 14.7 m -66.55 -25.75 66.81 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.213 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 16.2 m-30 -99.69 -4.73 30.16 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.473 -0.331 . . . . 10.0 111.481 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 71.53 33.24 64.01 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 111.624 -0.59 . . . . 10.0 111.624 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 48.8 pt -123.54 147.71 53.69 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-O 120.574 0.226 . . . . 10.0 110.813 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 140' ' ' PRO . . . . . 0.437 ' HG2' HG22 ' B' ' 112' ' ' VAL . 59.2 Cg_endo -73.07 151.92 50.45 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.625 2.216 . . . . 10.0 111.714 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -114.2 127.16 55.77 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.766 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 34.4 mm -125.14 122.05 62.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.082 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -90.89 124.37 35.13 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.595 -0.891 . . . . 10.0 108.595 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 144' ' ' THR . . . . . 0.476 ' HA ' ' O ' ' B' ' 150' ' ' GLN . 44.6 p -130.34 172.66 11.6 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 122.105 0.955 . . . . 10.0 113.373 -177.094 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 145' ' ' SER . . . . . 0.431 ' HB2' ' SG ' ' B' ' 118' ' ' CYS . 6.0 t -160.99 117.08 2.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.045 -1.434 . . . . 10.0 107.341 178.086 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.57 -17.87 62.91 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.769 0.319 . . . . 10.0 111.244 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 70.5 tttt -84.0 -44.61 13.98 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.209 0.448 . . . . 10.0 112.209 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 36.6 p -93.8 -13.69 27.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.735 0.302 . . . . 10.0 111.317 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 18.6 ttt-85 67.49 44.98 1.64 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.078 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 150' ' ' GLN . . . . . 0.476 ' O ' ' HA ' ' B' ' 144' ' ' THR . 21.6 tt0 -85.33 103.24 14.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.486 -0.779 . . . . 10.0 111.592 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 58.9 37.23 90.62 Favored Glycine 0 CA--C 1.519 0.285 0 CA-C-N 115.889 -0.596 . . . . 10.0 114.306 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 70.4 t -66.25 -54.52 25.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.911 0.386 . . . . 10.0 110.711 -179.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.45 -32.38 71.28 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -58.17 -42.62 86.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.85 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.89 -48.19 82.29 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.966 0.412 . . . . 10.0 110.64 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -65.17 -43.15 92.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.808 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 16.0 m-30 -60.71 -41.89 96.15 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.419 179.523 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 32.8 m -58.93 -38.16 78.34 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.501 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.929 HD22 ' HG ' ' B' ' 79' ' ' LEU . 24.2 tp -62.4 -46.11 90.08 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.047 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 160' ' ' VAL . . . . . 0.727 HG11 HD13 ' B' ' 46' ' ' ILE . 43.2 t -64.04 -39.35 85.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.987 -0.552 . . . . 10.0 109.571 178.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -63.53 -29.96 71.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.705 -0.679 . . . . 10.0 110.683 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -77.97 -43.72 28.84 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.208 178.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 163' ' ' ILE . . . . . 0.426 HD11 ' HA3' ' B' ' 77' ' ' GLY . 93.2 mt -60.17 -45.32 96.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.475 179.24 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -59.48 -48.12 82.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.356 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -66.39 -36.13 82.07 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.966 0.412 . . . . 10.0 110.821 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -63.04 -44.19 96.58 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.524 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -71.77 -39.41 69.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.604 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -57.55 -40.75 79.58 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.259 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -59.93 -36.04 76.21 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.936 -0.574 . . . . 10.0 112.165 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 25.3 mmt -90.44 -22.96 21.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.87 0.367 . . . . 10.0 111.556 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 31.4 t . . . . . 0 C--N 1.326 -0.436 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.968 -179.586 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.285 0 N-CA-C 111.503 -0.639 . . . . 10.0 111.503 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.01 136.73 52.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.737 0.303 . . . . 10.0 111.404 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 20.9 t -122.57 142.07 40.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.977 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 811' ' ' LYS . . . . . 0.656 ' HG2' HG22 ' D' ' 821' ' ' VAL . 70.1 mttt -93.92 125.78 38.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.033 0.444 . . . . 10.0 111.641 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 59.4 t -99.47 118.22 45.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.082 -0.71 . . . . 10.0 109.082 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 813' ' ' TYR . . . . . 0.437 ' HB2' HG22 ' D' ' 876' ' ' ILE . 83.9 m-85 -91.84 113.79 26.16 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.173 0.511 . . . . 10.0 111.185 -179.004 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 814' ' ' LEU . . . . . 0.68 HD13 ' HD2' ' D' ' 841' ' ' ARG . 23.6 mt -81.04 150.39 68.46 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.329 -0.851 . . . . 10.0 110.94 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 815' ' ' PRO . . . . . 0.721 ' HD3' ' HB ' ' D' ' 877' ' ' VAL . 37.3 Cg_endo -65.24 -7.41 15.6 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.178 2.585 . . . . 10.0 113.295 -179.267 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -90.28 17.22 7.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.986 0.422 . . . . 10.0 110.618 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 53.8 tttt 66.23 45.03 2.38 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 115.429 -0.805 . . . . 10.0 111.72 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 818' ' ' GLN . . . . . 0.558 ' HB3' ' HB2' ' B' ' 39' ' ' SER . 54.5 mt-30 -146.33 175.48 10.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.608 179.248 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.33 167.76 23.51 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.894 0.702 . . . . 10.0 112.894 -178.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 2.6 t -147.63 145.26 28.9 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.101 -0.954 . . . . 10.0 108.833 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 821' ' ' VAL . . . . . 0.656 HG22 ' HG2' ' D' ' 811' ' ' LYS . 21.9 t -101.1 115.25 42.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.963 0.411 . . . . 10.0 111.328 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 24.1 t -110.66 141.54 25.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.449 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 1.2 m -80.84 128.13 33.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 42.5 t -66.28 127.86 28.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.735 0.302 . . . . 10.0 110.477 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 825' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' D' ' 825' ' ' ARG . 0.6 OUTLIER -118.91 127.4 53.45 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.983 0.42 . . . . 10.0 110.881 179.909 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -77.05 74.6 3.63 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.675 -0.693 . . . . 10.0 112.349 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 165.41 -40.18 0.28 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.506 -0.854 . . . . 10.0 112.769 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 10.5 ptm -75.22 154.85 37.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.041 0.448 . . . . 10.0 111.738 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 829' ' ' SER . . . . . 0.58 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.5 OUTLIER -98.81 169.4 9.49 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.164 -179.473 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 87.6 t -57.95 -42.92 83.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.515 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 831' ' ' TYR . . . . . 0.732 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 83.0 t80 -56.03 -34.72 66.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.828 -0.624 . . . . 10.0 111.321 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -77.27 -49.39 15.16 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.306 -0.406 . . . . 10.0 111.133 -179.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 3.4 m -63.39 -40.79 98.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.396 -0.366 . . . . 10.0 111.626 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -71.58 -24.11 61.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.536 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -63.8 -32.55 74.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.037 0.446 . . . . 10.0 110.274 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 14.0 tttm -72.47 -6.42 43.62 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.552 -0.749 . . . . 10.0 111.282 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 837' ' ' ALA . . . . . 0.439 ' HB1' HD21 ' D' ' 814' ' ' LEU . . . -117.73 -46.77 2.64 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.967 0.413 . . . . 10.0 111.49 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 838' ' ' LEU . . . . . 0.427 HD12 ' HG3' ' D' ' 845' ' ' GLN . 74.8 mt -65.73 -43.92 87.56 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.819 0.674 . . . . 10.0 112.819 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -67.75 -21.24 65.28 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.131 0.419 . . . . 10.0 112.131 -179.149 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 50.5 t -75.54 -23.67 16.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.042 0.449 . . . . 10.0 110.583 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 841' ' ' ARG . . . . . 0.68 ' HD2' HD13 ' D' ' 814' ' ' LEU . 5.6 mtt-85 -106.55 -6.9 17.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.628 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 85.1 40.22 8.11 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.786 -0.721 . . . . 10.0 112.633 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 76.1 mt -114.68 129.04 56.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.791 0.329 . . . . 10.0 110.65 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -90.53 134.61 34.25 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.052 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 845' ' ' GLN . . . . . 0.427 ' HG3' HD12 ' D' ' 838' ' ' LEU . 14.7 mp0 -57.61 -34.25 69.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.965 -0.562 . . . . 10.0 112.096 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -72.01 -5.6 36.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.137 0.494 . . . . 10.0 111.565 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 3.6 m -126.04 25.43 6.75 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.081 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 64.3 m -145.31 165.22 29.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.01 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 11.4 p -143.66 145.86 21.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.886 -0.412 . . . . 10.0 109.886 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 850' ' ' VAL . . . . . 0.45 HG22 HG22 ' D' ' 877' ' ' VAL . 60.2 t -114.43 135.75 53.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.9 0.381 . . . . 10.0 110.944 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 851' ' ' TYR . . . . . 0.725 ' HB2' HG13 ' D' ' 876' ' ' ILE . 78.4 m-85 -118.69 141.35 48.69 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.194 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 852' ' ' ARG . . . . . 0.539 ' HD3' HD11 ' D' ' 870' ' ' LEU . 34.3 mtm180 -94.08 121.9 36.04 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.136 -0.69 . . . . 10.0 109.136 178.503 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 853' ' ' LEU . . . . . 0.502 ' HB3' ' HB2' ' D' ' 874' ' ' GLU . 1.1 tm? -84.19 113.67 21.25 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.113 -179.307 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 15.9 mt -111.07 72.96 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.685 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 96.1 mttt 66.43 9.09 6.22 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.998 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 147.28 -42.44 0.9 Allowed Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 121.109 -0.567 . . . . 10.0 111.848 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 7.3 mmt180 -69.74 139.94 53.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.737 0.303 . . . . 10.0 111.27 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -108.86 120.75 43.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.366 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 6.9 m -115.31 132.0 56.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.864 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 860' ' ' VAL . . . . . 0.575 HG22 ' HE1' ' D' ' 851' ' ' TYR . 11.5 t -65.73 137.78 24.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.646 -0.252 . . . . 10.0 111.052 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -124.5 149.3 47.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.528 -0.306 . . . . 10.0 110.268 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -92.74 163.99 13.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.83 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 863' ' ' TRP . . . . . 0.732 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 88.2 m95 -80.35 -34.44 36.52 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.237 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -72.36 -10.66 60.07 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.677 0.621 . . . . 10.0 112.677 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 2.7 m -68.01 148.61 50.79 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 110.032 -0.358 . . . . 10.0 110.032 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 866' ' ' ALA . . . . . 0.58 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -80.22 152.46 29.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.506 0.193 . . . . 10.0 110.7 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 6.0 tp -89.76 -4.92 10.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.241 0.543 . . . . 10.0 110.871 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -56.99 -50.99 85.03 Favored Pre-proline 0 CA--C 1.539 0.543 0 N-CA-C 113.342 0.867 . . . . 10.0 113.342 -179.605 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -76.61 6.02 4.37 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 121.912 1.741 . . . . 10.0 113.171 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 870' ' ' LEU . . . . . 0.539 HD11 ' HD3' ' D' ' 852' ' ' ARG . 3.4 mm? -90.75 47.03 1.37 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.218 0.532 . . . . 10.0 111.151 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -93.33 108.35 20.02 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.464 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 90.83 -0.23 76.17 Favored Glycine 0 CA--C 1.517 0.193 0 C-N-CA 121.069 -0.586 . . . . 10.0 113.617 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 873' ' ' GLU . . . . . 0.464 ' OE1' ' HD2' ' D' ' 852' ' ' ARG . 5.4 mt-10 -98.73 134.88 41.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.861 0.331 . . . . 10.0 111.286 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 874' ' ' GLU . . . . . 0.502 ' HB2' ' HB3' ' D' ' 853' ' ' LEU . 51.7 mt-10 -83.85 139.92 32.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 10.0 109.937 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 96.1 mt -114.13 118.2 33.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.109 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 876' ' ' ILE . . . . . 0.725 HG13 ' HB2' ' D' ' 851' ' ' TYR . 1.3 pt -111.69 120.36 61.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.385 179.42 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 877' ' ' VAL . . . . . 0.721 ' HB ' ' HD3' ' D' ' 815' ' ' PRO . 6.1 t -97.64 142.8 13.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.333 -178.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -125.26 160.04 30.22 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.547 178.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 80.8 t -93.79 132.46 37.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 116.258 -0.428 . . . . 10.0 109.999 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 44.6 mt . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.377 -0.82 . . . . 10.0 109.589 179.158 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 20.8 mt . . . . . 0 C--O 1.217 -0.626 0 CA-C-O 120.265 0.079 . . . . 10.0 110.845 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -70.69 -39.9 73.23 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.962 -0.384 . . . . 10.0 109.962 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -59.6 -40.8 88.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.623 179.093 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 242' ' ' GLU . . . . . 0.492 ' HB3' HH21 ' C' ' 532' ' ' ARG . 35.2 mt-10 -81.67 -30.83 32.54 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.327 -0.851 . . . . 10.0 110.236 179.018 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 49.7 ttm -64.6 -44.87 89.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.489 -0.323 . . . . 10.0 110.868 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 13.1 p -62.87 -45.27 93.33 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.863 -0.792 . . . . 10.0 108.863 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 245' ' ' LYS . . . . . 0.404 ' O ' ' HG3' ' A' ' 249' ' ' GLU . 15.1 mttm -60.43 -55.19 36.52 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.487 -0.779 . . . . 10.0 109.881 178.623 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -56.43 -45.96 80.51 Favored 'General case' 0 C--O 1.225 -0.222 0 O-C-N 123.652 0.595 . . . . 10.0 110.753 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 24.2 mt -60.35 -45.34 93.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.766 -0.197 . . . . 10.0 111.029 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 71.1 mt-10 -66.16 -41.8 89.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.63 0.252 . . . . 10.0 110.433 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 249' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 245' ' ' LYS . 88.2 mt-10 -64.39 -43.76 93.44 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.67 -0.493 . . . . 10.0 109.67 178.664 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 250' ' ' VAL . . . . . 0.562 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 35.5 t -65.31 -44.16 94.9 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.641 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.256 179.102 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 251' ' ' LYS . . . . . 0.472 ' O ' ' HG3' ' A' ' 255' ' ' GLN . 92.3 mttt -62.49 -48.21 80.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.041 0.448 . . . . 10.0 111.062 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.58 -41.87 98.33 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.178 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -77.18 -28.26 53.95 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 111.676 0.25 . . . . 10.0 111.676 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.587 HG22 ' HG ' ' A' ' 258' ' ' LEU . 0.4 OUTLIER -71.43 -20.14 20.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 C-N-CA 121.186 -0.206 . . . . 10.0 110.73 179.778 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 255' ' ' GLN . . . . . 0.472 ' HG3' ' O ' ' A' ' 251' ' ' LYS . 97.4 mt-30 -59.36 -61.07 8.59 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.505 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -65.23 -28.62 55.72 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.515 1.477 . . . . 10.0 111.059 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 257' ' ' TYR . . . . . 0.44 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 7.9 m-30 -64.04 -58.25 7.25 Favored 'General case' 0 C--O 1.231 0.091 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 258' ' ' LEU . . . . . 0.587 ' HG ' HG22 ' A' ' 254' ' ' VAL . 80.8 mt -65.45 -37.51 87.11 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.731 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -62.47 -44.89 95.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.917 0.389 . . . . 10.0 110.192 179.343 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 260' ' ' ASP . . . . . 0.898 ' HA ' ' HE2' ' A' ' 263' ' ' LYS . 10.9 t0 -64.3 -52.21 59.63 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.077 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 261' ' ' PHE . . . . . 0.529 ' HZ ' ' HG ' ' C' ' 514' ' ' LEU . 18.5 m-85 -62.02 -29.05 70.02 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.81 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 262' ' ' GLN . . . . . 0.513 ' HB2' ' O ' ' A' ' 258' ' ' LEU . 44.4 tt0 -66.44 -49.13 67.74 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.506 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 263' ' ' LYS . . . . . 0.898 ' HE2' ' HA ' ' A' ' 260' ' ' ASP . 23.9 mtmt -63.05 -44.94 94.48 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.824 -0.626 . . . . 10.0 109.336 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.453 ' CE ' ' HB1' ' C' ' 509' ' ' ALA . 13.9 mptt -58.26 -50.16 74.57 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.604 -0.726 . . . . 10.0 109.724 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 265' ' ' TRP . . . . . 0.497 ' HB2' ' O ' ' A' ' 261' ' ' PHE . 0.0 OUTLIER -61.41 -39.35 90.44 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.618 179.714 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -60.8 -47.62 85.49 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -63.88 -42.07 97.58 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 268' ' ' GLU . . . . . 0.456 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 35.8 mt-10 -58.99 -49.2 78.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.393 178.677 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 99.7 mmm -67.23 -40.08 86.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.464 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -60.7 -49.68 76.55 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 110.003 -0.369 . . . . 10.0 110.003 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 66.1 mt -64.84 -35.49 81.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.844 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 272' ' ' TYR . . . . . 0.702 ' HD2' HH22 ' C' ' 506' ' ' ARG . 0.3 OUTLIER -64.73 -42.52 95.17 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.206 178.978 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 273' ' ' ARG . . . . . 0.648 ' HA ' HG12 ' A' ' 276' ' ' VAL . 15.1 mtt85 -74.25 -38.66 63.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.84 0.352 . . . . 10.0 110.788 179.577 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -65.83 -26.23 67.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.367 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.796 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 93.6 mttt -95.2 -37.51 11.01 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.862 179.145 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 276' ' ' VAL . . . . . 0.648 HG12 ' HA ' ' A' ' 273' ' ' ARG . 2.2 p -62.22 -24.86 36.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 C-N-CA 121.31 -0.156 . . . . 10.0 111.355 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 277' ' ' GLU . . . . . 0.508 ' HB3' ' CD ' ' A' ' 278' ' ' PRO . 5.0 tp10 -62.93 -62.47 5.6 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 178.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 278' ' ' PRO . . . . . 0.508 ' CD ' ' HB3' ' A' ' 277' ' ' GLU . 18.5 Cg_endo -63.86 -31.54 67.54 Favored 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 121.694 1.596 . . . . 10.0 111.068 177.549 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.796 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 40.8 mt -65.09 -37.05 86.25 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.688 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 18.9 mtt180 -67.81 -34.88 77.61 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 178.179 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -67.74 -40.39 84.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.346 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 282' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 85.9 mt-10 -61.43 -47.93 83.47 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 108.89 -0.781 . . . . 10.0 108.89 178.325 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 48.6 mt -65.1 -38.71 91.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.335 -0.848 . . . . 10.0 110.537 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -66.57 -59.44 3.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.327 -0.397 . . . . 10.0 111.099 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -61.49 -37.85 85.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.048 0.451 . . . . 10.0 110.223 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -64.59 -49.0 66.98 Favored Glycine 0 N--CA 1.441 -0.996 0 N-CA-C 110.755 -0.938 . . . . 10.0 110.755 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.33 -35.11 79.81 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 110.249 -0.278 . . . . 10.0 110.249 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 288' ' ' ARG . . . . . 0.595 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 54.8 mtt180 -57.37 -45.7 84.14 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.794 -0.447 . . . . 10.0 109.794 178.639 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -71.04 -49.04 49.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.09 178.765 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -55.4 -43.2 75.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.724 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 64.0 mt -74.0 -39.28 63.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.891 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 292' ' ' HIS . . . . . 0.595 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 2.1 t-80 -60.99 -47.87 84.45 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 120.936 0.398 . . . . 10.0 109.936 179.38 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.87 -39.32 94.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.623 -0.717 . . . . 10.0 109.959 179.07 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 26.7 mt -67.37 -42.77 82.89 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.751 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -64.54 -43.73 93.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.763 0.316 . . . . 10.0 110.48 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.7 -3.94 21.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.257 0.551 . . . . 10.0 110.702 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -108.08 -34.67 6.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.484 -0.78 . . . . 10.0 109.125 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 57.7 mt -64.3 -31.34 72.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.22 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 299' ' ' SER . . . . . 0.498 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 2.6 m -68.27 -62.41 3.14 Favored Pre-proline 0 CA--C 1.54 0.564 0 CA-C-N 116.602 -0.272 . . . . 10.0 111.431 179.208 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 300' ' ' PRO . . . . . 0.498 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 35.1 Cg_endo -65.04 -50.98 1.79 Allowed 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 121.853 1.702 . . . . 10.0 112.229 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.688 ' HB3' ' HE2' ' C' ' 473' ' ' LYS . 92.0 mt -65.85 -25.55 67.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.767 0.318 . . . . 10.0 110.87 -179.541 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -76.74 -48.55 8.69 Favored Glycine 0 N--CA 1.443 -0.848 0 N-CA-C 110.49 -1.044 . . . . 10.0 110.49 178.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -64.06 -42.3 97.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.394 0.14 . . . . 10.0 110.776 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 304' ' ' GLU . . . . . 0.44 ' O ' ' HG2' ' A' ' 308' ' ' ARG . 15.9 mt-10 -64.09 -35.59 81.26 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.977 0.418 . . . . 10.0 110.158 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 27.0 ttt -68.11 -39.41 82.81 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 306' ' ' ARG . . . . . 0.463 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 66.4 mtt180 -67.32 -36.74 82.08 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 178.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 307' ' ' ASP . . . . . 0.553 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 7.9 t0 -65.05 -44.44 89.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.841 -0.618 . . . . 10.0 109.391 178.774 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 308' ' ' ARG . . . . . 0.997 ' HG3' HD21 ' C' ' 469' ' ' LEU . 13.4 mmt180 -66.28 -37.92 86.58 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 177.697 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -62.85 -35.02 78.59 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 115.488 -0.778 . . . . 10.0 109.649 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 310' ' ' ARG . . . . . 0.553 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 77.9 mtt180 -59.85 -45.64 91.79 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.771 -0.826 . . . . 10.0 108.771 178.061 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -69.59 -42.45 74.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.853 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 312' ' ' HIS . . . . . 0.659 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 2.8 m-70 -54.39 -53.23 56.78 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.826 -0.624 . . . . 10.0 109.723 179.082 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 95.6 t -70.37 -41.7 78.48 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.36 0 CA-C-N 115.389 -0.823 . . . . 10.0 111.538 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -58.61 -53.89 53.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.625 0.25 . . . . 10.0 111.17 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -60.32 -33.83 72.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.265 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 8.9 mt -72.89 -40.71 65.34 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.928 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.7 ttm105 -62.7 -51.55 66.75 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.548 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 3.6 m -67.15 -13.4 61.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.237 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -96.15 -43.63 7.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.85 0.357 . . . . 10.0 110.127 178.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 320' ' ' LEU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 57.6 mt -64.63 -33.56 76.21 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.21 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 321' ' ' ALA . . . . . 0.428 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -54.52 -60.96 6.39 Favored Pre-proline 0 CA--C 1.534 0.328 0 O-C-N 123.149 0.281 . . . . 10.0 111.352 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 322' ' ' PRO . . . . . 0.428 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 36.6 Cg_endo -68.62 -34.84 18.4 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 121.599 1.532 . . . . 10.0 110.69 178.254 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 323' ' ' TYR . . . . . 0.477 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 4.0 m-30 -57.31 -50.05 74.17 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.227 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 8.4 p -64.69 -36.71 85.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.529 -0.305 . . . . 10.0 110.801 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 325' ' ' ASP . . . . . 0.602 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 1.0 OUTLIER -68.89 -39.96 79.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.139 0.495 . . . . 10.0 109.977 179.117 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 326' ' ' GLU . . . . . 0.418 ' O ' ' HB3' ' A' ' 329' ' ' GLN . 35.8 mt-10 -67.27 -34.4 77.35 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.032 -0.729 . . . . 10.0 109.032 177.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 63.8 mt -68.09 -33.02 73.75 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 108.708 -0.849 . . . . 10.0 108.708 177.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 328' ' ' ARG . . . . . 0.602 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 84.7 mtt180 -67.4 -39.31 85.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.167 -1.049 . . . . 10.0 108.167 177.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 329' ' ' GLN . . . . . 0.418 ' HB3' ' O ' ' A' ' 326' ' ' GLU . 42.6 tt0 -61.04 -42.15 97.93 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.895 -1.15 . . . . 10.0 107.895 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 330' ' ' ARG . . . . . 0.649 HH12 HG23 ' C' ' 448' ' ' VAL . 57.8 mtt180 -63.07 -53.95 45.66 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.391 -0.822 . . . . 10.0 109.08 178.039 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 98.3 mt -53.3 -42.74 66.94 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.851 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 332' ' ' ALA . . . . . 0.643 ' O ' ' HB2' ' A' ' 336' ' ' GLU . . . -60.69 -45.32 94.64 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.239 -0.437 . . . . 10.0 109.949 178.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -68.99 -46.58 67.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.37 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 334' ' ' ARG . . . . . 0.633 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 4.3 mmt85 -60.92 -52.73 63.8 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.505 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 335' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 339' ' ' LYS . 83.9 mt -63.15 -34.92 78.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.993 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 336' ' ' GLU . . . . . 0.643 ' HB2' ' O ' ' A' ' 332' ' ' ALA . 0.3 OUTLIER -64.82 -44.32 90.23 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.221 -0.659 . . . . 10.0 109.221 178.83 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.12 -39.78 94.77 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.401 -0.963 . . . . 10.0 108.401 178.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 70.2 mt -66.68 -22.55 66.08 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.971 178.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 339' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 335' ' ' LEU . 91.2 mttt -75.38 -48.13 24.37 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.017 -0.734 . . . . 10.0 109.017 178.147 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -68.93 -47.75 64.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.637 -0.71 . . . . 10.0 109.829 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -65.85 -49.76 67.0 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.627 179.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.85 -37.76 94.86 Favored Glycine 0 C--N 1.33 0.227 0 CA-C-N 115.929 -0.578 . . . . 10.0 112.445 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.38 -46.21 94.75 Favored Glycine 0 N--CA 1.449 -0.457 0 N-CA-C 110.829 -0.908 . . . . 10.0 110.829 178.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -70.3 -37.33 74.76 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 345' ' ' ARG . . . . . 0.665 ' HA ' HD21 ' C' ' 429' ' ' ASN . 19.0 mtt180 -57.46 -58.72 7.05 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.269 179.292 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 346' ' ' LEU . . . . . 0.563 ' O ' ' HB2' ' A' ' 350' ' ' HIS . 92.7 mt -58.3 -39.82 80.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.565 -179.318 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -64.9 -49.21 71.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.768 0.318 . . . . 10.0 110.323 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -64.94 -43.73 91.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.182 -0.463 . . . . 10.0 111.209 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 22.7 m-30 -63.53 -39.69 95.09 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.922 -0.399 . . . . 10.0 109.922 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 350' ' ' HIS . . . . . 0.563 ' HB2' ' O ' ' A' ' 346' ' ' LEU . 0.6 OUTLIER -64.92 -44.17 90.42 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.705 178.921 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -59.25 -44.73 92.38 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.256 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 352' ' ' LYS . . . . . 0.452 ' HD3' ' HA ' ' C' ' 422' ' ' VAL . 16.4 mtmm -68.33 -27.14 66.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.525 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.23 -43.48 73.95 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 178.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.47 -45.19 94.62 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -63.36 -38.46 91.25 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.888 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 356' ' ' HIS . . . . . 0.425 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 5.2 m-70 -66.91 -35.61 80.39 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.142 178.641 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 78.4 mt -71.21 -39.87 71.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.192 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 68.7 m -62.78 -44.55 95.89 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 178.286 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 4.4 p -76.16 -16.57 59.84 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.417 179.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 360' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 356' ' ' HIS . 0.5 OUTLIER -76.18 -35.41 59.15 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 107.488 -1.301 . . . . 10.0 107.488 177.411 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 29.1 m -67.71 -25.32 65.6 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -72.36 -2.4 19.12 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.21 -0.904 . . . . 10.0 109.923 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.416 ' O ' ' HB3' ' A' ' 367' ' ' ALA . 31.2 mttp -123.16 -42.31 2.27 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 178.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -63.28 -22.25 66.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.535 -0.757 . . . . 10.0 111.429 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.899 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 96.6 mttt -102.12 -67.91 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.454 0 C-N-CA 120.819 -0.352 . . . . 10.0 111.544 179.013 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.899 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 21.9 Cg_exo -65.52 -55.36 0.45 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 122.268 1.979 . . . . 10.0 113.316 -178.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 367' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -60.89 -38.85 87.11 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.285 0.476 . . . . 10.0 112.285 -179.075 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 368' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 368' ' ' LEU . 3.0 mt -67.03 -42.25 85.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.776 0.322 . . . . 10.0 110.478 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 369' ' ' GLU . . . . . 1.059 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 2.7 mt-10 -69.19 -29.85 67.92 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.746 -0.464 . . . . 10.0 109.746 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -69.98 -44.42 69.47 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 178.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.72 -46.85 88.8 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.385 -0.825 . . . . 10.0 109.634 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 52.5 mtt85 -65.62 -36.69 84.44 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 1.059 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.7 mt-30 -63.08 -30.52 71.66 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.546 -0.752 . . . . 20.0 111.297 179.237 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -86.44 -36.09 9.99 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 109.149 -1.58 . . . . 10.0 109.149 178.519 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 17.6 mt -58.09 -40.31 80.82 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.011 0.374 . . . . 10.0 112.011 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 83.4 mt -55.4 -62.92 3.63 Favored Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 112.069 0.396 . . . . 10.0 112.069 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -63.19 -32.49 73.98 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 121.969 1.78 . . . . 10.0 111.564 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 6.5 t -63.45 -44.79 99.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 N-CA-C 109.916 -0.401 . . . . 10.0 109.916 178.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 33.7 mt -60.92 -35.63 77.19 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.438 -0.578 . . . . 10.0 109.438 178.478 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -62.86 -52.03 64.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.874 178.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.2 -38.11 85.38 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.611 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -67.97 -43.12 79.73 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.707 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -62.0 -48.42 80.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.486 -0.325 . . . . 10.0 110.538 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 75.8 t -57.51 -42.77 81.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.467 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 5.3 p -74.82 -55.03 6.24 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.174 0.435 . . . . 10.0 112.174 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -60.53 -44.53 95.97 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.311 0.856 . . . . 10.0 113.311 -178.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.484 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 56.8 mt -61.29 -41.98 97.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.689 0.281 . . . . 10.0 111.335 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 93.5 p -79.12 -26.12 42.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.329 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -65.92 -39.99 91.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 95.4 mt -61.85 -35.14 77.4 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.945 -0.571 . . . . 10.0 109.953 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 391' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 37.9 mt-10 -68.1 -42.4 80.37 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.55 -0.907 . . . . 10.0 108.55 178.547 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 392' ' ' GLU . . . . . 0.601 ' HA ' ' HD2' ' A' ' 395' ' ' LYS . 0.4 OUTLIER -61.7 -40.37 94.78 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.545 -0.752 . . . . 10.0 111.085 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -63.63 -51.82 63.54 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.493 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 4.8 m -58.63 -30.58 67.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.725 -0.671 . . . . 10.0 111.452 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 395' ' ' LYS . . . . . 0.601 ' HD2' ' HA ' ' A' ' 392' ' ' GLU . 93.1 mttt . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.601 -0.272 . . . . 10.0 111.684 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 55.9 mt . . . . . 0 CA--C 1.529 0.16 0 CA-C-O 121.185 0.517 . . . . 10.0 111.515 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.12 -37.99 84.83 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.011 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.87 -38.83 61.82 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.387 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 404' ' ' ASN . . . . . 0.453 ' O ' HG23 ' C' ' 408' ' ' VAL . 14.7 t-20 -57.56 -41.63 81.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.318 -0.856 . . . . 10.0 109.013 178.296 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -64.67 -33.99 77.23 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 115.415 -0.811 . . . . 10.0 111.847 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.68 -50.06 75.3 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.893 0.378 . . . . 10.0 110.21 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 1.2 m -63.79 -34.79 78.7 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.579 -0.526 . . . . 10.0 109.579 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 408' ' ' VAL . . . . . 0.453 HG23 ' O ' ' C' ' 404' ' ' ASN . 50.6 t -64.82 -41.38 92.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.003 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 2.8 m -61.05 -46.55 90.23 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 42.3 m -60.55 -38.33 84.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.86 178.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 91.5 m -63.15 -44.99 93.99 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.093 -0.503 . . . . 10.0 109.889 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 412' ' ' PHE . . . . . 0.453 ' O ' ' HG3' ' C' ' 416' ' ' ARG . 4.0 m-85 -64.72 -41.41 96.0 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.389 178.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 15.0 m -62.84 -44.34 96.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.019 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -66.88 -26.72 67.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.231 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 30.5 mt -70.86 -38.05 73.12 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 178.054 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 416' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' C' ' 412' ' ' PHE . 86.9 mtt180 -66.96 -40.11 87.41 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 108.751 -0.833 . . . . 10.0 108.751 178.297 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -65.16 -23.52 67.14 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 115.421 -0.809 . . . . 10.0 110.379 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -82.57 -48.25 11.2 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.57 -0.9 . . . . 10.0 108.57 177.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 84.6 mt -52.88 -35.05 57.33 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.203 -0.908 . . . . 10.0 112.151 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 420' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' C' ' 424' ' ' GLN . . . -52.94 -77.67 0.13 Allowed Glycine 0 CA--C 1.52 0.352 0 N-CA-C 111.84 -0.504 . . . . 10.0 111.84 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -56.94 -32.6 93.16 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.807 2.338 . . . . 10.0 111.742 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 422' ' ' VAL . . . . . 0.452 ' HA ' ' HD3' ' A' ' 352' ' ' LYS . 5.6 t -60.0 -50.21 81.02 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.226 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.925 179.273 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 21.4 p -70.78 -36.43 73.04 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.499 0.19 . . . . 10.0 110.901 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 424' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' C' ' 420' ' ' GLY . 78.2 mt-30 -57.82 -48.78 78.74 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.566 -0.531 . . . . 10.0 109.566 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 425' ' ' GLU . . . . . 0.422 ' OE1' ' HG3' ' A' ' 352' ' ' LYS . 97.2 mt-10 -76.33 -29.73 57.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.669 -0.696 . . . . 10.0 110.543 179.428 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 426' ' ' PHE . . . . . 0.44 ' HB2' ' O ' ' C' ' 422' ' ' VAL . 32.7 t80 -66.3 -46.99 75.05 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.824 0.345 . . . . 10.0 110.14 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 427' ' ' TRP . . . . . 0.531 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 47.3 m0 -64.86 -37.5 87.82 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 179.009 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.39 -34.19 75.6 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.574 178.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 429' ' ' ASN . . . . . 0.665 HD21 ' HA ' ' A' ' 345' ' ' ARG . 20.0 t-20 -68.95 -39.35 79.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.761 -1.2 . . . . 10.0 107.761 177.518 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 430' ' ' LEU . . . . . 0.65 ' HA ' ' HB2' ' C' ' 433' ' ' GLU . 69.1 mt -66.33 -25.9 67.05 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.251 -0.886 . . . . 10.0 110.287 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 431' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 35.5 mm-40 -63.0 -53.33 55.61 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.874 -0.787 . . . . 10.0 108.874 178.327 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -66.87 -31.52 72.17 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 433' ' ' GLU . . . . . 0.65 ' HB2' ' HA ' ' C' ' 430' ' ' LEU . 0.8 OUTLIER -64.0 -53.81 44.16 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.56 -0.745 . . . . 10.0 110.614 179.148 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 9.5 p -69.87 -40.27 75.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.855 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -67.0 -44.54 80.1 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.639 0.257 . . . . 10.0 110.726 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -61.8 -48.6 82.93 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 110.117 -1.193 . . . . 10.0 110.117 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 16.9 mt -61.16 -34.51 75.15 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 110.017 -0.364 . . . . 10.0 110.017 178.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 20.9 mtt85 -65.97 -43.28 88.31 Favored 'General case' 0 C--O 1.22 -0.454 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 178.368 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 439' ' ' GLN . . . . . 0.487 ' O ' ' HE2' ' C' ' 443' ' ' LYS . 74.8 mt-30 -62.92 -33.82 76.13 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-O 121.328 0.585 . . . . 10.0 109.678 178.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 440' ' ' GLU . . . . . 0.633 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 52.4 mt-10 -74.43 -59.6 2.65 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.09 178.844 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 75.1 mtm -62.36 -27.9 69.39 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 114.538 1.31 . . . . 10.0 114.538 -177.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 25.4 p -57.52 -59.07 5.72 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.259 0.552 . . . . 10.0 110.144 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 443' ' ' LYS . . . . . 0.487 ' HE2' ' O ' ' C' ' 439' ' ' GLN . 21.6 pttt -74.04 -31.27 62.82 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.334 179.151 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 444' ' ' ASP . . . . . 0.579 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 0.4 OUTLIER -61.38 -43.28 99.13 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.286 -0.415 . . . . 10.0 110.577 179.759 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 445' ' ' LEU . . . . . 0.441 ' HA ' ' HB ' ' C' ' 448' ' ' VAL . 81.2 mt -76.46 -42.23 44.5 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.418 -0.355 . . . . 10.0 111.311 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -62.62 -40.6 97.47 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.095 0.474 . . . . 10.0 110.055 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.11 -30.43 62.32 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.961 -0.755 . . . . 10.0 108.961 178.379 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 448' ' ' VAL . . . . . 0.649 HG23 HH12 ' A' ' 330' ' ' ARG . 1.2 t -57.83 -43.89 85.16 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 CA-C-N 116.068 -0.514 . . . . 10.0 109.819 178.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -67.35 -40.51 85.85 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -69.69 -10.19 57.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.099 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 451' ' ' LYS . . . . . 0.603 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 0.0 OUTLIER -104.62 -39.72 6.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.15 179.14 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 50.4 t -70.13 -36.4 67.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.797 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -55.08 -61.5 5.8 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 116.778 -0.192 . . . . 10.0 111.429 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.51 -26.37 40.42 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 121.823 1.682 . . . . 10.0 111.502 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 455' ' ' TYR . . . . . 0.603 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.1 OUTLIER -69.33 -47.93 62.93 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.796 -0.446 . . . . 10.0 109.796 179.342 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 456' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' C' ' 456' ' ' LEU . 17.5 mt -67.42 -32.22 72.96 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.29 -0.633 . . . . 10.0 109.29 178.687 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -67.11 -47.88 69.82 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.114 -0.699 . . . . 10.0 109.114 178.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 458' ' ' ASP . . . . . 0.584 ' HA ' ' HE2' ' C' ' 461' ' ' LYS . 41.3 t0 -66.81 -41.11 88.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.962 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -64.9 -40.09 94.54 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.931 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -62.94 -43.51 98.6 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 461' ' ' LYS . . . . . 0.584 ' HE2' ' HA ' ' C' ' 458' ' ' ASP . 27.5 mtmt -63.13 -46.39 87.47 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 15.5 mtmm -64.65 -36.97 85.98 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.221 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 36.1 t90 -66.33 -37.23 84.87 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.899 -0.778 . . . . 10.0 108.899 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -64.68 -45.17 87.8 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.536 -0.912 . . . . 10.0 108.536 177.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 0.804 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 45.6 mt-10 -61.2 -42.76 99.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.653 178.666 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 466' ' ' GLU . . . . . 0.861 ' OE1' HD12 ' C' ' 469' ' ' LEU . 0.4 OUTLIER -67.19 -39.51 86.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.968 -0.56 . . . . 10.0 109.877 178.942 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.11 -43.46 98.36 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 108.989 -0.745 . . . . 10.0 108.989 178.625 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -63.71 -45.11 91.47 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.133 -1.062 . . . . 10.0 108.133 177.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 0.997 HD21 ' HG3' ' A' ' 308' ' ' ARG . 96.5 mt -56.09 -45.11 79.53 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 115.35 -0.841 . . . . 20.0 109.782 177.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 15.4 m-30 -64.89 -41.82 95.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.521 179.226 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 59.6 mtt180 -66.57 -44.67 81.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.977 0.418 . . . . 10.0 111.174 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -78.0 -2.94 39.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.043 -0.526 . . . . 10.0 112.188 -179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 473' ' ' LYS . . . . . 0.688 ' HE2' ' HB3' ' A' ' 301' ' ' LEU . 62.5 mttt -116.08 -63.2 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.518 0.199 . . . . 10.0 111.29 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 66.1 t -57.54 -43.23 82.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.292 0.849 . . . . 10.0 113.292 -178.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.26 -59.74 12.84 Favored Pre-proline 0 CA--C 1.533 0.308 0 N-CA-C 112.34 0.496 . . . . 10.0 112.34 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -65.38 -29.99 53.69 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 121.835 1.69 . . . . 10.0 111.264 178.255 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 12.5 mt -67.44 -40.75 85.46 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 478' ' ' ARG . . . . . 0.553 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 67.3 ttt180 -63.48 -34.78 78.53 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 109.222 -0.658 . . . . 10.0 109.222 178.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -68.49 -47.29 67.42 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.22 -45.17 94.53 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.857 -0.611 . . . . 10.0 109.589 178.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 62.9 mt -67.39 -33.08 74.46 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.633 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 482' ' ' GLN . . . . . 0.553 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 30.4 tt0 -66.25 -47.12 74.79 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 178.86 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 483' ' ' GLU . . . . . 0.444 ' O ' ' HG3' ' C' ' 487' ' ' GLN . 42.1 mm-40 -66.67 -41.91 87.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.615 178.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.22 -39.24 97.67 Favored Glycine 0 N--CA 1.447 -0.586 0 N-CA-C 110.842 -0.903 . . . . 10.0 110.842 178.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.04 -36.74 78.04 Favored 'General case' 0 C--O 1.219 -0.507 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 178.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 64.3 mtt180 -64.52 -39.67 94.21 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.34 -0.615 . . . . 10.0 109.34 178.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 487' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' C' ' 483' ' ' GLU . 45.7 mt-30 -67.67 -43.85 79.25 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 488' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' C' ' 491' ' ' GLU . 78.9 tttt -65.64 -31.87 73.13 Favored 'General case' 0 C--O 1.226 -0.149 0 CA-C-N 115.725 -0.67 . . . . 10.0 109.599 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 21.1 mt -66.66 -41.32 88.39 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 108.626 -0.879 . . . . 10.0 108.626 177.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 490' ' ' HIS . . . . . 0.522 ' HA ' ' OE1' ' C' ' 493' ' ' GLN . 17.1 m-70 -64.12 -39.48 94.12 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 108.298 -1.001 . . . . 10.0 108.298 178.206 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 491' ' ' GLU . . . . . 0.558 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 39.9 mt-10 -60.9 -53.6 55.32 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.248 -1.019 . . . . 10.0 108.248 177.374 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 82.3 mt -57.81 -38.4 75.47 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 115.358 -0.837 . . . . 10.0 111.466 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 493' ' ' GLN . . . . . 0.522 ' OE1' ' HA ' ' C' ' 490' ' ' HIS . 69.2 mt-30 -61.07 -37.53 83.01 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.886 0.374 . . . . 10.0 110.298 179.263 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -81.56 -17.06 49.68 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.603 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.611 ' HG2' HD22 ' A' ' 279' ' ' LEU . 10.5 mtmm -103.64 6.37 37.06 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.685 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 32.6 mt -124.93 -44.08 1.95 Allowed 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 112.093 0.405 . . . . 10.0 112.093 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 497' ' ' SER . . . . . 0.803 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 10.3 m -66.93 -62.32 3.92 Favored Pre-proline 0 CA--C 1.539 0.534 0 N-CA-C 112.215 0.45 . . . . 10.0 112.215 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 498' ' ' PRO . . . . . 0.803 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 21.8 Cg_exo -67.18 -21.36 48.57 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 122.158 1.905 . . . . 10.0 111.89 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 499' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' C' ' 499' ' ' LEU . 12.6 mt -87.1 -41.75 13.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.939 179.45 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.49 -45.09 94.15 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 111.446 -0.662 . . . . 10.0 111.446 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -64.48 -32.56 74.24 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 121.239 0.543 . . . . 10.0 109.846 178.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 502' ' ' GLU . . . . . 0.458 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 38.6 tt0 -73.02 -40.24 65.34 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.443 178.253 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 503' ' ' MET . . . . . 0.59 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 87.2 mmm -60.46 -34.69 74.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 10.0 109.652 178.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -70.76 -34.3 71.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.1 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -71.38 -36.81 71.55 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.025 -1.102 . . . . 10.0 108.025 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.702 HH22 ' HD2' ' A' ' 272' ' ' TYR . 54.8 mtt180 -62.53 -38.38 89.75 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 107.836 -1.172 . . . . 10.0 107.836 177.244 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -64.05 -35.48 80.88 Favored 'General case' 0 C--O 1.226 -0.138 0 CA-C-N 115.65 -0.704 . . . . 10.0 109.994 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 508' ' ' ARG . . . . . 0.513 ' O ' ' HB3' ' C' ' 512' ' ' ASP . 75.2 mtt180 -64.16 -32.8 74.51 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.715 -0.846 . . . . 10.0 108.715 178.159 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 509' ' ' ALA . . . . . 0.453 ' HB1' ' CE ' ' A' ' 264' ' ' LYS . . . -96.57 13.12 29.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.118 -0.946 . . . . 10.0 110.909 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -128.74 -67.56 0.79 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.29 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 47.7 t -69.01 -49.76 59.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.626 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.582 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 12.0 t70 -66.75 -34.18 77.26 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.919 0.39 . . . . 10.0 110.36 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -68.31 -39.31 82.04 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.116 -1.068 . . . . 10.0 108.116 177.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 514' ' ' LEU . . . . . 0.529 ' HG ' ' HZ ' ' A' ' 261' ' ' PHE . 11.3 mt -67.48 -24.69 65.62 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.452 -0.794 . . . . 10.0 110.366 178.324 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 515' ' ' ARG . . . . . 0.582 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 89.8 mtt180 -58.75 -51.59 69.3 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.05 -0.722 . . . . 10.0 109.05 178.396 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.3 9.87 4.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.417 0.627 . . . . 10.0 110.901 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 517' ' ' HIS . . . . . 0.497 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 49.7 m170 -113.89 -39.16 4.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.146 -0.479 . . . . 10.0 109.874 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 95.0 mt -89.39 -30.75 18.13 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.582 -0.736 . . . . 10.0 111.714 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 519' ' ' ALA . . . . . 0.427 ' N ' ' HD2' ' C' ' 520' ' ' PRO . . . -58.11 -54.63 53.68 Favored Pre-proline 0 CA--C 1.531 0.222 0 C-N-CA 121.235 -0.186 . . . . 10.0 110.739 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 520' ' ' PRO . . . . . 0.427 ' HD2' ' N ' ' C' ' 519' ' ' ALA . 33.3 Cg_endo -67.47 -32.03 32.75 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 121.31 1.34 . . . . 10.0 110.048 177.879 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -62.8 -46.08 89.63 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.933 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 522' ' ' SER . . . . . 0.409 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 3.8 p -68.33 -33.52 74.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.015 0.436 . . . . 10.0 110.084 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -66.18 -45.5 80.63 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 178.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -65.84 -36.4 83.35 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 178.118 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 19.0 mt -60.81 -39.39 88.79 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.405 178.191 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 526' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' C' ' 522' ' ' SER . 54.7 mtt85 -63.54 -38.46 91.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.179 178.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -62.78 -46.7 86.81 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.449 -0.945 . . . . 10.0 108.449 178.062 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 48.2 mtt180 -63.16 -41.89 99.34 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 114.896 -1.047 . . . . 10.0 109.77 178.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 76.7 mt -65.24 -41.69 94.09 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.456 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -59.26 -49.63 77.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.227 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -61.7 -47.92 83.13 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.723 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 532' ' ' ARG . . . . . 0.492 HH21 ' HB3' ' A' ' 242' ' ' GLU . 1.5 mtt180 -64.6 -42.19 95.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.484 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 26.3 mt -64.36 -43.11 95.58 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 120.64 0.257 . . . . 10.0 110.34 179.154 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -63.42 -40.32 96.87 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.949 -0.389 . . . . 10.0 109.949 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.17 -41.21 99.19 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.955 -0.757 . . . . 10.0 108.955 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 536' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 96.1 mt -69.97 -19.63 63.35 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.681 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -87.46 -41.0 13.85 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 178.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.99 -51.64 52.52 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.722 -0.844 . . . . 10.0 108.722 178.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -70.66 -34.06 71.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.393 -0.821 . . . . 10.0 108.822 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.18 -45.66 85.22 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.956 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.02 -41.11 99.65 Favored Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 110.237 -1.145 . . . . 10.0 110.237 178.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.45 92.58 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 109.327 -0.62 . . . . 10.0 109.327 178.329 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 74.4 mtt180 -64.72 -38.52 91.27 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.952 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 85.9 mt -61.12 -41.7 97.18 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.555 -0.535 . . . . 10.0 109.555 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -68.34 -43.36 77.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.419 178.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -61.0 -47.53 86.04 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.052 179.019 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 15.7 m-30 -61.28 -43.56 98.67 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.399 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -59.67 -46.82 87.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.508 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -63.01 -54.86 31.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.564 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -58.63 -39.62 81.01 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.973 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.18 -41.4 90.34 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 116.491 -0.322 . . . . 10.0 110.466 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 47.2 m -62.39 -45.29 93.82 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -64.21 -29.7 70.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.317 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -79.48 -46.68 16.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.33 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 56.2 mt -60.04 -40.7 90.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.52 -0.309 . . . . 10.0 111.144 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 4.8 p -65.6 -47.79 74.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.867 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 12.3 p -68.83 -32.21 71.74 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.881 -0.328 . . . . 10.0 110.808 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 25.4 mt -63.84 -44.87 91.88 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.576 -0.527 . . . . 10.0 109.576 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 559' ' ' SER . . . . . 0.475 ' O ' ' HG3' ' C' ' 563' ' ' LYS . 2.4 p -71.84 -34.82 69.6 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.777 -0.453 . . . . 10.0 109.777 178.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 74.4 mt-10 -63.74 -24.16 67.66 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.686 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 48.1 mttp -97.91 -31.39 12.21 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.141 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -63.84 -39.01 93.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.696 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 563' ' ' LYS . . . . . 0.475 ' HG3' ' O ' ' C' ' 559' ' ' SER . 91.8 mttt -56.03 -61.86 5.72 Favored Pre-proline 0 CA--C 1.534 0.327 0 CA-C-N 116.42 -0.354 . . . . 10.0 111.44 179.268 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 564' ' ' PRO . . . . . 0.467 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 30.7 Cg_endo -65.65 -35.48 37.28 Favored 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 121.822 1.681 . . . . 10.0 111.736 179.037 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.8 82.69 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 121.145 -0.222 . . . . 10.0 110.814 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 57.3 mt -64.82 -41.61 95.63 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.204 -0.295 . . . . 10.0 110.204 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 567' ' ' GLU . . . . . 0.958 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 88.1 mt-10 -64.17 -44.14 92.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.662 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -67.88 -41.1 83.34 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.374 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 33.5 mt -58.79 -49.46 77.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.238 -0.437 . . . . 10.0 109.826 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 570' ' ' ARG . . . . . 0.427 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 59.2 mtt180 -65.85 -38.89 90.06 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.731 -0.47 . . . . 10.0 109.731 178.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 571' ' ' GLN . . . . . 0.958 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.5 mt-30 -61.51 -40.21 93.8 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.665 -0.698 . . . . 20.0 111.974 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -78.44 -37.31 27.89 Favored Glycine 0 CA--C 1.521 0.445 0 N-CA-C 109.927 -1.269 . . . . 10.0 109.927 179.106 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 18.8 mt -54.87 -37.21 65.99 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 112.021 0.378 . . . . 10.0 112.021 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 574' ' ' LEU . . . . . 0.551 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 53.4 mt -56.27 -66.02 1.32 Allowed Pre-proline 0 CA--C 1.538 0.484 0 N-CA-C 112.419 0.526 . . . . 10.0 112.419 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 575' ' ' PRO . . . . . 0.551 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 43.1 Cg_endo -68.72 -32.82 22.75 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 121.578 1.519 . . . . 10.0 112.11 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 15.4 t -65.27 -49.18 80.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.751 -0.204 . . . . 10.0 111.034 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 46.1 mt -65.2 -36.87 85.53 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 110.14 -0.319 . . . . 10.0 110.14 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 578' ' ' GLU . . . . . 0.523 ' O ' HG23 ' C' ' 582' ' ' VAL . 55.0 mm-40 -66.24 -46.37 77.38 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 110.091 -0.337 . . . . 10.0 110.091 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 44.0 m -62.15 -43.12 99.54 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.968 0.414 . . . . 10.0 109.986 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 580' ' ' PHE . . . . . 0.42 ' HD1' ' HA ' ' C' ' 580' ' ' PHE . 5.3 m-30 -65.51 -37.37 86.58 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.903 -0.59 . . . . 10.0 109.564 178.758 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -60.82 -41.21 95.26 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 582' ' ' VAL . . . . . 0.523 HG23 ' O ' ' C' ' 578' ' ' GLU . 95.2 t -61.65 -39.9 84.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.115 -0.698 . . . . 10.0 109.115 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 13.4 m -68.92 -36.94 78.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.238 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -70.32 -43.2 70.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.733 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 98.6 mt -61.55 -45.94 92.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.12 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 2.9 p -65.63 -40.94 93.09 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.69 -0.485 . . . . 10.0 109.69 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -60.46 -53.11 61.49 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 115.76 -0.655 . . . . 10.0 110.632 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.3 mt -56.09 -45.13 79.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.868 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -68.91 -39.63 79.57 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.665 0.617 . . . . 10.0 112.665 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -70.93 -41.1 71.61 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.993 0.425 . . . . 10.0 110.814 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 591' ' ' TYR . . . . . 0.438 ' HE1' ' HB3' ' A' ' 392' ' ' GLU . 22.3 m-30 -64.52 -39.66 94.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.759 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.38 -25.9 67.77 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.947 0.351 . . . . 10.0 111.947 -179.623 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -72.95 -39.21 66.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.12 0.486 . . . . 10.0 110.191 179.047 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -77.03 -26.48 53.74 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.872 -0.604 . . . . 10.0 110.634 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 83.4 mt -95.82 46.8 1.09 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.05 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.428 -0.796 . . . . 10.0 109.665 -179.968 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 7.1 t . . . . . 0 C--O 1.236 0.372 0 CA-C-O 121.716 0.769 . . . . 10.0 110.295 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -108.87 137.53 46.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.341 -0.845 . . . . 10.0 109.639 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -125.84 157.33 37.87 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.809 0.338 . . . . 10.0 111.386 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 mmtm -114.77 112.57 23.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.707 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.635 HD22 HD23 ' B' ' 159' ' ' LEU . 25.8 mt -108.65 117.28 33.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.971 0.415 . . . . 10.0 110.841 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 39.8 t -107.42 119.34 56.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.131 0.491 . . . . 10.0 110.724 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 21.6 t -90.63 121.1 40.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.545 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 18.3 m -114.91 165.27 10.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.917 0.389 . . . . 10.0 110.952 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 144.92 163.82 10.28 Favored Glycine 0 N--CA 1.445 -0.7 0 N-CA-C 110.8 -0.92 . . . . 10.0 110.8 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.53 176.1 7.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.293 0.568 . . . . 10.0 111.893 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.64 123.61 6.16 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.915 -0.659 . . . . 10.0 111.963 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 121.23 -20.06 8.54 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.627 -0.797 . . . . 10.0 112.12 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 34.2 m -65.2 -36.43 77.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.795 0.331 . . . . 10.0 111.58 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 104.7 39.26 2.39 Favored Glycine 0 CA--C 1.518 0.257 0 C-N-CA 120.598 -0.811 . . . . 10.0 113.596 179.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -59.73 -51.98 67.45 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.943 0.401 . . . . 10.0 111.267 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -60.04 -36.3 76.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.895 -0.593 . . . . 10.0 111.895 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.92 -50.99 68.65 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.691 0.282 . . . . 10.0 110.745 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 72.0 mt -59.72 -36.83 77.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.456 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' THR . . . . . 0.495 HG23 HG21 ' B' ' 55' ' ' ILE . 29.2 m -68.79 -51.05 45.13 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.291 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 97.6 mt -63.11 -32.0 54.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-O 120.816 0.341 . . . . 10.0 110.977 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.454 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 38.0 tp60 -64.45 -30.34 71.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.533 179.149 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 23.8 tp -85.35 -30.71 23.46 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.114 0.483 . . . . 10.0 110.474 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 43.2 mm -73.13 -59.36 3.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.954 -0.567 . . . . 10.0 112.086 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -125.1 4.92 7.9 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 113.179 0.807 . . . . 10.0 113.179 -178.509 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.454 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 54.6 t30 58.27 51.43 8.45 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.293 0.568 . . . . 10.0 111.198 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 40.6 t60 -129.39 120.9 26.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.839 -0.618 . . . . 10.0 110.089 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -84.29 118.26 24.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.414 -0.357 . . . . 10.0 110.64 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 10.1 m -77.39 141.57 15.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.541 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -105.74 -24.02 12.6 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.258 0.551 . . . . 10.0 109.948 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 3.4 pm0 -86.43 140.36 30.06 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.28 -0.873 . . . . 10.0 111.054 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -85.49 68.73 10.54 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.395 0.617 . . . . 10.0 109.814 178.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' ASP . . . . . 0.517 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 0.7 OUTLIER -71.3 138.02 84.12 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.724 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 34' ' ' PRO . . . . . 0.517 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 13.4 Cg_exo -72.25 -178.37 3.22 Favored 'Trans proline' 0 N--CA 1.463 -0.303 0 C-N-CA 123.158 2.572 . . . . 10.0 111.706 179.405 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.2 m -166.71 137.39 3.26 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.443 -0.344 . . . . 10.0 110.711 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 76.8 mt -123.01 -52.91 2.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 107.817 -1.179 . . . . 10.0 107.817 177.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -148.1 115.06 6.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.079 -0.964 . . . . 10.0 109.001 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 38' ' ' ASP . . . . . 0.716 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 23.9 m-20 -132.66 133.61 43.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.093 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 2.0 p -120.96 122.27 39.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.987 0.423 . . . . 10.0 111.796 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 40' ' ' TYR . . . . . 0.405 ' CE2' ' HB3' ' B' ' 38' ' ' ASP . 71.3 m-85 -122.49 155.52 36.02 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 41' ' ' ARG . . . . . 0.454 ' HB2' ' NE2' ' D' ' 818' ' ' GLN . 2.5 ttt180 -153.97 141.05 19.39 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.814 0.34 . . . . 10.0 111.21 -178.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -158.48 155.98 29.47 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.726 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -105.24 131.28 52.91 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.529 -0.545 . . . . 10.0 109.529 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 15.7 m -139.02 158.22 29.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.685 0.279 . . . . 10.0 111.104 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 54.6 t -92.43 100.62 11.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.047 -0.723 . . . . 10.0 109.047 178.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 39.1 mt -88.86 104.67 15.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.683 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 58.67 12.77 2.32 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.95 1.093 . . . . 10.0 113.95 178.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 132.45 -33.13 2.71 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.414 -0.898 . . . . 10.0 113.087 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -101.38 134.87 43.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.639 0.257 . . . . 10.0 110.703 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 5.6 t -81.61 140.86 34.19 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 71.3 m -147.09 158.59 43.99 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.833 0.349 . . . . 10.0 111.328 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.04 122.46 40.06 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 82.9 mt -111.87 120.98 43.78 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.541 0.571 . . . . 10.0 112.541 -178.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.88 113.19 24.79 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 107.697 -1.224 . . . . 10.0 107.697 177.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.495 HG21 HG23 ' B' ' 20' ' ' THR . 12.4 mt -101.5 127.05 55.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 120.811 0.338 . . . . 10.0 110.934 -178.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.6 tp -109.04 113.87 27.12 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.861 -0.609 . . . . 10.0 111.737 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.716 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 10.0 t70 -90.85 101.56 14.32 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.89 -0.781 . . . . 10.0 108.89 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 38.0 p -80.95 165.05 22.11 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 112.912 0.708 . . . . 10.0 112.912 -178.032 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.36 156.83 33.42 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.473 -0.785 . . . . 10.0 111.392 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -79.83 -55.82 3.48 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.786 -0.721 . . . . 10.0 111.969 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -120.32 127.82 52.7 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.762 -0.458 . . . . 20.0 109.762 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.565 ' OE1' ' HD2' ' B' ' 68' ' ' ARG . 27.7 tt0 -163.02 168.33 21.18 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.697 -0.483 . . . . 10.0 109.697 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 63' ' ' GLU . . . . . 0.537 ' HB3' ' H ' ' B' ' 64' ' ' TYR . 3.6 mm-40 -105.37 -136.96 0.36 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.586 -0.279 . . . . 10.0 110.943 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 64' ' ' TYR . . . . . 0.537 ' H ' ' HB3' ' B' ' 63' ' ' GLU . 48.1 t80 -103.47 90.11 3.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.1 0.476 . . . . 10.0 110.97 -179.343 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 3.1 m -101.4 139.39 37.13 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.702 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.11 -37.78 88.55 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.006 0.431 . . . . 10.0 111.183 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 39.4 ttp -64.76 -35.77 82.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.036 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.61 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 22.6 ttt85 -66.5 -51.53 55.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.545 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.33 -38.99 72.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.876 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 3.0 tp60 -58.53 -56.09 26.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.64 -0.709 . . . . 10.0 112.255 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 71' ' ' TYR . . . . . 0.61 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 1.7 p90 -67.28 -15.74 63.87 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 113.594 0.961 . . . . 10.0 113.594 -178.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 72' ' ' MET . . . . . 0.559 ' HB3' HG21 ' B' ' 103' ' ' VAL . 86.2 mtp -80.16 -18.31 50.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.773 0.321 . . . . 10.0 111.197 179.676 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 4.1 mtt-85 -75.15 -29.75 60.57 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.864 0.364 . . . . 10.0 110.715 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.59 -0.39 37.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.853 -0.612 . . . . 10.0 112.468 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -84.92 127.56 8.24 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.331 -0.937 . . . . 10.0 112.44 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -86.93 -42.28 13.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.218 0.532 . . . . 10.0 109.823 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -130.32 144.45 15.75 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 110.538 -1.025 . . . . 10.0 110.538 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -122.64 129.26 51.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.046 0.451 . . . . 10.0 111.861 -178.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.855 ' HG ' HD22 ' B' ' 159' ' ' LEU . 78.7 mt -96.88 108.82 21.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.549 -0.751 . . . . 10.0 109.886 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 19.3 m -85.47 91.08 8.12 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.027 -0.36 . . . . 10.0 110.027 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 47.4 t -89.6 121.61 39.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.542 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.639 ' HB3' HD11 ' B' ' 93' ' ' ILE . 20.1 p90 -130.51 152.1 50.26 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.661 -0.7 . . . . 10.0 109.882 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -91.67 125.97 36.59 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.976 -0.379 . . . . 10.0 109.976 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 84' ' ' ILE . . . . . 0.848 HD11 ' HA ' ' B' ' 118' ' ' CYS . 43.8 pt -70.44 -8.06 10.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.2 0.524 . . . . 10.0 111.16 -179.578 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 85' ' ' ASN . . . . . 0.499 HD21 ' HB3' ' B' ' 117' ' ' LYS . 0.0 OUTLIER -101.43 5.56 42.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.104 179.572 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -132.07 106.81 8.24 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.402 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 87' ' ' THR . . . . . 0.484 ' O ' ' HG3' ' B' ' 91' ' ' GLU . 0.2 OUTLIER -59.2 -39.52 82.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.906 -0.588 . . . . 10.0 112.479 -179.085 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -59.1 -36.06 74.5 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.778 0.288 . . . . 10.0 111.778 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 21.1 m -64.71 -36.53 84.59 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.001 0.429 . . . . 10.0 110.6 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -70.94 -34.43 71.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.682 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 91' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' B' ' 87' ' ' THR . 30.5 mt-10 -79.31 -25.78 42.34 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.97 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 92' ' ' ASP . . . . . 0.472 ' O ' ' HB3' ' B' ' 95' ' ' HIS . 0.3 OUTLIER -80.75 -2.64 47.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.495 -179.22 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 93' ' ' ILE . . . . . 0.639 HD11 ' HB3' ' B' ' 82' ' ' PHE . 29.5 mm -58.58 -42.36 84.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.728 0.299 . . . . 10.0 111.104 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 17.2 t60 -68.4 -26.62 65.64 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.986 0.422 . . . . 10.0 110.366 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 95' ' ' HIS . . . . . 0.472 ' HB3' ' O ' ' B' ' 92' ' ' ASP . 9.9 t-160 -66.08 -40.8 91.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.685 -0.689 . . . . 10.0 109.803 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -71.7 -44.27 64.48 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.408 -0.96 . . . . 10.0 108.408 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -51.84 -53.47 39.95 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.967 -1.015 . . . . 10.0 111.691 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -64.76 -37.18 86.72 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.126 0.417 . . . . 10.0 112.126 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 99' ' ' GLN . . . . . 0.411 ' O ' HG13 ' B' ' 103' ' ' VAL . 35.2 tt0 -61.97 -49.72 74.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.019 -0.363 . . . . 10.0 110.019 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 100' ' ' ILE . . . . . 0.555 ' HA ' HG22 ' B' ' 103' ' ' VAL . 42.1 mt -62.81 -42.15 95.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 10.0 111.018 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 101' ' ' LYS . . . . . 0.714 ' HE2' ' HG3' ' B' ' 107' ' ' GLU . 9.1 mtpm? -60.29 -32.86 71.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.545 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 49.2 ttp85 -80.69 -40.14 25.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.938 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.559 HG21 ' HB3' ' B' ' 72' ' ' MET . 18.8 m -69.16 -26.34 31.73 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 112.469 0.544 . . . . 10.0 112.469 -179.186 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -98.86 -14.09 19.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.761 0.315 . . . . 10.0 110.868 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 11.4 t70 59.47 39.48 21.8 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.146 -178.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 19.6 m -155.16 139.37 16.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.458 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 107' ' ' GLU . . . . . 0.714 ' HG3' ' HE2' ' B' ' 101' ' ' LYS . 7.2 mp0 -85.74 -13.07 49.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.651 0.739 . . . . 10.0 109.46 178.586 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -102.06 86.03 2.79 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.934 -1.03 . . . . 10.0 110.177 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 55.9 t -130.82 131.84 23.53 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.014 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -64.24 112.13 1.81 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.866 2.378 . . . . 10.0 111.824 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 111' ' ' MET . . . . . 0.432 ' HB2' HG21 ' B' ' 139' ' ' ILE . 57.5 mtt -130.54 149.61 52.13 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.126 -0.488 . . . . 10.0 109.746 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 112' ' ' VAL . . . . . 0.526 ' HB ' HD23 ' B' ' 79' ' ' LEU . 99.4 t -130.97 128.03 61.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.772 -0.455 . . . . 10.0 109.772 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 17.1 tp -82.91 119.56 24.57 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.557 -0.535 . . . . 10.0 109.557 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 51.2 t -117.26 117.03 53.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 120.963 0.411 . . . . 10.0 111.48 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -98.79 115.14 5.22 Favored Glycine 0 N--CA 1.45 -0.388 0 N-CA-C 110.304 -1.118 . . . . 10.0 110.304 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -103.04 164.18 11.77 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 117.204 0.502 . . . . 10.0 112.147 -178.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 117' ' ' LYS . . . . . 0.499 ' HB3' HD21 ' B' ' 85' ' ' ASN . 13.6 mtmt 69.44 41.68 1.26 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.108 -0.951 . . . . 10.0 113.112 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 118' ' ' CYS . . . . . 0.848 ' HA ' HD11 ' B' ' 84' ' ' ILE . 15.4 p -81.04 -12.49 59.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.21 0.529 . . . . 10.0 110.266 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -76.47 -12.19 60.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.388 -0.824 . . . . 10.0 110.945 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 31.6 mt -95.17 136.86 22.35 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.143 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -72.84 3.54 4.33 Favored 'Trans proline' 0 CA--C 1.53 0.295 0 C-N-CA 122.623 2.216 . . . . 10.0 112.904 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.26 32.56 0.69 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.858 0.361 . . . . 10.0 111.147 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 123' ' ' ARG . . . . . 0.643 ' HG3' HD12 ' B' ' 84' ' ' ILE . 24.6 ttm-85 -64.4 105.1 0.87 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.899 0.381 . . . . 10.0 111.557 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.5 m -94.12 -40.86 9.83 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.297 0.57 . . . . 10.0 109.661 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 45.7 t -86.7 122.84 39.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.566 -0.743 . . . . 10.0 109.577 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.9 150.14 42.85 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.986 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.38 -35.99 77.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.444 -179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -69.47 -33.99 73.71 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.62 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -62.43 -47.53 83.65 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.046 0.45 . . . . 10.0 110.151 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.33 94.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.741 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -63.2 -44.49 95.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.439 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -62.96 -42.22 99.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.987 0.422 . . . . 10.0 111.221 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 37.1 tp -66.2 -43.88 85.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.046 0.451 . . . . 10.0 110.276 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.22 -43.54 97.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.618 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -61.34 -35.53 77.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.683 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.0 m -67.27 -33.95 76.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.875 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -83.41 -19.84 35.25 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.231 0.539 . . . . 10.0 110.194 178.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.21 30.46 25.25 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 111.03 -0.828 . . . . 10.0 111.03 -179.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 139' ' ' ILE . . . . . 0.432 HG21 ' HB2' ' B' ' 111' ' ' MET . 48.7 pt -123.37 151.63 63.09 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.763 -0.218 . . . . 10.0 110.74 -179.335 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.36 156.96 33.07 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.384 2.056 . . . . 10.0 112.059 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -122.73 129.84 52.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.512 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 33.2 mm -125.97 125.59 68.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.142 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -87.32 124.41 33.33 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.208 -1.034 . . . . 10.0 108.208 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 144' ' ' THR . . . . . 0.599 ' HA ' ' O ' ' B' ' 150' ' ' GLN . 40.2 p -126.82 172.94 9.95 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.577 0.955 . . . . 10.0 113.577 -177.128 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 26.5 t -159.79 125.16 4.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.245 -1.343 . . . . 10.0 107.615 178.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.47 -27.2 65.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.946 0.403 . . . . 10.0 111.828 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -73.79 -55.74 5.85 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.603 0.594 . . . . 10.0 112.603 -179.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 44.4 p -83.22 -14.81 52.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.641 -0.254 . . . . 10.0 111.591 -178.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 27.0 ttt180 68.32 22.88 7.86 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.622 0.725 . . . . 10.0 109.834 -178.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 150' ' ' GLN . . . . . 0.599 ' O ' ' HA ' ' B' ' 144' ' ' THR . 10.1 tt0 -62.05 111.45 1.94 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.907 -1.042 . . . . 10.0 111.833 -179.566 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 67.89 9.38 56.32 Favored Glycine 0 C--O 1.227 -0.303 0 N-CA-C 114.658 0.623 . . . . 10.0 114.658 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.68 -53.34 48.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 117.511 0.655 . . . . 10.0 111.17 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -62.01 -45.1 95.07 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.118 0.485 . . . . 10.0 110.373 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -63.48 -36.13 82.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.852 -0.613 . . . . 10.0 112.53 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.0 -47.85 81.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.908 0.385 . . . . 10.0 110.196 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -66.91 -42.02 86.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.686 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -62.99 -42.34 99.82 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.18 -0.463 . . . . 10.0 110.598 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.551 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 66.1 m -60.09 -41.4 92.4 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.807 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.855 HD22 ' HG ' ' B' ' 79' ' ' LEU . 41.0 tp -57.8 -43.65 85.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.495 -0.321 . . . . 10.0 110.222 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 46.4 t -64.78 -36.72 78.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.117 -0.492 . . . . 10.0 109.929 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 161' ' ' ARG . . . . . 0.551 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 67.3 mtt180 -63.25 -44.63 94.62 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.126 179.291 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 162' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' B' ' 158' ' ' THR . 17.0 mm-40 -64.39 -38.07 89.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.095 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 163' ' ' ILE . . . . . 0.509 ' O ' ' HG2' ' B' ' 167' ' ' LYS . 96.1 mt -65.02 -43.64 96.05 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.201 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -63.16 -40.33 97.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.534 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -65.5 -31.62 72.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.241 0.543 . . . . 10.0 109.653 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 20.8 t-80 -67.23 -35.65 80.03 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.913 178.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 167' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' B' ' 163' ' ' ILE . 55.1 mmtt -63.26 -48.93 76.09 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.789 -0.641 . . . . 10.0 109.623 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -61.37 -42.81 99.31 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.243 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -58.47 -46.39 86.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.943 -0.572 . . . . 10.0 110.474 179.302 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 16.8 ttm -67.01 -24.39 66.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.625 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 C--N 1.327 -0.376 0 CA-C-O 121.018 0.437 . . . . 10.0 110.977 179.551 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 N-CA-C 111.946 -0.462 . . . . 10.0 111.946 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 1.6 p -126.15 130.11 50.38 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.618 0.247 . . . . 10.0 110.944 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 45.7 t -117.81 128.7 74.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.154 -0.476 . . . . 10.0 109.804 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 13.3 pttp -93.34 119.35 32.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.163 0.506 . . . . 10.0 111.395 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 812' ' ' VAL . . . . . 0.572 HG11 HD11 ' D' ' 834' ' ' LEU . 35.0 t -96.62 129.11 47.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.868 -0.605 . . . . 10.0 109.465 179.674 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -90.71 139.25 30.9 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.062 0.458 . . . . 10.0 111.194 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 814' ' ' LEU . . . . . 0.463 HD13 ' HG3' ' D' ' 841' ' ' ARG . 68.4 mt -112.4 154.94 44.37 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.507 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.91 55.13 1.71 Allowed 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.038 2.492 . . . . 10.0 112.649 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -151.3 19.65 0.75 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.164 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 67.0 mttm 62.12 31.97 17.59 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.715 -0.675 . . . . 10.0 111.22 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 818' ' ' GLN . . . . . 0.454 ' NE2' ' HB2' ' B' ' 41' ' ' ARG . 95.2 mt-30 -141.91 173.47 11.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.254 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.48 171.02 18.73 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.793 0.33 . . . . 10.0 111.708 -179.149 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 9.7 t -138.12 141.49 40.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.725 -0.671 . . . . 10.0 109.357 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 47.2 t -92.33 110.84 23.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.973 0.416 . . . . 10.0 111.333 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 17.3 t -102.07 141.5 18.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.247 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.99 135.77 35.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.46 -0.337 . . . . 10.0 110.095 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 824' ' ' VAL . . . . . 0.701 HG11 ' HB2' ' D' ' 871' ' ' ASP . 57.3 t -75.14 116.3 17.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 110.231 -0.285 . . . . 10.0 110.231 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 23.6 mtp180 -129.26 109.5 11.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.995 0.426 . . . . 10.0 111.196 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -70.21 114.54 8.46 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.477 0.656 . . . . 10.0 110.186 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 147.71 -34.75 1.23 Allowed Glycine 0 N--CA 1.446 -0.65 0 N-CA-C 110.118 -1.193 . . . . 10.0 110.118 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 828' ' ' MET . . . . . 0.433 ' HB2' ' HB2' ' D' ' 832' ' ' ASP . 10.7 ptm -98.0 150.29 21.53 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.447 -0.377 . . . . 10.0 110.132 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 829' ' ' SER . . . . . 0.67 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.3 OUTLIER -94.36 176.73 6.19 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.301 -179.065 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 92.3 t -59.05 -37.29 67.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 831' ' ' TYR . . . . . 0.498 ' HA ' ' HE3' ' D' ' 863' ' ' TRP . 52.9 t80 -58.09 -49.7 76.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.497 -0.774 . . . . 10.0 110.912 179.488 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 832' ' ' ASP . . . . . 0.433 ' HB2' ' HB2' ' D' ' 828' ' ' MET . 3.3 m-20 -68.42 -38.36 81.15 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.08 -0.509 . . . . 10.0 112.05 -179.064 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 5.4 m -73.02 -43.45 62.06 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.814 0.672 . . . . 10.0 112.814 -178.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 834' ' ' LEU . . . . . 0.572 HD11 HG11 ' D' ' 812' ' ' VAL . 0.6 OUTLIER -79.22 -15.02 58.67 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.454 0.539 . . . . 10.0 112.454 -178.896 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -56.3 -52.44 64.52 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.056 0.391 . . . . 10.0 112.056 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 5.2 mmmm -59.55 -36.39 76.07 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.062 0.393 . . . . 10.0 112.062 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -71.34 -38.3 71.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.915 0.388 . . . . 10.0 111.294 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 838' ' ' LEU . . . . . 0.421 HD21 HG11 ' D' ' 877' ' ' VAL . 90.4 mt -75.03 -45.22 43.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.275 -0.42 . . . . 10.0 111.184 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -58.91 -37.97 77.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.019 -0.537 . . . . 10.0 112.224 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 3.2 p -71.12 -12.75 16.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 121.073 0.463 . . . . 10.0 111.407 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 841' ' ' ARG . . . . . 0.463 ' HG3' HD13 ' D' ' 814' ' ' LEU . 11.8 mmt180 -110.65 -2.0 16.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.838 0.351 . . . . 10.0 111.061 179.696 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 77.65 24.4 65.13 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.999 -0.62 . . . . 10.0 112.443 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 843' ' ' LEU . . . . . 0.478 ' HB3' ' SG ' ' D' ' 848' ' ' CYS . 93.3 mt -106.52 143.93 33.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.545 0.212 . . . . 10.0 110.481 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -109.32 159.34 17.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.259 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -78.15 62.57 2.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.791 0.329 . . . . 10.0 110.995 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -134.32 -67.16 0.59 Allowed 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.123 -0.489 . . . . 10.0 112.046 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 1.7 p -87.78 -17.05 32.47 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.229 0.537 . . . . 10.0 110.707 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 848' ' ' CYS . . . . . 0.478 ' SG ' ' HB3' ' D' ' 843' ' ' LEU . 4.6 m -83.43 128.59 34.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.982 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 5.0 p -121.35 137.94 53.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.3 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 850' ' ' VAL . . . . . 0.438 HG22 HG22 ' D' ' 877' ' ' VAL . 20.7 t -98.62 127.31 51.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.779 -179.541 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -108.04 135.92 48.59 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.19 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 852' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' D' ' 858' ' ' LYS . 71.6 mtp180 -87.2 169.88 11.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.002 -0.544 . . . . 10.0 109.564 178.718 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 853' ' ' LEU . . . . . 0.418 HD22 ' HA ' ' D' ' 853' ' ' LEU . 0.6 OUTLIER -121.42 78.65 1.45 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.461 0.648 . . . . 10.0 111.049 -179.697 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 65.8 mt -91.66 94.24 4.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.227 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 855' ' ' LYS . . . . . 0.496 ' HA ' ' HD3' ' D' ' 855' ' ' LYS . 31.5 mmtt 58.58 28.39 17.02 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.51 -0.768 . . . . 10.0 112.157 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 102.25 -19.85 47.13 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 121.042 -0.599 . . . . 10.0 112.13 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.48 111.61 19.21 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.925 0.393 . . . . 10.0 111.3 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 858' ' ' LYS . . . . . 0.652 ' HE2' HD13 ' D' ' 876' ' ' ILE . 86.6 mttt -69.95 112.9 6.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.892 178.797 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -110.35 134.49 52.24 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.792 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 46.1 t -68.81 123.68 22.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.661 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 861' ' ' THR . . . . . 0.463 ' HB ' ' HG3' ' D' ' 852' ' ' ARG . 1.8 t -105.22 172.8 6.6 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.184 -0.302 . . . . 10.0 110.184 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -114.34 163.59 15.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.985 0.421 . . . . 10.0 110.817 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 863' ' ' TRP . . . . . 0.498 ' HE3' ' HA ' ' D' ' 831' ' ' TYR . 78.7 m95 -82.6 -21.44 35.17 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.539 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.91 -16.58 58.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.668 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 2.9 m -69.49 138.81 53.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.647 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 866' ' ' ALA . . . . . 0.67 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -76.43 151.55 36.48 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.671 -0.492 . . . . 10.0 109.671 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 867' ' ' ILE . . . . . 0.464 ' HA ' HD23 ' D' ' 870' ' ' LEU . 7.3 tp -82.93 0.59 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 121.104 0.478 . . . . 10.0 112.155 -179.129 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -61.29 -56.05 37.67 Favored Pre-proline 0 CA--C 1.543 0.707 0 N-CA-C 113.67 0.989 . . . . 10.0 113.67 -179.012 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.44 3.77 5.03 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 121.984 1.789 . . . . 10.0 113.001 -179.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 870' ' ' LEU . . . . . 0.464 HD23 ' HA ' ' D' ' 867' ' ' ILE . 2.9 mm? -85.76 -11.99 52.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.007 0.432 . . . . 10.0 111.402 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 871' ' ' ASP . . . . . 0.701 ' HB2' HG11 ' D' ' 824' ' ' VAL . 2.9 t70 -64.09 114.97 4.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.362 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 133.77 -30.18 3.01 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.76 -0.733 . . . . 10.0 112.508 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -119.78 -167.62 1.46 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.59 0.233 . . . . 10.0 110.937 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -131.7 153.71 49.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.114 -0.493 . . . . 10.0 110.286 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 70.6 mt -114.51 144.82 42.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.716 0.294 . . . . 10.0 111.622 -178.434 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 876' ' ' ILE . . . . . 0.652 HD13 ' HE2' ' D' ' 858' ' ' LYS . 3.2 mp -123.7 123.7 67.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 877' ' ' VAL . . . . . 0.438 HG22 HG22 ' D' ' 850' ' ' VAL . 17.3 t -103.44 135.77 39.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 120.649 0.261 . . . . 10.0 111.009 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.79 164.89 28.43 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.023 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 45.0 t -106.21 127.06 61.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 120.67 0.271 . . . . 10.0 110.57 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 94.7 mt . . . . . 0 C--O 1.252 1.207 0 CA-C-O 118.392 -0.813 . . . . 10.0 111.088 -179.998 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 82.8 mt . . . . . 0 N--CA 1.456 -0.157 0 CA-C-O 120.873 0.368 . . . . 10.0 110.585 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 202' ' ' LYS . . . . . 0.716 ' HE2' HG21 ' C' ' 576' ' ' VAL . 6.1 mtpm? -64.64 -46.35 82.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.706 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 203' ' ' LEU . . . . . 0.401 ' HG ' ' CD1' ' A' ' 207' ' ' TRP . 1.3 tt -61.23 -36.94 81.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.92 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 75.8 mt -61.4 -44.48 97.07 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.44 -179.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.37 -39.85 38.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.284 -0.416 . . . . 10.0 111.551 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -62.48 -45.14 94.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.839 0.352 . . . . 10.0 110.532 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 207' ' ' TRP . . . . . 0.401 ' CD1' ' HG ' ' A' ' 203' ' ' LEU . 8.0 m95 -68.55 -26.27 65.33 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.827 179.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -65.12 -39.95 93.8 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 3.1 m -65.64 -31.72 72.9 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 109.15 -0.685 . . . . 10.0 109.15 177.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 65.6 t -66.1 -49.02 79.43 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 115.866 -0.607 . . . . 10.0 109.575 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.17 -29.21 69.46 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.905 -0.405 . . . . 10.0 109.905 178.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 50.7 m -76.95 -2.15 32.27 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.413 0.625 . . . . 10.0 110.217 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 213' ' ' THR . . . . . 0.405 ' O ' ' HG ' ' A' ' 217' ' ' LEU . 81.9 m -108.19 -41.17 4.98 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 177.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -59.89 -37.74 80.26 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.234 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.3 -49.66 73.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.439 178.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 53.0 mmtt -61.36 -38.0 85.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.675 -0.693 . . . . 10.0 109.918 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 217' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 213' ' ' THR . 59.2 mt -64.81 -40.39 95.12 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.822 178.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -68.19 -36.91 80.31 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.697 -0.483 . . . . 10.0 109.697 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -70.74 -21.72 62.5 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.239 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -88.01 -48.62 7.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.537 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 221' ' ' LEU . . . . . 0.451 ' HA ' ' HB ' ' A' ' 224' ' ' VAL . 76.3 mt -58.1 -30.29 66.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.867 -0.606 . . . . 10.0 112.091 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -53.48 -71.32 0.71 Allowed Glycine 0 C--N 1.333 0.364 0 C-N-CA 121.053 -0.594 . . . . 10.0 111.71 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -62.21 -32.84 82.56 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.236 1.958 . . . . 10.0 111.227 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 224' ' ' VAL . . . . . 0.515 ' O ' ' HB2' ' A' ' 228' ' ' PHE . 4.8 t -58.35 -48.9 83.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 N-CA-C 111.732 0.271 . . . . 10.0 111.732 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 2.9 p -63.43 -35.31 80.0 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.902 -0.319 . . . . 10.0 110.589 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 61.1 mt-30 -69.85 -50.12 45.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.401 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -61.79 -39.88 93.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 10.0 109.919 179.172 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 228' ' ' PHE . . . . . 0.515 ' HB2' ' O ' ' A' ' 224' ' ' VAL . 0.3 OUTLIER -63.95 -45.82 87.46 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.617 178.474 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 229' ' ' TRP . . . . . 0.466 ' HA ' ' HB2' ' A' ' 232' ' ' LEU . 8.4 m95 -65.75 -38.91 90.39 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.262 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -58.35 -49.56 76.75 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 178.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 231' ' ' ASN . . . . . 0.663 ' HA ' ' HE3' ' A' ' 234' ' ' LYS . 70.9 m-20 -66.95 -37.98 85.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.41 -0.814 . . . . 10.0 109.767 179.29 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 232' ' ' LEU . . . . . 0.466 ' HB2' ' HA ' ' A' ' 229' ' ' TRP . 12.9 mt -63.84 -39.74 94.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.478 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 233' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 237' ' ' GLU . 61.2 mm-40 -62.25 -47.48 84.2 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 109.55 -0.537 . . . . 10.0 109.55 178.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 234' ' ' LYS . . . . . 0.663 ' HE3' ' HA ' ' A' ' 231' ' ' ASN . 25.1 mtmt -56.49 -44.99 81.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.055 0.455 . . . . 10.0 109.879 179.1 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -66.19 -52.36 48.83 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.713 -0.676 . . . . 10.0 111.105 179.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 24.4 p -62.88 -35.93 81.63 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.645 0.609 . . . . 10.0 112.645 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 237' ' ' GLU . . . . . 0.449 ' OE1' ' HA ' ' A' ' 237' ' ' GLU . 9.8 mm-40 -64.85 -44.41 89.86 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.235 -1.024 . . . . 10.0 108.235 178.091 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -64.57 -41.01 98.04 Favored Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 109.847 -1.301 . . . . 10.0 109.847 178.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 239' ' ' LEU . . . . . 0.661 HD22 H462 ' A' ' 20' ' ' PCW . 76.7 mt -62.85 -36.94 84.89 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 110.031 -0.359 . . . . 10.0 110.031 178.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -66.27 -50.33 64.06 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -58.29 -45.3 88.21 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.444 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 242' ' ' GLU . . . . . 0.585 ' HB3' ' NH2' ' C' ' 532' ' ' ARG . 31.2 mm-40 -63.87 -44.84 91.88 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.978 -1.01 . . . . 10.0 110.479 179.054 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 243' ' ' MET . . . . . 0.458 ' HG3' ' HG ' ' A' ' 247' ' ' LEU . 0.1 OUTLIER -65.15 -27.48 68.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.908 179.336 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 24.8 m -63.03 -49.16 75.72 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 108.411 -0.959 . . . . 10.0 108.411 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -70.55 -42.42 71.17 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.142 -0.688 . . . . 10.0 109.142 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 246' ' ' ASP . . . . . 0.449 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.6 OUTLIER -53.29 -65.02 0.64 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.277 -0.874 . . . . 10.0 110.934 179.911 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.458 ' HG ' ' HG3' ' A' ' 243' ' ' MET . 45.2 mt -58.5 -45.97 87.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.817 -0.629 . . . . 10.0 111.972 -179.114 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -61.03 -48.25 82.62 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.947 0.351 . . . . 10.0 111.947 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -65.19 -40.83 94.75 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.116 -0.328 . . . . 10.0 110.116 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 250' ' ' VAL . . . . . 0.627 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 24.8 t -63.51 -42.85 97.63 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.441 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.547 179.054 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.454 ' O ' HG12 ' A' ' 254' ' ' VAL . 89.6 mttt -72.38 -43.43 63.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.829 0.347 . . . . 10.0 111.398 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.94 -34.73 78.1 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.321 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 45.4 mtpt -88.57 -25.49 22.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.398 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.627 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.5 OUTLIER -65.84 -26.22 38.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.739 0.304 . . . . 10.0 110.548 179.51 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -61.21 -60.93 9.04 Favored Pre-proline 0 CA--C 1.535 0.388 0 CA-C-N 116.188 -0.46 . . . . 10.0 109.809 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 256' ' ' PRO . . . . . 0.421 ' HA ' ' HB3' ' A' ' 259' ' ' ASP . 20.1 Cg_endo -65.39 -24.41 57.34 Favored 'Trans proline' 0 C--N 1.36 1.176 0 C-N-CA 121.725 1.617 . . . . 10.0 111.059 177.218 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 257' ' ' TYR . . . . . 0.517 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 6.7 m-30 -65.53 -52.97 48.6 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 177.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 83.8 mt -66.44 -41.21 89.48 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.556 -0.747 . . . . 10.0 110.007 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 259' ' ' ASP . . . . . 0.447 ' O ' ' HB2' ' A' ' 263' ' ' LYS . 5.6 t70 -60.18 -43.91 95.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.065 0.459 . . . . 10.0 110.391 178.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -65.55 -47.24 76.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.278 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -65.92 -45.94 80.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.782 -0.644 . . . . 10.0 111.646 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 23.1 tt0 -64.9 -34.71 79.05 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-O 120.497 0.189 . . . . 10.0 110.537 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 263' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 259' ' ' ASP . 2.8 ttmp? -60.83 -49.57 76.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.507 0.67 . . . . 10.0 109.283 178.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.437 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 41.7 mttt -70.64 -35.11 72.74 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.342 -0.844 . . . . 10.0 110.199 179.089 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 9.2 t90 -62.44 -35.73 80.19 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.746 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -62.02 -46.05 90.88 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 108.827 -0.805 . . . . 10.0 108.827 178.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -62.74 -43.55 98.51 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 268' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 46.3 mt-10 -56.81 -48.9 76.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.68 179.29 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 81.3 mmm -71.64 -43.17 66.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.754 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -61.51 -49.94 74.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.902 -0.135 . . . . 10.0 111.113 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 86.8 mt -64.58 -36.27 83.68 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.867 -0.42 . . . . 10.0 109.867 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 272' ' ' TYR . . . . . 0.474 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 40.6 t80 -61.67 -50.03 74.14 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.479 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 273' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' A' ' 273' ' ' ARG . 50.3 mtt85 -67.05 -36.03 81.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.706 0.288 . . . . 10.0 110.588 179.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -61.2 -45.34 94.99 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.797 -0.638 . . . . 10.0 109.923 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.793 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 63.1 mttt -80.52 -31.65 37.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.428 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 1.4 t -53.95 -37.64 34.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 O-C-N 123.123 0.264 . . . . 10.0 111.42 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -58.96 -63.37 4.23 Favored Pre-proline 0 CA--C 1.533 0.296 0 N-CA-C 112.332 0.493 . . . . 10.0 112.332 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 278' ' ' PRO . . . . . 0.472 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 15.5 Cg_endo -60.68 -35.69 88.3 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 122.11 1.873 . . . . 10.0 111.601 178.312 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.979 HD22 ' HG2' ' C' ' 495' ' ' LYS . 16.6 mt -65.19 -41.61 94.38 Favored 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 109.931 -0.396 . . . . 10.0 109.931 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 20.4 ttm180 -67.55 -35.07 78.34 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -65.82 -44.17 86.43 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.261 178.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 282' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 83.8 mt-10 -60.46 -45.08 95.01 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 108.953 -0.758 . . . . 10.0 108.953 178.376 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 283' ' ' LEU . . . . . 0.583 ' HB3' H241 ' A' ' 3' ' ' PCW . 84.3 mt -62.71 -47.14 84.89 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.459 -0.791 . . . . 10.0 109.884 179.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -62.98 -56.71 14.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.91 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -61.92 -43.97 97.74 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.884 0.374 . . . . 10.0 110.576 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -61.98 -47.2 91.6 Favored Glycine 0 N--CA 1.444 -0.819 0 N-CA-C 110.857 -0.897 . . . . 10.0 110.857 178.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.61 -34.5 78.41 Favored 'General case' 0 C--O 1.218 -0.595 0 N-CA-C 110.187 -0.301 . . . . 10.0 110.187 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 288' ' ' ARG . . . . . 0.417 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 88.4 mtt180 -57.81 -44.92 86.7 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -68.83 -53.2 22.83 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.655 -0.498 . . . . 10.0 109.655 178.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 53.6 mttt -52.82 -49.74 65.07 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.668 -0.696 . . . . 10.0 111.515 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 84.1 mt -68.11 -45.48 73.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.487 -0.324 . . . . 10.0 111.355 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 292' ' ' HIS . . . . . 0.464 ' O ' ' HG3' ' A' ' 296' ' ' GLU . 43.8 t60 -59.84 -47.72 84.61 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.686 -0.234 . . . . 10.0 110.683 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 293' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 297' ' ' LYS . 44.3 mt-10 -63.03 -35.27 79.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.689 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 36.6 mt -70.94 -38.6 72.87 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.066 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -63.57 -35.39 80.34 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 108.65 -0.87 . . . . 10.0 108.65 177.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 296' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 292' ' ' HIS . 56.7 mt-10 -73.2 -7.44 51.45 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.081 -0.963 . . . . 10.0 110.349 178.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 297' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 293' ' ' GLU . 2.6 mmpp? -100.87 -44.28 5.82 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.757 -0.831 . . . . 10.0 108.757 178.059 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 90.7 mt -60.82 -22.85 64.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.598 -0.728 . . . . 10.0 111.267 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 299' ' ' SER . . . . . 0.518 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 18.5 m -73.77 -67.09 0.45 Allowed Pre-proline 0 CA--C 1.542 0.642 0 C-N-CA 120.841 -0.344 . . . . 10.0 111.41 178.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 300' ' ' PRO . . . . . 0.518 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 37.3 Cg_endo -65.84 -44.59 7.61 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.04 1.827 . . . . 10.0 112.25 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.542 HD13 ' HG2' ' C' ' 473' ' ' LYS . 85.0 mt -69.89 -22.01 63.27 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.024 0.44 . . . . 10.0 110.007 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -77.99 -45.22 10.62 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 109.169 -1.573 . . . . 10.0 109.169 177.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -61.57 -41.95 98.13 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.6 -0.889 . . . . 10.0 108.6 177.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.07 -36.88 85.07 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.272 -0.876 . . . . 10.0 109.448 178.337 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 11.2 tpt -64.81 -46.13 83.31 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.511 -0.551 . . . . 10.0 109.511 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 27.8 mtt180 -63.52 -43.55 96.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.419 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 307' ' ' ASP . . . . . 0.918 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 5.1 t0 -64.19 -40.04 95.26 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.253 -0.431 . . . . 10.0 110.348 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 308' ' ' ARG . . . . . 1.57 ' CD ' HD11 ' C' ' 469' ' ' LEU . 5.1 mmp_? -69.55 -36.72 76.62 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.912 -0.774 . . . . 10.0 108.912 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 309' ' ' ALA . . . . . 0.529 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -65.39 -35.07 79.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.739 -0.664 . . . . 10.0 109.783 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 310' ' ' ARG . . . . . 0.918 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 86.2 mtt180 -58.37 -55.22 37.86 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 109.026 -0.731 . . . . 10.0 109.026 178.437 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -62.28 -39.89 94.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.613 178.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 312' ' ' HIS . . . . . 0.592 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 0.2 OUTLIER -56.29 -54.45 45.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.738 179.246 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 313' ' ' VAL . . . . . 0.449 ' O ' ' HG3' ' A' ' 317' ' ' ARG . 57.7 t -73.75 -41.77 54.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.813 -0.63 . . . . 10.0 112.24 -178.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.1 -39.15 93.84 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.998 -0.281 . . . . 10.0 111.309 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -68.21 -28.73 67.5 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 108.569 -0.9 . . . . 10.0 108.569 177.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 16.5 mt -73.86 -37.17 64.84 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-N 115.428 -0.806 . . . . 10.0 108.889 178.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.449 ' HG3' ' O ' ' A' ' 313' ' ' VAL . 74.9 mtt180 -61.58 -49.37 76.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.933 0.397 . . . . 10.0 110.163 179.23 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -69.18 -10.35 57.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.818 -0.628 . . . . 10.0 112.063 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 17.5 m80 -106.31 -50.49 3.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.652 -0.249 . . . . 10.0 111.372 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 82.8 mt -63.12 -38.57 91.71 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.539 0.57 . . . . 10.0 112.539 -179.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.19 -60.24 9.54 Favored Pre-proline 0 CA--C 1.534 0.345 0 C-N-CA 121.206 -0.198 . . . . 10.0 111.292 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -66.43 -32.73 39.72 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 121.444 1.429 . . . . 10.0 111.239 178.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 323' ' ' TYR . . . . . 0.418 ' O ' ' HB2' ' A' ' 327' ' ' LEU . 5.2 m-30 -60.6 -48.66 80.78 Favored 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 110.333 -0.247 . . . . 10.0 110.333 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 324' ' ' SER . . . . . 0.49 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 25.4 p -69.97 -35.05 74.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.859 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 325' ' ' ASP . . . . . 0.643 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 37.0 t70 -67.04 -46.83 73.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.935 0.398 . . . . 10.0 110.161 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -67.77 -30.21 69.61 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.066 -0.716 . . . . 10.0 109.066 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 327' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 323' ' ' TYR . 1.0 OUTLIER -67.66 -29.61 68.95 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 108.952 -0.759 . . . . 10.0 108.952 178.01 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 328' ' ' ARG . . . . . 0.643 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 75.8 mtt180 -64.96 -38.45 91.02 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 108.611 -0.885 . . . . 10.0 108.611 178.041 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -69.12 -40.76 78.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.111 178.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 330' ' ' ARG . . . . . 0.53 ' NH2' ' HB3' ' C' ' 447' ' ' GLU . 13.5 ttm180 -65.17 -44.99 86.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.652 -0.704 . . . . 10.0 109.391 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 48.5 mt -65.12 -34.32 78.12 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.826 -0.624 . . . . 10.0 109.572 178.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -63.93 -43.07 96.99 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -64.2 -42.73 96.52 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.076 -0.713 . . . . 10.0 109.076 178.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 334' ' ' ARG . . . . . 0.558 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 6.7 mmt180 -61.28 -52.35 65.1 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.593 -0.73 . . . . 10.0 109.285 178.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 43.7 mt -61.51 -37.74 84.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.543 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -61.17 -48.86 79.61 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.42 -43.12 95.34 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.929 -0.578 . . . . 10.0 109.916 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 338' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 334' ' ' ARG . 69.5 mt -63.09 -32.61 74.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 10.0 111.274 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -76.46 -46.39 27.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.662 0.268 . . . . 10.0 110.507 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -65.48 -48.99 70.71 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.128 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 341' ' ' ASN . . . . . 0.427 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 3.8 m-20 -65.68 -38.04 88.16 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.549 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 342' ' ' GLY . . . . . 0.576 ' HA2' ' HD2' ' A' ' 345' ' ' ARG . . . -60.34 -42.98 99.06 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.472 -0.785 . . . . 10.0 111.544 179.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.75 -37.88 93.08 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 110.731 -0.948 . . . . 10.0 110.731 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -73.16 -44.82 59.41 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.446 -0.576 . . . . 10.0 109.446 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 345' ' ' ARG . . . . . 0.576 ' HD2' ' HA2' ' A' ' 342' ' ' GLY . 98.0 mtt180 -53.92 -49.33 68.9 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.969 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 95.3 mt -63.67 -40.56 97.14 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.325 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -64.29 -47.32 79.94 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.157 0.503 . . . . 10.0 109.839 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 348' ' ' GLU . . . . . 0.472 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 22.0 mt-10 -66.67 -41.38 88.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.788 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 349' ' ' TYR . . . . . 0.429 ' HD1' ' HA ' ' A' ' 349' ' ' TYR . 1.8 m-30 -61.22 -39.33 89.86 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.937 -0.394 . . . . 10.0 109.937 178.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -65.64 -39.92 91.96 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.395 -0.594 . . . . 10.0 109.395 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -65.7 -50.82 63.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.676 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 16.4 mttm -60.72 -37.57 82.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.575 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -64.89 -44.59 89.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.023 178.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 32.4 m -61.04 -41.79 97.25 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.832 -0.433 . . . . 10.0 109.832 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -63.19 -40.02 96.31 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 356' ' ' HIS . . . . . 0.554 ' HA ' ' OE1' ' C' ' 418' ' ' GLN . 17.7 m80 -65.79 -45.18 83.37 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.484 -0.78 . . . . 10.0 109.852 179.069 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.406 HD23 HD12 ' A' ' 360' ' ' LEU . 96.5 mt -59.49 -34.98 73.26 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.649 179.339 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 358' ' ' SER . . . . . 0.5 ' O ' ' HG3' ' A' ' 362' ' ' GLU . 29.7 m -63.26 -49.19 75.06 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.057 -0.519 . . . . 10.0 110.258 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 21.0 p -72.63 -28.22 62.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.084 0.468 . . . . 10.0 109.942 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 360' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 356' ' ' HIS . 28.9 mt -64.45 -47.65 78.24 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.164 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 1.4 p -64.69 -34.87 79.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.817 0.341 . . . . 10.0 110.591 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 362' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 358' ' ' SER . 25.5 mt-10 -68.48 -9.02 46.19 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.426 179.312 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.578 ' HD3' HG23 ' C' ' 411' ' ' THR . 7.5 mtmp? -116.88 -29.81 5.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.604 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -73.5 -14.69 61.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.281 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.72 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 95.4 mttt -117.09 -68.86 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 112.401 0.519 . . . . 10.0 112.401 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.72 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 50.2 Cg_exo -57.42 -56.07 2.06 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.141 1.894 . . . . 10.0 112.445 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -64.07 -42.62 96.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.207 -0.452 . . . . 10.0 111.367 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 368' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 368' ' ' LEU . 9.2 mt -65.68 -37.57 86.86 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 120.908 -0.317 . . . . 10.0 111.248 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 369' ' ' GLU . . . . . 0.837 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 9.6 mt-10 -68.77 -32.75 72.72 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.998 -0.371 . . . . 10.0 109.998 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.22 -45.0 78.13 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.413 -0.958 . . . . 10.0 108.413 177.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.51 -47.95 79.61 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.171 -0.922 . . . . 10.0 109.908 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -65.13 -39.9 93.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.933 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.837 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.8 mt-30 -64.32 -34.58 78.47 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.15 -0.477 . . . . 20.0 110.704 178.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -77.43 -34.65 39.61 Favored Glycine 0 C--N 1.332 0.336 0 N-CA-C 109.698 -1.361 . . . . 10.0 109.698 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 18.0 mt -61.26 -28.39 69.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.758 -0.221 . . . . 10.0 111.186 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 376' ' ' LEU . . . . . 0.491 ' HB2' ' HD3' ' A' ' 377' ' ' PRO . 56.3 mt -59.47 -65.07 2.27 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 121.083 -0.247 . . . . 10.0 111.089 179.241 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.491 ' HD3' ' HB2' ' A' ' 376' ' ' LEU . 30.6 Cg_endo -65.09 -34.07 47.92 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 121.819 1.68 . . . . 10.0 111.212 178.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 16.0 t -62.3 -53.36 48.48 Favored 'Isoleucine or valine' 0 C--O 1.231 0.095 0 CA-C-N 116.702 -0.226 . . . . 10.0 110.433 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 379' ' ' LEU . . . . . 0.4 ' O ' ' HG3' ' A' ' 383' ' ' LYS . 40.4 mt -62.09 -41.47 98.23 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 109.957 -0.386 . . . . 10.0 109.957 179.327 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 380' ' ' GLU . . . . . 0.485 ' O ' HG23 ' A' ' 384' ' ' VAL . 73.8 mt-10 -61.78 -46.65 88.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.765 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 30.0 p -64.45 -34.11 77.43 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.867 0.365 . . . . 10.0 110.346 178.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 382' ' ' PHE . . . . . 0.434 ' HD1' ' HA ' ' A' ' 382' ' ' PHE . 3.3 m-30 -68.55 -41.4 79.88 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.06 -0.718 . . . . 10.0 109.06 178.13 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 383' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 379' ' ' LEU . 83.0 mttt -63.22 -40.28 97.01 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 178.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 384' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 380' ' ' GLU . 54.5 t -59.98 -45.86 94.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-N 116.057 -0.52 . . . . 10.0 109.927 178.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.26 -43.06 71.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.522 -0.308 . . . . 10.0 111.491 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -63.68 -48.31 77.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.767 0.318 . . . . 10.0 111.38 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 99.2 mt -63.07 -39.76 95.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.432 -0.349 . . . . 10.0 111.363 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 388' ' ' SER . . . . . 0.414 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 31.4 p -72.52 -39.31 67.66 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.856 -0.338 . . . . 10.0 110.896 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -66.01 -31.07 71.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.261 0.553 . . . . 10.0 110.318 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 27.6 mt -61.4 -22.0 64.6 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.752 -0.658 . . . . 10.0 111.113 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -64.02 -50.36 68.81 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.902 -0.777 . . . . 10.0 108.902 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 392' ' ' GLU . . . . . 0.643 ' HA ' ' HG2' ' A' ' 395' ' ' LYS . 20.5 mp0 -61.56 -44.05 97.75 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.32 -0.855 . . . . 10.0 111.658 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -54.04 -42.52 69.27 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 123.683 0.614 . . . . 10.0 112.169 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 30.2 m -82.88 -38.88 22.3 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.396 0.517 . . . . 10.0 112.396 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 395' ' ' LYS . . . . . 0.643 ' HG2' ' HA ' ' A' ' 392' ' ' GLU . 2.1 ptpt -77.37 -2.74 36.63 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.808 0.67 . . . . 10.0 112.808 -178.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 396' ' ' LYS . . . . . 0.76 ' HD3' ' HB2' ' C' ' 587' ' ' ALA . 0.0 OUTLIER -110.29 -22.53 11.68 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 120.132 -0.627 . . . . 10.0 111.297 -179.927 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -108.26 2.18 22.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.795 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 . . . . . 0 C--O 1.237 0.428 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 -179.832 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 399' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' C' ' 399' ' ' LEU . 2.9 mm? . . . . . 0 CA--C 1.521 -0.156 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 23.0 mtpt -81.21 2.12 29.19 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.336 -0.847 . . . . 10.0 110.173 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 1.7 mt -62.76 -24.39 67.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.471 -0.786 . . . . 10.0 111.003 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 56.9 mt -64.6 -38.06 89.71 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.156 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.84 -43.55 75.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.617 0.722 . . . . 10.0 109.484 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -66.91 -44.73 80.03 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.391 -0.822 . . . . 10.0 110.667 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 405' ' ' TRP . . . . . 0.515 ' HE1' ' H39' ' A' ' 55' ' ' PCW . 0.0 OUTLIER -65.49 -29.19 69.81 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.224 -0.444 . . . . 10.0 111.176 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.23 -37.16 79.49 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 109.406 -0.59 . . . . 10.0 109.406 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 69.6 m -69.8 -28.63 65.89 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.408 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 408' ' ' VAL . . . . . 0.439 ' O ' ' HB ' ' C' ' 411' ' ' THR . 57.6 t -69.93 -38.16 74.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.479 -0.782 . . . . 10.0 108.89 178.408 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 1.6 m -62.54 -41.82 99.13 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.5 -0.926 . . . . 10.0 108.5 177.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 3.8 m -63.82 -33.18 75.09 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.044 -0.725 . . . . 10.0 109.044 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 411' ' ' THR . . . . . 0.578 HG23 ' HD3' ' A' ' 363' ' ' LYS . 95.7 m -65.93 -41.83 90.88 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 108.847 -0.797 . . . . 10.0 108.847 178.246 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -61.87 -42.3 98.89 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.291 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 413' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' C' ' 417' ' ' GLU . 8.5 m -61.17 -44.73 96.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.012 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 414' ' ' LYS . . . . . 0.413 ' HA ' ' HD3' ' C' ' 414' ' ' LYS . 35.0 mmtt -61.71 -37.58 84.7 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.127 0.489 . . . . 10.0 110.007 178.513 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 415' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' C' ' 411' ' ' THR . 83.9 mt -68.83 -38.24 79.7 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.663 178.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -65.0 -31.74 73.13 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.431 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 417' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' C' ' 413' ' ' SER . 13.7 mt-10 -65.25 -35.54 81.34 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 418' ' ' GLN . . . . . 0.744 ' O ' ' HB ' ' C' ' 422' ' ' VAL . 26.0 mt-30 -80.56 -33.49 36.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.723 -0.672 . . . . 10.0 109.972 178.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 53.2 mt -63.94 -15.88 60.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.636 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -89.0 -95.76 1.05 Allowed Glycine 0 N--CA 1.444 -0.803 0 C-N-CA 120.801 -0.714 . . . . 10.0 111.969 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 421' ' ' PRO . . . . . 0.466 ' O ' ' HB2' ' C' ' 425' ' ' GLU . 12.3 Cg_endo -54.05 -39.96 83.34 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.553 2.835 . . . . 10.0 114.345 -178.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 422' ' ' VAL . . . . . 0.744 ' HB ' ' O ' ' C' ' 418' ' ' GLN . 76.0 t -63.61 -48.18 87.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 117.953 0.342 . . . . 10.0 111.062 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 4.9 m -68.59 -39.16 81.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.817 0.342 . . . . 10.0 110.096 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -61.97 -42.28 98.95 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.276 -0.639 . . . . 10.0 109.276 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 425' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' C' ' 421' ' ' PRO . 14.6 tt0 -64.8 -39.74 94.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.205 -0.907 . . . . 10.0 108.676 178.637 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.37 -38.86 88.52 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.048 -0.723 . . . . 10.0 109.048 178.663 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -66.98 -38.16 85.55 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.602 178.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -64.7 -36.92 85.83 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 429' ' ' ASN . . . . . 0.472 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 7.2 t30 -68.2 -39.94 82.3 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 177.072 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 43.2 mt -61.21 -34.12 74.59 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.518 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -63.76 -35.61 81.16 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -72.89 -36.83 67.41 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.567 -0.901 . . . . 10.0 108.567 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -63.59 -48.62 76.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.039 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.75 -42.85 97.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.91 -0.587 . . . . 10.0 110.227 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -63.03 -40.92 99.19 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.92 -44.94 96.66 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 110.405 -1.078 . . . . 10.0 110.405 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 98.1 mt -63.39 -31.32 72.44 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 438' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' C' ' 438' ' ' ARG . 50.1 mtt180 -77.07 -3.45 39.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.089 0.471 . . . . 10.0 110.453 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -111.41 -23.68 10.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.684 -0.858 . . . . 10.0 108.684 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 440' ' ' GLU . . . . . 0.558 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 42.1 mt-10 -91.93 -61.0 1.72 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.927 -1.033 . . . . 10.0 110.494 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 97.4 mmm -62.66 -30.83 71.67 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.952 -0.567 . . . . 10.0 112.459 -178.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.5 p -60.17 -46.04 91.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.127 0.489 . . . . 10.0 109.725 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 443' ' ' LYS . . . . . 0.445 ' O ' ' HB2' ' C' ' 447' ' ' GLU . 88.2 mttt -78.83 -40.79 31.78 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.432 -0.804 . . . . 10.0 109.653 179.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 444' ' ' ASP . . . . . 0.493 ' CG ' ' HD3' ' A' ' 330' ' ' ARG . 1.0 OUTLIER -58.15 -52.91 63.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.739 -179.398 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 62.2 mt -58.85 -44.16 90.92 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -68.15 -38.17 81.83 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.7 -0.481 . . . . 10.0 109.7 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 447' ' ' GLU . . . . . 0.53 ' HB3' ' NH2' ' A' ' 330' ' ' ARG . 2.4 mm-40 -61.99 -38.68 89.53 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 178.137 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 32.2 t -66.4 -51.2 60.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-N 115.24 -0.891 . . . . 10.0 109.354 178.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -58.09 -48.53 79.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.767 0.318 . . . . 10.0 111.413 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -67.27 -11.78 58.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.184 -0.462 . . . . 10.0 112.031 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 451' ' ' LYS . . . . . 0.488 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 43.3 mttp -108.19 -33.1 7.24 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.025 0.38 . . . . 10.0 112.025 179.357 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 18.9 t -66.21 -37.93 80.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 O-C-N 123.158 0.286 . . . . 10.0 110.653 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -57.38 -60.57 9.33 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 121.011 -0.275 . . . . 10.0 110.742 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 454' ' ' PRO . . . . . 0.4 ' HA ' ' HB3' ' C' ' 457' ' ' ASP . 29.4 Cg_endo -67.06 -24.37 45.13 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 121.679 1.586 . . . . 10.0 111.674 178.38 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 455' ' ' TYR . . . . . 0.553 ' O ' ' HB2' ' C' ' 459' ' ' PHE . 46.3 t80 -69.02 -48.08 63.85 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 109.35 -0.611 . . . . 10.0 109.35 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 24.6 mt -69.41 -27.18 65.06 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.755 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 457' ' ' ASP . . . . . 0.4 ' HB3' ' HA ' ' C' ' 454' ' ' PRO . 6.2 t70 -71.78 -48.89 43.57 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 458' ' ' ASP . . . . . 0.596 ' HA ' ' HD2' ' C' ' 461' ' ' LYS . 12.2 t70 -65.5 -37.42 86.74 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 459' ' ' PHE . . . . . 0.553 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 0.3 OUTLIER -67.19 -36.56 82.0 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.371 -0.831 . . . . 10.0 109.348 178.256 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -64.8 -39.42 93.56 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.031 -0.729 . . . . 10.0 109.031 178.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 461' ' ' LYS . . . . . 0.596 ' HD2' ' HA ' ' C' ' 458' ' ' ASP . 40.6 mttp -60.88 -48.39 82.01 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.699 -0.852 . . . . 10.0 108.699 178.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 16.1 mtmm -64.95 -39.24 93.2 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.512 -0.767 . . . . 10.0 110.665 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 463' ' ' TRP . . . . . 0.452 ' HA ' ' CE3' ' C' ' 463' ' ' TRP . 1.3 m95 -62.8 -41.02 99.11 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.102 -0.703 . . . . 10.0 109.102 178.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -62.52 -49.89 73.55 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.061 -0.718 . . . . 10.0 109.061 178.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 0.932 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 42.4 mt-10 -55.96 -44.89 78.9 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.356 179.006 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -66.11 -52.78 45.46 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.88 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 88.3 mmm -59.63 -48.07 83.13 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.049 0.388 . . . . 10.0 112.049 -179.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -63.96 -46.14 86.0 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.554 -0.536 . . . . 10.0 109.554 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 1.57 HD11 ' CD ' ' A' ' 308' ' ' ARG . 96.4 mt -59.89 -43.23 94.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.623 -0.717 . . . . 20.0 110.659 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 13.0 m-30 -68.49 -36.75 79.38 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.049 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 -63.83 -39.37 94.06 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.329 -0.619 . . . . 10.0 109.329 178.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -81.47 10.44 5.8 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.629 -0.714 . . . . 10.0 111.244 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 473' ' ' LYS . . . . . 0.542 ' HG2' HD13 ' A' ' 301' ' ' LEU . 76.8 mttt -124.58 -54.2 1.66 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.281 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 474' ' ' VAL . . . . . 0.437 ' O ' ' HB2' ' C' ' 478' ' ' ARG . 79.2 t -58.15 -43.24 85.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.524 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 475' ' ' GLU . . . . . 0.46 ' HB2' ' CD ' ' C' ' 476' ' ' PRO . 83.1 mt-10 -60.7 -62.18 6.47 Favored Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 120.966 -0.294 . . . . 10.0 111.75 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 476' ' ' PRO . . . . . 0.46 ' CD ' ' HB2' ' C' ' 475' ' ' GLU . 18.2 Cg_endo -60.11 -40.1 63.61 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 121.985 1.79 . . . . 10.0 112.057 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 477' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' C' ' 477' ' ' LEU . 26.0 mt -65.31 -43.91 89.53 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.45 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 478' ' ' ARG . . . . . 0.437 ' HB2' ' O ' ' C' ' 474' ' ' VAL . 38.6 mtt180 -62.38 -39.84 94.5 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 109.665 -0.495 . . . . 10.0 109.665 179.026 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -63.92 -48.54 76.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.039 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -66.53 -39.83 88.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.489 179.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 23.1 mt -67.47 -32.03 72.59 Favored 'General case' 0 C--O 1.219 -0.552 0 N-CA-C 109.585 -0.524 . . . . 10.0 109.585 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 482' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 0.7 OUTLIER -67.72 -46.95 70.72 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.55 -0.537 . . . . 10.0 109.55 178.711 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -65.32 -40.51 93.81 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -66.64 -35.58 90.08 Favored Glycine 0 N--CA 1.445 -0.714 0 N-CA-C 110.646 -0.982 . . . . 10.0 110.646 178.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 485' ' ' ALA . . . . . 0.427 ' O ' ' HG ' ' C' ' 489' ' ' LEU . . . -71.77 -36.78 70.47 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 109.071 -0.715 . . . . 10.0 109.071 178.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -66.35 -37.4 85.23 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -66.06 -42.65 89.17 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 107.91 -1.144 . . . . 10.0 107.91 176.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 488' ' ' LYS . . . . . 0.471 ' HE2' HD11 ' C' ' 492' ' ' LEU . 76.5 tttt -65.11 -39.43 93.11 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.596 178.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 489' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' C' ' 485' ' ' ALA . 58.5 mt -63.38 -46.63 85.59 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.164 -0.68 . . . . 10.0 109.164 178.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -60.92 -41.39 96.09 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 108.968 -0.753 . . . . 10.0 108.968 178.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 491' ' ' GLU . . . . . 0.694 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 30.8 mt-10 -59.65 -53.2 60.8 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 177.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 492' ' ' LEU . . . . . 0.471 HD11 ' HE2' ' C' ' 488' ' ' LYS . 84.2 mt -56.27 -43.63 78.97 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.908 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -61.96 -51.47 67.96 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.95 -0.389 . . . . 10.0 109.95 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -70.66 -8.64 53.4 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.949 0.722 . . . . 10.0 112.949 -178.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.979 ' HG2' HD22 ' A' ' 279' ' ' LEU . 13.2 mttm -102.13 -49.97 3.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.96 0.409 . . . . 10.0 110.047 178.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 85.3 mt -71.3 -19.75 62.29 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.972 0.73 . . . . 10.0 112.972 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 68.4 m -71.73 -60.9 2.25 Favored Pre-proline 0 C--N 1.329 -0.29 0 C-N-CA 120.563 -0.455 . . . . 10.0 111.113 178.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -63.38 -37.54 48.85 Favored 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 121.835 1.69 . . . . 10.0 110.851 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 40.8 mt -72.04 -29.73 64.45 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 116.345 -0.389 . . . . 10.0 109.994 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -69.71 -46.82 52.17 Favored Glycine 0 N--CA 1.449 -0.47 0 N-CA-C 110.212 -1.155 . . . . 10.0 110.212 178.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -61.45 -42.2 98.4 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.312 -0.996 . . . . 10.0 108.312 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.64 -44.91 92.47 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 114.955 -1.021 . . . . 10.0 109.882 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 503' ' ' MET . . . . . 0.438 ' SD ' ' HD2' ' C' ' 506' ' ' ARG . 47.4 mmm -61.79 -34.31 75.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.706 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -68.97 -38.33 79.32 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.693 -0.484 . . . . 10.0 109.693 178.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.0 -30.14 61.07 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.932 -0.766 . . . . 10.0 108.932 178.027 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.438 ' HD2' ' SD ' ' C' ' 503' ' ' MET . 38.8 mtt180 -64.64 -46.02 84.35 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 107.056 -1.461 . . . . 10.0 107.056 176.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -62.18 -39.07 91.46 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 114.812 -1.085 . . . . 10.0 108.989 178.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 508' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' C' ' 512' ' ' ASP . 43.0 mtt180 -61.78 -54.16 46.18 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.849 -0.797 . . . . 10.0 108.849 178.065 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 509' ' ' ALA . . . . . 0.403 ' HB1' ' CD ' ' A' ' 264' ' ' LYS . . . -61.81 -22.42 65.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.349 -0.841 . . . . 10.0 112.766 -179.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -95.24 -52.12 4.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.58 0.229 . . . . 10.0 111.389 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 96.6 t -67.18 -44.26 87.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.46 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.521 ' HB2' ' O ' ' C' ' 508' ' ' ARG . 7.3 m-20 -64.87 -33.59 76.37 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.18 -47.29 77.47 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 107.136 -1.431 . . . . 10.0 107.136 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 514' ' ' LEU . . . . . 0.523 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 75.8 mt -61.15 -36.62 80.29 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.177 178.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -62.12 -23.35 66.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.963 0.411 . . . . 10.0 109.965 178.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 1.6 m -113.24 8.31 18.1 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.454 0.645 . . . . 10.0 110.236 179.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 517' ' ' HIS . . . . . 0.532 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 44.3 m170 -118.15 -47.2 2.58 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.207 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 76.2 mt -82.45 -29.43 30.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.886 -0.597 . . . . 10.0 111.247 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -60.1 -57.86 23.61 Favored Pre-proline 0 C--N 1.331 -0.216 0 C-N-CA 121.094 -0.243 . . . . 10.0 111.009 179.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -66.83 -27.7 43.69 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 121.242 1.294 . . . . 10.0 110.367 178.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 521' ' ' TYR . . . . . 0.532 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 34.7 t80 -65.51 -45.25 84.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.226 179.692 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 4.4 p -70.25 -34.54 72.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.859 0.361 . . . . 10.0 110.06 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 523' ' ' ASP . . . . . 0.421 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 0.4 OUTLIER -67.33 -45.53 76.14 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 178.752 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -61.41 -45.54 93.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.442 -0.947 . . . . 10.0 108.442 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 16.2 mt -61.58 -32.81 72.93 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.506 -0.77 . . . . 10.0 110.726 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 526' ' ' ARG . . . . . 0.421 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 37.7 mtt180 -64.1 -43.06 96.52 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 110.135 -0.32 . . . . 10.0 110.135 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -67.74 -44.35 77.75 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.994 -0.743 . . . . 10.0 108.994 178.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 528' ' ' ARG . . . . . 0.645 ' HB3' ' NH2' ' C' ' 532' ' ' ARG . 77.9 mtt180 -61.61 -43.17 99.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.924 -1.034 . . . . 10.0 110.739 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 57.2 mt -69.03 -35.48 76.67 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 116.176 -0.466 . . . . 10.0 110.203 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 530' ' ' ALA . . . . . 0.466 ' O ' ' HG3' ' C' ' 534' ' ' GLU . . . -63.13 -47.88 80.88 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.591 -0.522 . . . . 10.0 109.591 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -61.92 -40.23 94.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.717 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 532' ' ' ARG . . . . . 0.645 ' NH2' ' HB3' ' C' ' 528' ' ' ARG . 1.3 mtm180 -66.73 -40.49 88.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.497 -0.774 . . . . 10.0 110.168 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 17.2 mt -62.46 -40.8 97.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.129 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 534' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' C' ' 530' ' ' ALA . 40.1 mt-10 -63.77 -39.44 94.26 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.845 -0.428 . . . . 10.0 109.845 178.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -66.13 -40.61 90.78 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 97.3 mt -68.67 -33.43 73.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.262 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -77.06 -37.01 55.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.431 -0.349 . . . . 10.0 111.205 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -64.16 -53.35 50.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.114 0.483 . . . . 10.0 109.706 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -72.75 -32.75 65.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.474 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.43 -45.33 86.49 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.863 -0.684 . . . . 10.0 111.426 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -63.31 -35.64 92.33 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 110.72 -0.952 . . . . 10.0 110.72 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -70.49 -46.02 64.52 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.754 -0.832 . . . . 10.0 108.754 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 48.2 mtt85 -59.81 -36.66 77.21 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.73 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 74.1 mt -60.77 -41.82 96.24 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.605 -0.517 . . . . 10.0 109.605 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.98 -46.49 71.19 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 546' ' ' GLU . . . . . 0.646 ' O ' ' HD2' ' C' ' 550' ' ' LYS . 0.2 OUTLIER -58.22 -47.82 82.3 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.503 -0.771 . . . . 10.0 110.151 178.56 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -61.45 -40.91 96.22 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 116.345 -0.388 . . . . 10.0 110.494 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -63.32 -39.48 94.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.909 0.385 . . . . 10.0 110.177 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 549' ' ' ALA . . . . . 0.514 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -66.99 -46.47 74.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.374 178.44 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 550' ' ' LYS . . . . . 0.646 ' HD2' ' O ' ' C' ' 546' ' ' GLU . 0.0 OUTLIER -63.42 -36.71 84.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.144 178.716 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.93 -38.22 90.27 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.588 -0.893 . . . . 10.0 108.588 178.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 91.3 m -65.41 -44.55 87.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.474 -0.785 . . . . 10.0 108.895 178.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 553' ' ' GLU . . . . . 0.514 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 29.4 mt-10 -63.43 -41.11 98.68 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.332 -0.618 . . . . 10.0 109.332 178.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -63.85 -42.64 97.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.778 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 49.3 mt -65.61 -38.24 88.88 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 18.1 m -67.57 -38.45 84.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.388 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 2.9 p -78.29 -9.56 59.29 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.153 0.502 . . . . 10.0 110.162 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 19.4 mt -90.77 -25.33 20.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.785 -0.643 . . . . 10.0 109.434 178.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.9 m -60.89 -37.89 83.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.047 -0.524 . . . . 10.0 109.948 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 560' ' ' GLU . . . . . 0.42 ' O ' ' HG2' ' C' ' 564' ' ' PRO . 0.5 OUTLIER -74.79 0.52 15.13 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.583 179.638 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 561' ' ' LYS . . . . . 0.491 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 12.5 mptt -117.2 -45.83 2.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.015 0.436 . . . . 10.0 110.521 179.005 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -75.47 -8.76 57.56 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.101 -0.5 . . . . 10.0 112.151 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 563' ' ' LYS . . . . . 0.561 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 61.4 mttm -113.62 -75.73 0.01 OUTLIER Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 113.043 0.757 . . . . 10.0 113.043 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 564' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 30.4 Cg_endo -65.86 -45.16 6.64 Favored 'Trans proline' 0 C--N 1.357 0.989 0 C-N-CA 121.404 1.403 . . . . 10.0 112.355 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 565' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -64.79 -40.98 96.13 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.487 0.184 . . . . 10.0 111.275 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -40.76 96.78 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.863 -0.421 . . . . 10.0 109.863 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 567' ' ' GLU . . . . . 0.584 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 31.7 mm-40 -67.84 -35.52 78.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.998 178.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -66.46 -43.94 84.12 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.749 -0.834 . . . . 10.0 108.749 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.44 -42.97 97.22 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.647 178.192 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 570' ' ' ARG . . . . . 0.414 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 65.0 mtt180 -63.88 -42.52 97.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.052 178.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 571' ' ' GLN . . . . . 0.584 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.5 mt-30 -64.93 -21.96 66.91 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.571 -0.741 . . . . 20.0 111.794 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -89.39 -42.15 5.59 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 109.556 -1.418 . . . . 10.0 109.556 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 54.1 mt -59.25 -41.17 88.15 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.068 0.396 . . . . 10.0 112.068 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 574' ' ' LEU . . . . . 0.433 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 87.9 mt -51.61 -64.38 1.47 Allowed Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 112.716 0.635 . . . . 10.0 112.716 -179.477 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 575' ' ' PRO . . . . . 0.433 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 36.2 Cg_endo -65.46 -32.15 50.11 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.773 1.649 . . . . 10.0 111.964 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 576' ' ' VAL . . . . . 0.716 HG21 ' HE2' ' A' ' 202' ' ' LYS . 12.1 t -64.41 -48.02 86.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.649 -0.25 . . . . 10.0 110.527 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 49.1 mt -62.24 -37.45 85.48 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.461 -0.57 . . . . 10.0 109.461 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 578' ' ' GLU . . . . . 0.447 ' O ' HG23 ' C' ' 582' ' ' VAL . 2.9 mm-40 -62.75 -49.1 76.34 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.758 -0.656 . . . . 10.0 109.919 178.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 37.3 m -64.34 -37.39 87.33 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.396 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -66.52 -40.16 89.02 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.223 -0.658 . . . . 10.0 109.223 178.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 78.1 mttt -61.11 -43.88 98.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.157 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 582' ' ' VAL . . . . . 0.447 HG23 ' O ' ' C' ' 578' ' ' GLU . 97.4 t -59.86 -45.1 95.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 121.197 0.522 . . . . 10.0 109.926 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 9.5 m -68.25 -35.61 78.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.417 -0.81 . . . . 10.0 111.109 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 584' ' ' PHE . . . . . 0.464 ' O ' ' HG ' ' C' ' 588' ' ' LEU . 4.6 m-85 -72.24 -47.0 53.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.234 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 52.0 mt -58.94 -45.38 90.55 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.828 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 586' ' ' SER . . . . . 0.562 ' O ' ' HG3' ' C' ' 590' ' ' GLU . 9.4 p -63.24 -46.73 85.57 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.568 -0.53 . . . . 10.0 109.568 178.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 587' ' ' ALA . . . . . 0.76 ' HB2' ' HD3' ' A' ' 396' ' ' LYS . . . -56.18 -45.74 79.64 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.89 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 588' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' C' ' 584' ' ' PHE . 97.2 mt -55.67 -54.14 47.91 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.277 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -62.34 -46.83 86.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 10.0 111.7 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 590' ' ' GLU . . . . . 0.562 ' HG3' ' O ' ' C' ' 586' ' ' SER . 45.7 mt-10 -59.0 -47.95 83.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.463 -179.353 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -66.32 -43.13 87.03 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.296 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 35.9 m -61.47 -35.91 78.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.743 0.306 . . . . 10.0 111.014 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 593' ' ' LYS . . . . . 0.506 ' HE3' ' HA ' ' C' ' 590' ' ' GLU . 42.8 mtmt -64.99 -34.62 78.87 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.952 0.352 . . . . 10.0 111.952 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 594' ' ' LYS . . . . . 0.414 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 89.0 mttt -92.95 -14.17 27.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.966 0.412 . . . . 10.0 111.776 -179.362 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 94.0 mt -106.91 34.93 3.2 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.295 0.569 . . . . 10.0 110.16 179.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 60.8 t30 . . . . . 0 C--O 1.246 0.886 0 CA-C-O 118.49 -0.767 . . . . 10.0 110.502 -179.649 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.507 ' HG3' ' H32' ' A' ' 19' ' ' PCW . 73.9 mmm . . . . . 0 C--O 1.231 0.118 0 CA-C-O 121.223 0.535 . . . . 10.0 110.856 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 2.9 m -82.23 117.68 22.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.421 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.495 ' OE1' ' H71' ' A' ' 19' ' ' PCW . 28.7 tt0 -108.18 132.9 53.15 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.748 -179.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -117.29 142.89 46.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.658 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.417 ' HD3' ' HB3' ' B' ' 54' ' ' ASP . 50.8 mmtt -101.92 113.43 26.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.518 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.565 HD22 HD23 ' B' ' 159' ' ' LEU . 33.4 mt -112.13 125.97 54.69 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.522 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 59.2 t -110.13 122.81 65.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 120.941 -0.303 . . . . 10.0 110.504 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.594 HG12 ' HD2' ' B' ' 16' ' ' LYS . 59.5 t -102.18 108.86 24.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.357 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 9.6 m -109.57 153.53 11.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.543 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 168.76 168.72 31.23 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 111.227 -0.749 . . . . 10.0 111.227 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.418 ' O ' HG22 ' B' ' 14' ' ' VAL . . . -74.2 155.92 37.83 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.253 0.549 . . . . 10.0 111.545 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -66.13 119.3 12.81 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.672 -0.694 . . . . 10.0 111.788 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 124.43 -20.4 6.98 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.706 -0.759 . . . . 10.0 112.605 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.418 HG22 ' O ' ' B' ' 11' ' ' ALA . 35.6 m -65.28 -24.64 35.47 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -179.341 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.34 45.83 3.96 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.569 -0.824 . . . . 10.0 113.568 178.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.594 ' HD2' HG12 ' B' ' 8' ' ' VAL . 4.3 mtmp? -65.12 -44.0 90.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.668 0.27 . . . . 10.0 110.79 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.84 -46.91 84.07 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.084 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.83 -47.75 83.75 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.779 -0.646 . . . . 10.0 111.346 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 25.1 mt -57.68 -46.73 83.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.432 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' THR . . . . . 0.487 ' O ' HG12 ' B' ' 24' ' ' ILE . 1.4 m -68.64 -47.75 65.8 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.083 -0.508 . . . . 10.0 112.198 -179.356 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 88.6 mt -62.24 -31.77 52.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-O 120.806 0.336 . . . . 10.0 111.077 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.483 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 60.2 tp60 -66.3 -28.11 68.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.112 0.482 . . . . 10.0 110.581 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 29.4 tp -86.64 -33.86 19.98 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.934 0.397 . . . . 10.0 110.658 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' ILE . . . . . 0.487 HG12 ' O ' ' B' ' 20' ' ' THR . 46.3 mm -73.0 -78.36 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 112.421 0.526 . . . . 10.0 112.421 -179.234 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -98.42 -1.05 42.36 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.058 0.392 . . . . 10.0 112.058 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.483 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 4.0 t30 60.55 55.29 3.45 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.214 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -135.72 123.72 22.8 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.761 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -80.88 133.95 35.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.301 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 23.7 m -85.94 166.98 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.54 -0.3 . . . . 10.0 110.482 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -133.58 -17.19 2.28 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.364 0.602 . . . . 10.0 110.898 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 17.0 pm0 -97.68 165.52 11.93 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.464 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.512 ' HA ' H5'1 ' B' ' 201' ' ' GNP . 91.2 t80 -83.23 96.77 8.56 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 178.006 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -69.54 112.86 13.41 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.78 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -78.88 54.41 5.12 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.894 2.396 . . . . 10.0 111.919 -179.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -56.75 133.38 54.09 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.057 -0.974 . . . . 10.0 112.098 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.839 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 79.6 mt -126.34 -53.98 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 178.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.411 ' HB3' HG23 ' D' ' 821' ' ' VAL . 1.7 tm-20 -154.61 95.01 1.74 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.126 -0.943 . . . . 10.0 108.745 178.711 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -140.21 124.22 17.54 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.693 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.92 150.05 23.91 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.723 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 40' ' ' TYR . . . . . 0.409 ' HB3' HG13 ' B' ' 24' ' ' ILE . 97.9 m-85 -131.42 121.74 25.1 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 41' ' ' ARG . . . . . 0.759 HH11 HD21 ' B' ' 52' ' ' LEU . 28.8 ttp85 -118.14 126.5 52.34 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.727 0.298 . . . . 10.0 111.585 -178.422 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 52.7 tttt -140.92 161.95 36.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.5 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -120.77 127.09 51.64 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 110.11 -0.33 . . . . 10.0 110.11 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 7.3 m -138.83 169.22 18.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.966 0.412 . . . . 10.0 111.021 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 42.2 t -102.66 111.22 31.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 179.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 46' ' ' ILE . . . . . 0.407 HD11 HD11 ' B' ' 53' ' ' LEU . 32.7 mt -111.14 110.73 33.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.919 -178.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 61.65 38.96 14.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.698 -0.683 . . . . 10.0 111.941 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.6 -15.07 56.5 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.832 -0.622 . . . . 10.0 113.816 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -104.36 130.45 52.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 117.118 0.459 . . . . 10.0 111.331 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 1.2 t -75.53 127.68 33.63 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 73.8 m -137.0 139.71 41.62 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-O 121.14 0.495 . . . . 10.0 111.726 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.759 HD21 HH11 ' B' ' 41' ' ' ARG . 46.0 tp -95.27 121.04 36.51 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 107.609 -1.256 . . . . 10.0 107.609 178.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.407 HD11 HD11 ' B' ' 46' ' ' ILE . 88.0 mt -108.31 119.83 40.62 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 112.331 0.493 . . . . 10.0 112.331 -178.326 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.417 ' HB3' ' HD3' ' B' ' 5' ' ' LYS . 30.6 t70 -108.49 98.74 8.22 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.117 -1.068 . . . . 10.0 108.117 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 10.1 mt -90.57 127.12 43.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.477 -0.783 . . . . 10.0 111.369 -178.031 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.4 ' HG ' HG23 ' B' ' 58' ' ' THR . 61.1 tp -102.43 111.74 24.17 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.303 179.473 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -104.5 103.07 12.7 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.861 -0.608 . . . . 10.0 109.507 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 58' ' ' THR . . . . . 0.484 HG21 ' CE1' ' B' ' 71' ' ' TYR . 11.4 p -105.36 171.58 7.25 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.04 -0.527 . . . . 10.0 112.383 -178.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.839 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -61.96 145.75 52.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 10.0 112.06 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -108.74 25.54 18.83 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.62 -0.718 . . . . 10.0 111.4 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -136.0 34.88 2.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.055 0.455 . . . . 20.0 111.756 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.414 ' OE1' ' HD2' ' B' ' 68' ' ' ARG . 21.0 mt-10 -96.99 143.39 27.89 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.289 179.434 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -84.78 -74.18 0.4 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.387 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -158.38 87.32 0.9 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.167 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -105.55 141.19 37.45 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.866 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.34 -35.36 79.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.031 0.443 . . . . 10.0 110.28 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 50.3 ttp -62.76 -39.44 94.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.846 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.599 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 46.5 ttt85 -65.89 -46.6 77.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.132 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.533 ' O ' ' HG3' ' B' ' 73' ' ' ARG . 13.6 t70 -55.59 -44.46 76.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.717 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -64.34 -48.65 74.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.781 -0.645 . . . . 10.0 112.377 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 71' ' ' TYR . . . . . 0.599 ' CE2' ' HA ' ' B' ' 68' ' ' ARG 0.256 0.5 OUTLIER -70.78 -19.6 62.69 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.527 0.936 . . . . 10.0 113.527 -178.795 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' B' B ' 72' ' ' MET . . . . . 0.417 ' HB3' HG21 ' B' ' 103' ' ' VAL . 40.7 mmm -74.45 -24.24 59.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.181 0.515 . . . . 10.0 110.081 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 73' ' ' ARG . . . . . 0.533 ' HG3' ' O ' ' B' ' 69' ' ' ASP . 89.8 mtt180 -73.47 -30.75 63.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.5 -179.515 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.3 -5.2 43.45 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.979 0.733 . . . . 10.0 112.979 -179.251 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -87.87 130.78 10.26 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.383 -0.913 . . . . 10.0 111.799 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -80.94 -65.02 1.07 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.743 0.306 . . . . 10.0 110.275 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -103.18 147.75 16.96 Favored Glycine 0 N--CA 1.446 -0.7 0 N-CA-C 111.046 -0.822 . . . . 10.0 111.046 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -123.79 136.22 54.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.268 0.556 . . . . 10.0 111.909 -179.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.806 ' HG ' HD22 ' B' ' 159' ' ' LEU . 79.8 mt -107.61 120.45 42.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.316 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 18.2 m -92.69 88.7 6.37 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 27.3 t -88.1 116.03 29.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.987 -0.551 . . . . 10.0 112.048 -178.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.679 ' HB3' HD11 ' B' ' 93' ' ' ILE . 15.6 p90 -129.11 159.68 35.22 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.558 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -96.97 132.37 42.83 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 110.129 -0.323 . . . . 10.0 110.129 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 84' ' ' ILE . . . . . 0.549 ' CD1' ' HA ' ' B' ' 118' ' ' CYS . 2.5 pt -68.3 -10.94 13.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.91 0.386 . . . . 10.0 111.442 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 85' ' ' ASN . . . . . 0.409 ' HB3' ' HB2' ' B' ' 122' ' ' SER . 0.0 OUTLIER -104.25 5.47 34.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.434 179.946 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -124.3 104.44 8.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.172 0.511 . . . . 10.0 110.306 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.46 -34.57 78.06 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.579 -0.737 . . . . 10.0 111.875 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -60.55 -41.54 94.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.863 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 89' ' ' SER . . . . . 0.422 ' O ' HG12 ' B' ' 93' ' ' ILE . 11.2 m -63.42 -37.95 89.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.43 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 90' ' ' PHE . . . . . 0.498 ' HE1' ' HA ' ' B' ' 130' ' ' ALA . 65.5 t80 -64.98 -35.43 81.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.022 0.439 . . . . 10.0 110.766 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -80.37 -32.72 37.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.063 0.459 . . . . 10.0 110.574 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -73.91 -7.47 52.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.772 -0.649 . . . . 10.0 112.034 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 93' ' ' ILE . . . . . 0.679 HD11 ' HB3' ' B' ' 82' ' ' PHE . 23.8 mm -58.91 -37.9 69.9 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 CA-C-O 121.148 0.499 . . . . 10.0 109.985 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 16.0 t-80 -64.0 -33.46 75.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.196 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -62.77 -42.65 99.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.802 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 96' ' ' TYR . . . . . 0.416 ' CD2' ' HA ' ' B' ' 93' ' ' ILE . 19.0 m-85 -64.38 -44.79 90.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.084 -0.507 . . . . 10.0 109.695 179.04 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 97' ' ' ARG . . . . . 0.481 ' HD2' ' SD ' ' B' ' 111' ' ' MET . 10.8 tpt180 -56.67 -48.41 77.68 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.309 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -66.39 -41.55 89.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.447 -0.342 . . . . 10.0 111.614 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -60.67 -45.86 92.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.942 0.401 . . . . 10.0 110.691 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 100' ' ' ILE . . . . . 0.465 ' HA ' HG22 ' B' ' 103' ' ' VAL . 54.3 mt -65.79 -40.89 88.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.802 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 101' ' ' LYS . . . . . 0.641 ' HG2' ' HA ' ' B' ' 107' ' ' GLU . 39.3 mtpt -58.15 -37.18 74.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.004 -0.543 . . . . 10.0 111.259 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 59.8 ttp85 -76.98 -47.65 20.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.018 -0.537 . . . . 10.0 112.407 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.465 HG22 ' HA ' ' B' ' 100' ' ' ILE . 32.7 m -66.85 -30.1 48.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 N-CA-C 112.654 0.612 . . . . 10.0 112.654 -178.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.427 ' HA ' ' HD2' ' B' ' 104' ' ' LYS . 10.7 mmmm -91.72 -12.51 33.78 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 121.112 -0.235 . . . . 10.0 111.382 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 28.0 t0 60.0 34.8 21.5 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.696 0.76 . . . . 10.0 110.971 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 42.9 m -156.43 147.16 21.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.736 -0.665 . . . . 10.0 109.858 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 107' ' ' GLU . . . . . 0.641 ' HA ' ' HG2' ' B' ' 101' ' ' LYS . 20.7 mp0 -93.88 -26.67 16.8 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.972 0.415 . . . . 10.0 110.503 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -94.0 77.18 4.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.69 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 57.8 t -120.06 133.38 23.93 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.749 -0.659 . . . . 10.0 110.081 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 110' ' ' PRO . . . . . 0.488 ' HB3' ' HB3' ' B' ' 162' ' ' GLU . 32.4 Cg_exo -59.55 114.97 2.28 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.843 2.362 . . . . 10.0 112.324 179.6 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 111' ' ' MET . . . . . 0.481 ' SD ' ' HD2' ' B' ' 97' ' ' ARG . 41.1 mtt -136.71 156.5 48.45 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.386 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 112' ' ' VAL . . . . . 0.531 ' HB ' HD23 ' B' ' 79' ' ' LEU . 87.0 t -135.38 132.38 52.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 110.049 -0.352 . . . . 10.0 110.049 179.134 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 19.9 tp -84.53 121.89 28.23 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.381 -0.6 . . . . 10.0 109.381 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 47.7 t -117.11 115.13 47.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.031 0.443 . . . . 10.0 111.769 -178.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.69 97.25 1.76 Allowed Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 110.49 -1.044 . . . . 10.0 110.49 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -87.28 161.41 18.0 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.853 0.359 . . . . 10.0 111.925 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 91.4 mttt 69.54 35.18 2.56 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.336 -0.847 . . . . 10.0 112.148 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 118' ' ' CYS . . . . . 0.549 ' HA ' ' CD1' ' B' ' 84' ' ' ILE . 29.1 p -74.33 -12.97 60.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.479 -0.328 . . . . 10.0 111.797 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -81.39 -20.64 40.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.398 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 73.7 mt -67.92 142.42 95.44 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.013 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -61.66 -32.36 86.92 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.914 2.409 . . . . 10.0 111.947 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 122' ' ' SER . . . . . 0.409 ' HB2' ' HB3' ' B' ' 85' ' ' ASN . 0.1 OUTLIER -73.87 118.7 17.14 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.33 179.596 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 18.0 ttt180 -141.93 115.47 9.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.806 0.336 . . . . 10.0 111.094 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.56 -24.78 11.64 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.571 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 38.5 t -104.34 114.29 43.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.56 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 126' ' ' ASP . . . . . 0.526 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 13.8 t70 -75.61 152.42 37.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.676 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.2 m -56.75 -42.29 79.04 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.838 -0.619 . . . . 10.0 112.094 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -64.91 -44.7 88.68 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 121.256 -0.178 . . . . 10.0 111.294 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 129' ' ' GLN . . . . . 0.526 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 38.0 mt-30 -58.16 -45.97 86.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.851 0.357 . . . . 10.0 110.805 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 130' ' ' ALA . . . . . 0.498 ' HA ' ' HE1' ' B' ' 90' ' ' PHE . . . -67.6 -44.94 76.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.307 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -62.7 -39.79 95.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.847 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -61.7 -41.29 97.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.342 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 37.8 tp -64.78 -44.19 90.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.009 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.22 -43.98 97.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.184 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -60.35 -36.5 78.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.803 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 20.6 m -66.65 -30.42 70.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.688 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -85.82 -18.18 33.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.582 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.64 28.94 28.12 Favored Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 111.259 -0.736 . . . . 10.0 111.259 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 139' ' ' ILE . . . . . 0.415 ' HB ' ' HD2' ' B' ' 140' ' ' PRO . 50.4 pt -128.19 159.07 69.04 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.723 -0.238 . . . . 10.0 110.444 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 140' ' ' PRO . . . . . 0.415 ' HD2' ' HB ' ' B' ' 139' ' ' ILE . 90.2 Cg_endo -82.83 158.36 15.98 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 122.569 2.179 . . . . 10.0 112.42 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -119.07 124.38 46.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.398 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 23.0 mm -119.13 121.42 66.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.947 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 143' ' ' GLU . . . . . 0.404 ' HG2' ' CB ' ' B' ' 118' ' ' CYS . 6.7 tt0 -85.24 123.6 30.92 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.676 -1.231 . . . . 10.0 107.676 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 70.1 p -130.09 170.45 14.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.783 0.801 . . . . 10.0 113.073 -176.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 8.7 t -155.44 108.16 2.71 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.672 -1.149 . . . . 10.0 108.495 178.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -66.15 -24.94 66.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.739 0.304 . . . . 10.0 111.611 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 23.1 ttpp -74.85 -35.28 62.38 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.123 0.416 . . . . 10.0 112.123 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 69.6 p -100.68 -7.46 23.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.942 0.401 . . . . 10.0 111.156 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 149' ' ' ARG . . . . . 0.421 HH12 ' CG ' ' B' ' 153' ' ' ASP . 1.8 ttt-85 67.07 23.3 9.71 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 115.588 -0.733 . . . . 10.0 111.781 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -90.08 127.42 36.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.395 -0.366 . . . . 10.0 111.541 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 75.11 -4.85 37.02 Favored Glycine 0 CA--C 1.52 0.362 0 N-CA-C 114.635 0.614 . . . . 10.0 114.635 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 65.6 t -55.61 -60.91 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 117.1 0.45 . . . . 10.0 111.88 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 153' ' ' ASP . . . . . 0.421 ' CG ' HH12 ' B' ' 149' ' ' ARG . 0.1 OUTLIER -66.88 -34.01 76.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.974 0.416 . . . . 10.0 110.597 -179.51 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -59.76 -43.35 94.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.696 -0.684 . . . . 10.0 111.383 -179.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -59.64 -45.4 92.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.671 179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 156' ' ' PHE . . . . . 0.4 ' O ' HG23 ' B' ' 160' ' ' VAL . 55.8 m-85 -64.52 -43.99 92.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.806 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -59.88 -40.66 89.46 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.915 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 18.4 m -62.99 -43.07 99.81 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.789 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.806 HD22 ' HG ' ' B' ' 79' ' ' LEU . 39.6 tp -60.66 -44.11 96.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.42 . . . . 10.0 111.128 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 160' ' ' VAL . . . . . 0.4 HG23 ' O ' ' B' ' 156' ' ' PHE . 58.1 t -61.9 -38.53 80.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.181 0.515 . . . . 10.0 110.332 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -67.09 -33.66 75.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.177 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 162' ' ' GLU . . . . . 0.488 ' HB3' ' HB3' ' B' ' 110' ' ' PRO . 42.2 mm-40 -68.07 -40.61 82.68 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 109.763 -0.458 . . . . 10.0 109.763 178.521 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 81.2 mt -62.62 -45.5 98.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.341 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 76.0 mtt180 -61.03 -46.75 89.47 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.671 -0.695 . . . . 10.0 109.709 178.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -54.4 -47.53 72.62 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.674 -0.693 . . . . 10.0 111.42 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -64.65 -45.84 85.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.205 0.446 . . . . 10.0 112.205 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -66.96 -40.31 87.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.264 -0.425 . . . . 10.0 112.098 -179.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -65.6 -43.66 88.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.957 0.408 . . . . 10.0 110.351 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.7 tttm -60.23 -44.58 95.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.024 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 77.0 mtp -66.17 -31.92 73.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.416 -0.356 . . . . 10.0 111.783 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 22.0 m -76.06 -30.78 58.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.679 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -110.73 20.51 17.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.025 0.44 . . . . 10.0 111.108 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -74.0 -67.35 0.61 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.386 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 175.08 73.74 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.213 -0.994 . . . . 10.0 113.278 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 175' ' ' LYS . . . . . 0.668 ' HB3' ' H39' ' A' ' 20' ' ' PCW . 95.6 mttt -73.21 -48.39 35.49 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.108 0.48 . . . . 10.0 109.766 179.563 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 176' ' ' LYS . . . . . 0.91 ' HE2' ' H40' ' A' ' 20' ' ' PCW . 0.0 OUTLIER -84.59 -0.44 53.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.457 0.646 . . . . 10.0 109.926 179.281 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -86.43 -13.67 45.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.304 -0.862 . . . . 10.0 109.663 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 18.7 mtpt 65.97 62.5 0.61 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.817 -0.628 . . . . 10.0 110.985 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 26.9 tttm -110.56 91.31 3.61 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.523 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 42.7 tttm 62.07 95.15 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.831 0.678 . . . . 10.0 112.831 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -121.29 -57.91 1.82 Allowed 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.468 179.521 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp 62.15 -160.3 0.31 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.681 -0.691 . . . . 10.0 112.044 -179.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 3.4 m -140.21 -41.23 0.42 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.283 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 184' ' ' LYS . . . . . 0.504 ' HE2' ' H20' ' A' ' 16' ' ' PCW . 14.7 ptpt -99.26 99.78 10.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.936 0.398 . . . . 10.0 111.125 179.136 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 78.5 m . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.604 -179.611 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 111.779 -0.528 . . . . 10.0 111.779 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 9.3 p -123.79 133.68 53.78 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.598 -0.301 . . . . 10.0 110.561 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 8.8 t -123.45 135.44 63.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.282 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 811' ' ' LYS . . . . . 0.818 ' HB3' HG22 ' D' ' 821' ' ' VAL . 13.9 pttp -99.99 116.5 32.17 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.073 0.463 . . . . 10.0 111.112 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 812' ' ' VAL . . . . . 0.767 HG11 HD11 ' D' ' 834' ' ' LEU . 32.2 t -96.11 133.36 37.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.571 -179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.06 134.22 35.33 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.795 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 47.1 mt -99.71 150.28 36.67 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.132 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -67.75 0.64 4.02 Favored 'Trans proline' 0 CA--C 1.534 0.485 0 C-N-CA 122.999 2.466 . . . . 10.0 113.069 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -98.03 17.18 18.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.017 0.437 . . . . 10.0 110.076 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 28.1 tttp 66.89 48.35 1.32 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 115.369 -0.832 . . . . 10.0 110.565 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -150.05 -179.32 7.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.497 -0.774 . . . . 10.0 109.508 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.7 160.76 41.81 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.463 -0.199 . . . . 10.0 110.463 178.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 6.6 t -142.61 132.89 24.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.387 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 821' ' ' VAL . . . . . 0.818 HG22 ' HB3' ' D' ' 811' ' ' LYS . 57.1 t -91.82 117.68 35.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.076 0.465 . . . . 10.0 111.593 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 27.4 m -115.06 164.16 11.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.072 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.26 135.5 34.42 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.78 0.324 . . . . 10.0 110.948 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 824' ' ' VAL . . . . . 0.613 HG11 ' HB2' ' D' ' 871' ' ' ASP . 21.3 t -83.04 125.36 40.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 7.6 mtp180 -121.9 151.45 40.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.867 0.365 . . . . 10.0 110.823 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -91.7 37.38 0.96 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.497 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . -143.78 -66.79 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.449 -0.882 . . . . 10.0 113.047 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 828' ' ' MET . . . . . 0.415 ' HB2' ' HB2' ' D' ' 832' ' ' ASP . 11.5 ptm -58.44 155.62 11.7 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 113.072 0.767 . . . . 10.0 113.072 -179.315 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 829' ' ' SER . . . . . 0.857 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.3 OUTLIER -97.06 178.21 5.34 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.59 -0.732 . . . . 10.0 111.136 -179.222 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 79.3 t -60.12 -43.36 92.75 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 109.765 -0.457 . . . . 10.0 109.765 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 831' ' ' TYR . . . . . 0.642 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 34.1 t80 -55.36 -45.2 76.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.278 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 832' ' ' ASP . . . . . 0.415 ' HB2' ' HB2' ' D' ' 828' ' ' MET . 13.1 m-20 -69.16 -48.13 63.11 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.976 -0.557 . . . . 10.0 111.601 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 4.3 m -63.78 -40.32 96.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.88 -179.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 834' ' ' LEU . . . . . 0.767 HD11 HG11 ' D' ' 812' ' ' VAL . 3.2 mm? -82.89 -9.52 59.27 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 111.902 0.334 . . . . 10.0 111.902 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -62.61 -51.89 65.52 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 120.622 0.249 . . . . 10.0 110.552 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 13.3 mmmt -60.45 -29.99 69.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.947 -0.569 . . . . 10.0 111.22 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 837' ' ' ALA . . . . . 0.515 ' O ' HG12 ' D' ' 840' ' ' VAL . . . -75.66 -42.62 50.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.167 -0.469 . . . . 10.0 111.085 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 838' ' ' LEU . . . . . 0.742 HD12 ' HG3' ' D' ' 845' ' ' GLN . 30.8 mt -76.14 -41.08 51.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.724 0.297 . . . . 10.0 111.74 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -63.36 -26.27 68.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.431 -0.35 . . . . 10.0 111.259 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 840' ' ' VAL . . . . . 0.515 HG12 ' O ' ' D' ' 837' ' ' ALA . 0.9 OUTLIER -80.52 -17.66 12.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.114 0.483 . . . . 10.0 111.147 -179.545 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' D' D ' 841' ' ' ARG . . . . . 0.426 ' HD3' ' HA ' ' D' ' 841' ' ' ARG . 4.8 mmt180 -106.54 -0.62 23.77 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.37 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 77.5 32.89 45.23 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.762 -0.733 . . . . 10.0 112.105 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 62.5 mt -115.17 161.11 18.87 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.711 0.291 . . . . 10.0 110.745 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -122.38 152.0 40.63 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.112 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 845' ' ' GLN . . . . . 0.742 ' HG3' HD12 ' D' ' 838' ' ' LEU . 19.0 mp0 -78.42 21.5 0.37 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.906 0.706 . . . . 10.0 112.906 -178.549 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 37.4 p-10 -95.4 -40.68 9.38 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.422 0.527 . . . . 10.0 112.422 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 62.1 m -109.04 6.66 25.25 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.901 0.334 . . . . 10.0 111.901 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 36.2 m -106.61 144.75 32.82 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.91 0.386 . . . . 10.0 111.006 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 7.3 p -132.82 137.99 52.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.922 -0.581 . . . . 10.0 109.733 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 850' ' ' VAL . . . . . 0.407 ' O ' HG22 ' D' ' 861' ' ' THR . 18.1 t -99.83 139.49 21.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 120.768 0.318 . . . . 10.0 110.636 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 851' ' ' TYR . . . . . 0.857 ' HB3' ' HB3' ' D' ' 858' ' ' LYS . 65.7 m-85 -119.23 132.62 55.95 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.987 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 852' ' ' ARG . . . . . 0.594 ' HD3' HD11 ' D' ' 870' ' ' LEU . 8.4 mtm180 -79.21 171.37 15.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.351 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 853' ' ' LEU . . . . . 0.615 HD11 ' H61' ' A' ' 30' ' ' PCW . 0.2 OUTLIER -116.73 96.23 5.39 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.439 179.775 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' D' D ' 854' ' ' ILE . . . . . 0.719 ' HB ' ' H62' ' A' ' 12' ' ' PCW . 33.6 mt -133.36 115.76 23.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.537 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 855' ' ' LYS . . . . . 0.752 ' HB2' ' H41' ' A' ' 12' ' ' PCW . 3.4 mmpt? 63.78 42.38 6.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.663 -0.699 . . . . 10.0 111.681 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 856' ' ' GLY . . . . . 0.459 ' O ' ' H63' ' A' ' 30' ' ' PCW . . . 76.66 -31.32 1.46 Allowed Glycine 0 N--CA 1.452 -0.239 0 CA-C-N 115.796 -0.638 . . . . 10.0 113.742 179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 857' ' ' ARG . . . . . 0.91 HH21 ' HN1' ' A' ' 37' ' ' 17F . 20.5 mtp180 -91.53 158.4 16.48 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.281 0.562 . . . . 10.0 112.0 -179.166 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 858' ' ' LYS . . . . . 0.857 ' HB3' ' HB3' ' D' ' 851' ' ' TYR . 44.0 mtpt -87.68 148.95 24.55 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.455 -0.793 . . . . 10.0 111.223 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 1.3 m -127.99 137.21 52.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.453 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 860' ' ' VAL . . . . . 0.631 HG22 ' HE1' ' D' ' 851' ' ' TYR . 8.6 t -66.07 130.35 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.688 0.28 . . . . 10.0 111.421 -179.301 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 861' ' ' THR . . . . . 0.407 HG22 ' O ' ' D' ' 850' ' ' VAL . 2.1 t -127.68 160.79 30.58 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.955 -0.387 . . . . 10.0 109.955 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -103.57 159.45 15.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.865 0.364 . . . . 10.0 111.591 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 863' ' ' TRP . . . . . 0.642 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 96.2 m95 -79.0 -30.8 44.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.038 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.61 -29.76 70.97 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.508 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 2.2 m -64.36 145.51 55.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.417 -179.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 866' ' ' ALA . . . . . 0.857 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -73.5 161.83 29.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.118 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 867' ' ' ILE . . . . . 0.549 ' HA ' HD23 ' D' ' 870' ' ' LEU . 6.2 tp -93.98 -1.84 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.088 0.471 . . . . 10.0 111.097 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 868' ' ' ALA . . . . . 0.501 ' HB3' ' HD3' ' D' ' 869' ' ' PRO . . . -54.29 -51.8 74.65 Favored Pre-proline 0 CA--C 1.539 0.546 0 N-CA-C 113.582 0.956 . . . . 10.0 113.582 -179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 869' ' ' PRO . . . . . 0.501 ' HD3' ' HB3' ' D' ' 868' ' ' ALA . 6.0 Cg_exo -79.83 19.34 1.01 Allowed 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 122.466 2.111 . . . . 10.0 113.04 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 870' ' ' LEU . . . . . 0.594 HD11 ' HD3' ' D' ' 852' ' ' ARG . 2.6 mm? -107.64 22.22 16.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.258 0.551 . . . . 10.0 110.741 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 871' ' ' ASP . . . . . 0.613 ' HB2' HG11 ' D' ' 824' ' ' VAL . 10.3 t70 -87.38 108.12 18.84 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.564 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 127.93 -55.25 0.76 Allowed Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.665 -0.779 . . . . 10.0 112.767 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -85.41 172.06 11.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.833 0.349 . . . . 10.0 111.33 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 874' ' ' GLU . . . . . 0.475 ' O ' ' HB2' ' D' ' 853' ' ' LEU . 29.0 mt-10 -118.37 159.2 23.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.253 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 875' ' ' LEU . . . . . 0.419 ' HB2' HG13 ' D' ' 812' ' ' VAL . 24.8 mt -122.9 154.32 38.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.019 0.438 . . . . 10.0 111.875 -178.311 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 876' ' ' ILE . . . . . 0.641 ' HB ' ' HE3' ' D' ' 858' ' ' LYS . 61.1 mt -126.17 122.29 61.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.222 -0.659 . . . . 10.0 109.222 178.402 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 40.3 t -93.18 131.99 38.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.762 0.315 . . . . 10.0 111.146 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 878' ' ' GLU . . . . . 0.448 ' OE2' ' H61' ' A' ' 27' ' ' PCW . 0.0 OUTLIER -121.89 162.78 20.38 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.717 179.301 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' D' D ' 879' ' ' VAL . . . . . 0.468 ' O ' ' H71' ' A' ' 18' ' ' PCW . 50.6 t -114.84 133.16 61.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 120.91 0.386 . . . . 10.0 110.652 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 99.2 mt . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.343 -0.837 . . . . 10.0 110.075 179.626 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PCW . . . . . 0.733 H342 H351 ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PCW . . . . . 0.422 H142 H241 ' A' ' 21' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PCW . . . . . 0.651 ' H39' H161 ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PCW . . . . . 0.61 H151 H382 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PCW . . . . . 0.7 H121 H371 ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PCW . . . . . 0.627 ' O11' ' H73' ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PCW . . . . . 0.544 H332 H122 ' A' ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PCW . . . . . 0.598 H271 H422 ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PCW . . . . . 0.535 ' H71' ' O2 ' ' A' ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PCW . . . . . 0.652 H372 H281 ' A' ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PCW . . . . . 0.752 ' H41' ' HB2' ' D' ' 855' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PCW . . . . . 0.678 ' H42' ' H2 ' ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PCW . . . . . 0.594 H252 H442 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PCW . . . . . 0.41 H341 H251 ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PCW . . . . . 0.727 H362 H10A ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PCW . . . . . 0.652 H261 ' H61' ' A' ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PCW . . . . . 0.694 H171 ' H12' ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PCW . . . . . 0.507 ' H32' ' HG3' ' B' ' 1' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PCW . . . . . 0.91 ' H40' ' HE2' ' B' ' 176' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PCW . . . . . 0.585 H161 H171 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PCW . . . . . 0.692 H262 H182 ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PCW . . . . . 0.852 ' H73' HN1A ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PCW . . . . . 0.621 H281 H262 ' A' ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PCW . . . . . 0.722 H421 H141 ' A' ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PCW . . . . . 0.733 H351 H342 ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PCW . . . . . 0.568 ' H52' ' H4A' ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PCW . . . . . 0.613 ' H81' H331 ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PCW . . . . . 0.722 H141 H421 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PCW . . . . . 0.615 ' H61' HD11 ' D' ' 853' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PCW . . . . . 0.642 ' H73' H331 ' A' ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PCW . . . . . 0.648 H321 H20A ' A' ' 33' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' 17F . . . . . 0.668 ' H54' H461 ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' 17F . . . . . 0.852 HN1A ' H73' ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' 17F . . . . . 0.645 H11A ' H8A' ' A' ' 33' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' 17F . . . . . 0.752 H18A ' H36' ' A' ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' 17F . . . . . 0.91 ' HN1' HH21 ' D' ' 857' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' 17F . . . . . 1.04 ' H4 ' ' H1 ' ' A' ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' 17F . . . . . 0.727 H10A H362 ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' 17F . . . . . 0.752 ' H36' H18A ' A' ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PCW . . . . . 0.672 H412 H421 ' A' ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PCW . . . . . 0.669 H272 H361 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PCW . . . . . 0.856 ' H62' ' H11' ' A' ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PCW . . . . . 0.671 H481 H212 ' A' ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PCW . . . . . 0.552 H262 H252 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PCW . . . . . 0.513 ' H83' ' O2 ' ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PCW . . . . . 0.652 H472 H12A ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PCW . . . . . 0.647 H442 H172 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PCW . . . . . 0.724 H122 H352 ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PCW . . . . . 0.558 H482 H221 ' A' ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PCW . . . . . 0.713 H442 H442 ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PCW . . . . . 0.682 H152 H331 ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PCW . . . . . 0.442 H352 H371 ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PCW . . . . . 0.647 H172 H442 ' A' ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PCW . . . . . 0.671 H212 H481 ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PCW . . . . . 0.625 ' H51' ' H31' ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PCW . . . . . 0.724 H352 H122 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PCW . . . . . 0.492 ' O2P' ' H81' ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PCW . . . . . 0.672 H421 H412 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PCW . . . . . 0.682 H331 H152 ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PCW . . . . . 0.583 H351 H141 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PCW . . . . . 0.599 H122 H151 ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PCW . . . . . 0.652 H281 H372 ' A' ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PCW . . . . . 0.565 H472 H462 ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PCW . . . . . 0.472 ' H82' ' O31' ' A' ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PCW . . . . . 0.507 H261 H381 ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PCW . . . . . 0.553 ' H20' H171 ' A' ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PCW . . . . . 0.58 ' H42' ' O1P' ' A' ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PCW . . . . . 0.856 ' H11' ' H62' ' A' ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PCW . . . . . 0.73 ' H51' ' H2 ' ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PCW . . . . . 0.824 ' H71' ' H19' ' A' ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PCW . . . . . 0.599 H151 H122 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' 17F . . . . . 0.652 H12A H472 ' A' ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' 17F . . . . . 0.508 ' H64' ' H11' ' A' ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' 17F . . . . . 0.804 ' HN1' ' H4 ' ' A' ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' 17F . . . . . 0.566 ' H38' ' H74' ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' 17F . . . . . 0.527 ' H10' H382 ' A' ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' 17F . . . . . 0.446 ' H48' H422 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' 17F . . . . . 0.622 ' H4 ' ' H1 ' ' A' ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' 17F . . . . . 0.553 ' H10' H162 ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 201' ' ' GNP . . . . . 0.512 H5'1 ' HA ' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 87.0 mt . . . . . 0 CA--C 1.519 -0.235 0 CA-C-O 121.163 0.506 . . . . 10.0 109.759 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 25.7 mttp -64.48 -27.95 69.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.391 -0.822 . . . . 10.0 110.342 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 39.3 mt -71.06 -32.56 69.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.131 179.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.91 -38.01 85.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.485 . . . . 10.0 109.858 179.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -65.77 -38.59 89.48 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 115.798 -0.637 . . . . 10.0 109.649 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 206' ' ' ASN . . . . . 0.456 ' O ' HG23 ' A' ' 210' ' ' VAL . 11.0 m-80 -72.53 -52.94 13.5 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.217 -0.901 . . . . 10.0 111.147 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 38.4 m0 -57.83 -39.43 77.63 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.56 0.578 . . . . 10.0 112.56 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -59.46 -40.17 86.02 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.033 0.444 . . . . 10.0 110.481 179.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 49.8 m -74.17 -35.66 64.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.183 178.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 210' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 206' ' ' ASN . 77.8 t -63.39 -45.59 97.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.64 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 8.6 p -64.69 -46.78 80.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.072 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 2.5 p -62.1 -38.53 89.25 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.887 0.375 . . . . 10.0 110.192 179.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 92.3 m -64.48 -42.81 95.67 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -62.49 -43.08 99.68 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.816 -0.438 . . . . 10.0 109.816 178.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 57.7 m -60.56 -45.9 92.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.125 -0.489 . . . . 10.0 109.918 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 216' ' ' LYS . . . . . 0.512 ' HA ' ' HD3' ' A' ' 216' ' ' LYS . 11.2 mmtp -66.12 -34.69 78.62 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.229 -0.442 . . . . 10.0 110.446 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 48.1 mt -64.3 -41.95 96.6 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.086 -0.709 . . . . 10.0 109.086 178.386 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -66.38 -36.05 81.87 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.398 -0.593 . . . . 10.0 109.398 178.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -68.41 -18.72 64.51 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.444 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -93.31 -46.74 7.23 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.529 -0.915 . . . . 10.0 108.529 178.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 89.1 mt -59.35 -35.2 73.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.553 -0.749 . . . . 10.0 111.782 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -53.57 -70.33 0.96 Allowed Glycine 0 C--N 1.332 0.31 0 N-CA-C 111.783 -0.527 . . . . 10.0 111.783 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.6 -33.05 87.68 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.077 1.851 . . . . 10.0 111.266 178.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 2.3 t -59.55 -47.22 91.72 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-N 116.48 -0.327 . . . . 10.0 111.168 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 3.0 p -65.29 -36.61 84.61 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 120.636 -0.426 . . . . 10.0 109.943 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -63.61 -47.16 82.55 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -64.47 -37.96 89.34 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.687 -0.688 . . . . 10.0 109.54 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 228' ' ' PHE . . . . . 0.44 ' HD1' ' HA ' ' A' ' 228' ' ' PHE . 3.3 m-30 -66.86 -43.89 82.42 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.289 178.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 229' ' ' TRP . . . . . 0.589 ' O ' ' HG2' ' A' ' 233' ' ' GLU . 3.3 m95 -60.1 -47.21 86.83 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.662 -0.496 . . . . 10.0 109.662 178.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.01 -42.59 98.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.458 178.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -62.64 -46.08 89.88 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.274 -0.639 . . . . 10.0 109.274 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 84.4 mt -65.84 -30.13 70.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.222 -0.899 . . . . 10.0 110.598 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 233' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' ' 229' ' ' TRP . 68.3 mm-40 -60.89 -49.42 77.55 Favored 'General case' 0 C--O 1.223 -0.314 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 178.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 14.5 mtmm -62.34 -42.14 99.14 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.509 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -65.93 -44.15 85.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.003 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 26.9 p -70.46 -26.69 63.75 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.419 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -69.39 -46.25 67.34 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.369 -0.974 . . . . 10.0 108.369 177.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -63.11 -39.96 98.62 Favored Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 109.732 -1.347 . . . . 10.0 109.732 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 33.6 mt -68.24 -33.82 75.1 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.986 -0.376 . . . . 10.0 109.986 178.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 21.6 mtm180 -65.79 -43.1 89.73 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.13 -0.692 . . . . 10.0 109.13 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 43.0 tt0 -64.98 -41.1 95.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.608 -0.724 . . . . 10.0 109.172 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -65.73 -45.78 81.38 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.298 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 243' ' ' MET . . . . . 0.49 ' O ' ' HB2' ' A' ' 247' ' ' LEU . 48.1 mmm -60.4 -48.25 82.58 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.964 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.9 p -59.53 -37.82 79.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.054 0.454 . . . . 10.0 111.236 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 245' ' ' LYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 93.5 mttt -78.61 -59.44 2.78 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.17 179.434 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -56.23 -50.13 72.18 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.983 0.735 . . . . 10.0 112.983 -178.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 243' ' ' MET . 21.4 mt -56.5 -51.59 67.92 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.582 0.23 . . . . 10.0 111.437 -179.41 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -67.65 -33.01 74.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.531 -0.304 . . . . 10.0 111.355 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 249' ' ' GLU . . . . . 0.449 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 0.2 OUTLIER -68.64 -43.5 76.14 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.604 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 48.4 t -67.91 -41.91 85.2 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.409 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.867 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 44.0 mttm -64.28 -42.96 96.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.712 0.291 . . . . 10.0 110.826 179.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -64.43 -40.81 96.47 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.109 -0.496 . . . . 10.0 109.945 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 7.7 mtpt -77.93 -21.81 50.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.811 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.46 ' HA ' ' HB2' ' A' ' 257' ' ' TYR . 0.5 OUTLIER -66.55 -26.26 37.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.413 -0.358 . . . . 10.0 110.057 179.349 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 255' ' ' GLN . . . . . 0.505 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 70.8 mt-30 -62.45 -61.79 6.94 Favored Pre-proline 0 N--CA 1.451 -0.408 0 CA-C-N 115.922 -0.581 . . . . 10.0 109.599 178.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 256' ' ' PRO . . . . . 0.505 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 19.7 Cg_endo -62.61 -27.06 76.01 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 121.741 1.627 . . . . 10.0 110.818 177.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 257' ' ' TYR . . . . . 0.494 ' HE1' ' CG ' ' C' ' 517' ' ' HIS . 3.9 m-30 -62.13 -60.61 3.35 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.838 -0.801 . . . . 10.0 108.838 178.114 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 86.5 mt -64.3 -35.01 79.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.915 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -64.55 -55.08 22.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.543 -0.299 . . . . 10.0 110.548 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -64.3 -42.05 96.55 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.325 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 261' ' ' PHE . . . . . 0.481 ' O ' ' HB2' ' A' ' 265' ' ' TRP . 4.7 m-30 -62.04 -38.69 89.68 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.422 -0.354 . . . . 10.0 110.122 178.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -67.81 -43.2 80.19 Favored 'General case' 0 C--O 1.22 -0.471 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -58.99 -49.34 78.26 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.767 ' HE3' ' HB1' ' C' ' 509' ' ' ALA . 14.6 mptt -63.94 -55.28 23.68 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.734 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 265' ' ' TRP . . . . . 0.481 ' HB2' ' O ' ' A' ' 261' ' ' PHE . 0.0 OUTLIER -58.22 -39.97 80.45 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.049 0.388 . . . . 10.0 112.049 -179.324 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 266' ' ' GLN . . . . . 0.46 ' O ' ' HG3' ' A' ' 270' ' ' GLU . 43.0 tt0 -63.47 -47.45 81.72 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -64.44 -44.66 90.44 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.724 -0.473 . . . . 10.0 109.724 178.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 268' ' ' GLU . . . . . 0.506 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 48.3 mt-10 -61.11 -38.05 84.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.653 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 14.9 ttt -70.56 -46.27 63.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.061 179.168 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 270' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 266' ' ' GLN . 40.8 mt-10 -63.84 -45.91 87.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.472 179.269 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 74.3 mt -63.47 -29.99 71.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.004 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 272' ' ' TYR . . . . . 0.506 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 0.1 OUTLIER -73.77 -45.98 48.45 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.103 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -61.62 -37.66 84.76 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.343 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -62.92 -20.4 65.15 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.216 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.584 ' O ' ' HB2' ' A' ' 279' ' ' LEU . 51.5 mttp -99.85 -30.86 11.8 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.952 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 276' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 272' ' ' TYR . 42.6 t -62.04 -42.56 95.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.879 179.444 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 277' ' ' GLU . . . . . 0.417 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 17.5 mt-10 -55.77 -59.25 12.02 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 111.695 0.257 . . . . 10.0 111.695 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 278' ' ' PRO . . . . . 0.417 ' HD3' ' HB2' ' A' ' 277' ' ' GLU . 29.1 Cg_endo -66.67 -36.97 23.01 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 121.639 1.559 . . . . 10.0 111.397 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.584 ' HB2' ' O ' ' A' ' 275' ' ' LYS . 3.0 mt -60.16 -44.76 94.74 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 120.666 0.269 . . . . 10.0 110.722 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 23.2 ttm180 -58.62 -42.14 87.52 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.174 -0.676 . . . . 10.0 109.174 179.106 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -69.73 -47.87 61.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.842 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -58.25 -47.29 84.03 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.016 0.436 . . . . 10.0 110.399 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 61.1 mt -66.93 -41.6 86.73 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.933 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -62.78 -56.4 17.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.495 0.188 . . . . 10.0 111.335 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -66.33 -41.57 89.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.892 0.377 . . . . 10.0 110.695 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -62.03 -49.43 75.29 Favored Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 111.621 -0.592 . . . . 10.0 111.621 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -67.17 -35.57 79.94 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 109.93 -0.396 . . . . 10.0 109.93 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 39.2 ttm180 -60.42 -45.14 94.68 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 178.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -63.1 -54.18 41.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.061 178.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 73.3 mttt -58.14 -46.42 85.68 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.476 -0.784 . . . . 10.0 111.551 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 60.7 mt -68.53 -42.4 78.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.576 -0.284 . . . . 10.0 111.622 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -61.19 -46.91 88.54 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.35 -0.241 . . . . 10.0 110.35 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -65.75 -36.31 83.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.762 0.315 . . . . 10.0 111.006 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 36.9 mt -69.86 -41.86 74.3 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 178.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -67.66 -37.46 82.42 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.021 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.3 -30.86 70.83 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.913 -0.585 . . . . 10.0 109.602 178.443 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 297' ' ' LYS . . . . . 0.543 ' HE2' ' HB2' ' C' ' 476' ' ' PRO . 18.6 tttp -82.25 -26.24 33.39 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.381 178.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 18.9 mt -67.01 -24.72 66.05 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.719 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 299' ' ' SER . . . . . 0.438 ' HB2' ' CD ' ' A' ' 300' ' ' PRO . 31.4 m -65.85 -63.54 3.19 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.837 178.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 300' ' ' PRO . . . . . 0.438 ' CD ' ' HB2' ' A' ' 299' ' ' SER . 17.7 Cg_endo -61.64 -47.08 12.1 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 121.632 1.555 . . . . 10.0 111.732 178.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.535 HD22 ' HG2' ' C' ' 473' ' ' LYS . 80.2 mt -65.24 -28.62 69.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.726 0.298 . . . . 10.0 111.38 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -81.46 -45.58 7.32 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 110.802 -0.919 . . . . 10.0 110.802 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -62.22 -43.41 98.88 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.852 -0.425 . . . . 10.0 109.852 178.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -66.86 -31.72 72.51 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 109.535 -0.543 . . . . 10.0 109.535 178.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 305' ' ' MET . . . . . 0.486 ' HB2' ' O ' ' A' ' 301' ' ' LEU . 12.9 tpt -67.86 -45.45 74.54 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 306' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 306' ' ' ARG . 49.5 mtt85 -66.95 -36.21 81.71 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.896 178.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -64.46 -47.52 78.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.24 178.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 308' ' ' ARG . . . . . 0.892 ' HG3' HD21 ' C' ' 469' ' ' LEU . 13.0 mmt180 -70.76 -33.32 70.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.168 178.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -63.62 -36.78 84.94 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 35.2 ttm105 -60.3 -50.89 71.85 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.17 -1.048 . . . . 10.0 108.17 177.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.16 88.45 Favored 'General case' 0 C--N 1.331 -0.203 0 O-C-N 123.702 0.626 . . . . 10.0 110.222 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 312' ' ' HIS . . . . . 0.685 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 5.2 m-70 -56.98 -57.61 11.78 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.958 -0.564 . . . . 10.0 109.886 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 313' ' ' VAL . . . . . 0.418 ' O ' ' HG3' ' A' ' 317' ' ' ARG . 47.8 t -68.56 -39.17 80.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.446 -0.797 . . . . 10.0 112.308 -178.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 314' ' ' ASP . . . . . 0.432 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 7.3 t0 -62.71 -45.69 91.6 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.579 0.228 . . . . 10.0 111.369 -179.253 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -65.46 -32.05 73.46 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.984 -0.747 . . . . 10.0 108.984 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 36.1 mt -71.88 -34.3 69.08 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 115.223 -0.899 . . . . 10.0 109.809 178.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.432 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 64.2 mtt180 -62.58 -49.89 73.47 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.636 -0.505 . . . . 10.0 109.636 178.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 2.9 m -66.57 -13.38 60.95 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.482 -0.781 . . . . 10.0 111.23 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -100.99 -43.0 6.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.4 -0.364 . . . . 10.0 110.754 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 320' ' ' LEU . . . . . 0.489 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 64.2 mt -67.65 -30.87 70.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.444 -0.344 . . . . 10.0 111.398 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 321' ' ' ALA . . . . . 0.403 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -57.32 -60.86 8.43 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 121.268 -0.173 . . . . 10.0 110.698 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.403 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 27.8 Cg_endo -66.16 -38.02 23.01 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.246 1.297 . . . . 10.0 110.385 177.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 323' ' ' TYR . . . . . 0.489 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 4.2 m-30 -55.57 -52.68 62.92 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 111.83 0.307 . . . . 10.0 111.83 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 22.0 p -63.96 -43.68 95.08 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 123.088 0.243 . . . . 10.0 111.603 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 325' ' ' ASP . . . . . 0.466 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 2.6 t70 -65.88 -41.78 91.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.996 0.427 . . . . 10.0 110.819 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 326' ' ' GLU . . . . . 0.46 ' O ' ' HG3' ' A' ' 330' ' ' ARG . 73.0 mt-10 -70.81 -30.11 66.47 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.359 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 327' ' ' LEU . . . . . 0.668 HD23 ' HD3' ' A' ' 330' ' ' ARG . 13.4 mt -66.34 -35.65 80.89 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 108.231 -1.025 . . . . 10.0 108.231 177.299 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 328' ' ' ARG . . . . . 0.466 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 59.8 mtt180 -64.99 -35.56 81.57 Favored 'General case' 0 C--O 1.223 -0.294 0 N-CA-C 108.676 -0.861 . . . . 10.0 108.676 177.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -67.48 -41.55 84.42 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.103 -0.703 . . . . 10.0 109.103 178.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 330' ' ' ARG . . . . . 0.668 ' HD3' HD23 ' A' ' 327' ' ' LEU . 4.6 mtp-105 -65.31 -45.54 83.93 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 108.984 -0.747 . . . . 10.0 108.984 178.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 44.2 mt -64.34 -38.24 90.32 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.89 179.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 332' ' ' ALA . . . . . 0.458 ' O ' ' HG2' ' A' ' 336' ' ' GLU . . . -63.55 -45.06 92.23 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.92 -44.76 94.12 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.304 -0.628 . . . . 10.0 109.304 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 334' ' ' ARG . . . . . 0.495 HH21 ' CG ' ' C' ' 444' ' ' ASP . 81.6 mtt180 -63.72 -43.27 97.04 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.989 178.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 55.4 mt -65.18 -44.99 86.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.668 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 336' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 332' ' ' ALA . 34.8 mm-40 -59.21 -42.48 91.05 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.572 -0.529 . . . . 10.0 109.572 178.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 337' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 341' ' ' ASN . . . -69.83 -39.8 76.26 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.246 -0.65 . . . . 10.0 109.246 178.521 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 7.0 tp -62.37 -28.66 69.92 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.402 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -70.43 -44.53 67.68 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.844 -0.428 . . . . 10.0 109.844 178.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -71.52 -49.8 37.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.444 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 341' ' ' ASN . . . . . 0.41 ' HB2' ' O ' ' A' ' 337' ' ' ALA . 1.2 m-20 -61.3 -46.57 89.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.363 -0.835 . . . . 10.0 109.938 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -64.95 -44.25 94.79 Favored Glycine 0 N--CA 1.449 -0.5 0 N-CA-C 111.687 -0.565 . . . . 10.0 111.687 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.87 -43.59 97.87 Favored Glycine 0 C--N 1.332 0.309 0 N-CA-C 110.756 -0.938 . . . . 10.0 110.756 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -66.08 -45.01 82.8 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.281 -0.637 . . . . 10.0 109.281 178.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 345' ' ' ARG . . . . . 0.408 ' HE ' ' CD ' ' C' ' 433' ' ' GLU . 59.8 mtt180 -56.48 -48.46 77.1 Favored 'General case' 0 C--O 1.224 -0.257 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 81.9 mt -61.18 -39.73 91.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.979 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -66.63 -48.81 68.25 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.563 -0.532 . . . . 10.0 109.563 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -59.39 -46.83 87.58 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.898 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -62.42 -42.09 99.18 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.092 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 6.4 m80 -62.43 -43.93 97.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.747 0.308 . . . . 10.0 110.377 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.99 -45.16 94.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.932 0.396 . . . . 10.0 109.947 178.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 352' ' ' LYS . . . . . 0.888 ' HG2' HG13 ' C' ' 422' ' ' VAL . 11.0 mttp -67.75 -35.89 79.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.877 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.64 -35.88 81.23 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 52.2 m -61.34 -50.86 71.23 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.771 -0.825 . . . . 10.0 108.771 178.222 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -65.75 -28.14 68.82 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.669 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 356' ' ' HIS . . . . . 0.476 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 2.2 m80 -64.84 -40.2 94.79 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.249 -1.019 . . . . 10.0 108.249 177.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 83.0 mt -72.82 -41.43 64.91 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.413 -0.812 . . . . 10.0 109.573 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 4.9 m -56.01 -53.87 51.69 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.062 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 359' ' ' THR . . . . . 0.505 ' HA ' ' OE1' ' A' ' 362' ' ' GLU . 61.3 p -70.9 -19.65 62.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.004 -0.543 . . . . 10.0 110.789 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 360' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 356' ' ' HIS . 34.8 tp -68.43 -42.85 78.3 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.393 -0.595 . . . . 10.0 109.393 178.638 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.44 -30.32 70.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.271 0.558 . . . . 10.0 109.893 178.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 362' ' ' GLU . . . . . 0.505 ' OE1' ' HA ' ' A' ' 359' ' ' THR . 35.4 mt-10 -78.19 5.8 9.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.441 -0.799 . . . . 10.0 111.311 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.692 ' HD3' HG23 ' C' ' 411' ' ' THR . 27.0 mttp -131.1 -46.38 1.01 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.025 -0.534 . . . . 10.0 109.65 178.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.17 -11.69 61.07 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.964 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.503 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 90.7 mttt -108.79 -72.77 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.43 0 CA-C-O 119.336 -0.364 . . . . 10.0 111.97 178.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.503 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 31.5 Cg_endo -64.16 -51.32 2.2 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 121.553 1.502 . . . . 10.0 112.862 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 367' ' ' ALA . . . . . 0.512 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -61.98 -42.32 99.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 10.0 111.384 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 368' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 368' ' ' LEU . 9.3 mt -67.39 -36.82 82.08 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.99 -0.284 . . . . 10.0 110.874 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 369' ' ' GLU . . . . . 0.752 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 68.9 mt-10 -66.66 -35.34 79.93 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.905 -0.776 . . . . 10.0 108.905 177.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -63.94 -47.01 82.17 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.636 -0.876 . . . . 10.0 108.636 178.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 1.5 mt -59.76 -44.48 93.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.309 179.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.458 HH11 ' HD2' ' A' ' 372' ' ' ARG . 58.8 mtt180 -66.79 -42.34 86.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.045 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.752 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.6 mt-30 -60.96 -34.79 75.3 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.686 -0.688 . . . . 20.0 111.413 178.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -79.19 -35.32 30.5 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 109.583 -1.407 . . . . 10.0 109.583 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 18.8 mt -57.64 -35.49 70.56 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.667 0.247 . . . . 10.0 111.667 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 376' ' ' LEU . . . . . 0.566 ' HB2' ' HD3' ' A' ' 377' ' ' PRO . 22.0 mt -56.59 -65.83 1.46 Allowed Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 111.737 0.273 . . . . 10.0 111.737 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.566 ' HD3' ' HB2' ' A' ' 376' ' ' LEU . 30.1 Cg_endo -65.22 -33.95 47.23 Favored 'Trans proline' 0 C--N 1.357 1.012 0 C-N-CA 121.72 1.614 . . . . 10.0 111.828 179.118 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 19.2 t -62.68 -50.86 78.05 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 N-CA-C 110.429 -0.211 . . . . 10.0 110.429 179.521 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 56.0 mt -61.84 -35.99 79.87 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 380' ' ' GLU . . . . . 0.455 ' O ' HG23 ' A' ' 384' ' ' VAL . 45.2 mt-10 -62.99 -52.65 62.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.309 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.8 p -61.54 -36.71 81.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.736 0.303 . . . . 10.0 110.482 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -65.92 -43.52 87.87 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 178.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 79.7 mttt -67.04 -39.14 86.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.697 179.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 384' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 380' ' ' GLU . 54.1 t -60.72 -45.74 97.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 109.67 -0.493 . . . . 10.0 109.67 178.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.0 p -69.34 -41.98 75.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.446 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 386' ' ' PHE . . . . . 0.441 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 5.6 m-30 -63.03 -49.48 74.46 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.597 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 82.8 mt -58.82 -38.39 78.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.968 0.413 . . . . 10.0 111.017 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 14.7 m -72.73 -37.36 67.78 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.12 178.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -70.07 -34.5 73.27 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.931 0.396 . . . . 10.0 110.661 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 390' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 70.0 mt -58.87 -47.07 86.2 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.277 179.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 77.0 mt-10 -68.62 -29.67 68.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.195 0.522 . . . . 10.0 110.039 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.42 -36.92 83.88 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.699 179.134 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -68.26 -46.57 70.06 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.149 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.2 -30.27 70.97 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.288 -0.415 . . . . 10.0 111.96 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -72.47 -15.67 61.8 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.02 0.438 . . . . 10.0 110.946 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.98 -48.78 5.28 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.518 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 96.6 mt -86.85 59.74 5.82 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.675 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 . . . . . 0 N--CA 1.471 0.586 0 N-CA-C 112.632 0.604 . . . . 10.0 112.632 178.861 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 78.4 mt . . . . . 0 CA--C 1.518 -0.277 0 N-CA-C 109.876 -0.416 . . . . 10.0 109.876 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 400' ' ' LYS . . . . . 0.427 ' HG3' ' H ' ' C' ' 400' ' ' LYS . 1.6 mtmm -60.41 -38.08 82.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.886 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 401' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' C' ' 405' ' ' TRP . 57.4 mt -64.85 -40.75 95.65 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.379 -0.828 . . . . 10.0 111.152 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 98.4 mt -71.8 -40.4 69.21 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 120.862 0.363 . . . . 10.0 111.238 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.09 -46.62 77.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.448 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 404' ' ' ASN . . . . . 0.508 ' O ' HG23 ' C' ' 408' ' ' VAL . 1.0 OUTLIER -65.19 -38.29 90.03 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 179.262 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 405' ' ' TRP . . . . . 0.501 ' HB2' ' O ' ' C' ' 401' ' ' LEU . 1.7 t90 -61.1 -34.88 75.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.437 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -64.81 -45.53 85.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.132 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 1.6 m -61.71 -36.33 80.63 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.092 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 408' ' ' VAL . . . . . 0.508 HG23 ' O ' ' C' ' 404' ' ' ASN . 96.9 t -67.01 -37.75 79.99 Favored 'Isoleucine or valine' 0 C--O 1.231 0.107 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 178.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 38.6 m -62.93 -42.6 99.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.737 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 14.5 m -62.44 -30.64 71.38 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 411' ' ' THR . . . . . 0.692 HG23 ' HD3' ' A' ' 363' ' ' LYS . 47.1 m -66.81 -33.57 75.91 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.745 178.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -70.52 -38.47 74.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.13 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 2.0 m -63.15 -40.94 99.03 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 414' ' ' LYS . . . . . 0.721 ' HA ' ' HG3' ' C' ' 417' ' ' GLU . 36.9 mmtt -69.25 -31.85 70.67 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.033 179.048 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 46.1 tp -71.06 -37.92 72.51 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 416' ' ' ARG . . . . . 0.578 ' HA ' ' HB2' ' C' ' 419' ' ' LEU . 54.6 mtt180 -66.7 -23.32 66.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.631 -0.713 . . . . 10.0 111.03 179.225 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 417' ' ' GLU . . . . . 0.721 ' HG3' ' HA ' ' C' ' 414' ' ' LYS . 2.3 mt-10 -64.56 -36.08 83.07 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 108.243 -1.021 . . . . 10.0 108.243 177.524 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 418' ' ' GLN . . . . . 0.779 ' O ' ' HB ' ' C' ' 422' ' ' VAL . 18.4 mt-30 -81.66 -30.03 32.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.033 -0.985 . . . . 10.0 109.277 178.323 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 419' ' ' LEU . . . . . 0.578 ' HB2' ' HA ' ' C' ' 416' ' ' ARG . 71.6 mt -69.27 -11.62 60.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.318 179.494 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -97.89 -99.75 2.07 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.159 -0.543 . . . . 10.0 112.038 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -49.44 -43.67 37.6 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.789 2.993 . . . . 10.0 113.769 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 422' ' ' VAL . . . . . 0.888 HG13 ' HG2' ' A' ' 352' ' ' LYS . 55.1 t -59.66 -46.95 92.78 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-O 120.531 0.205 . . . . 10.0 111.085 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 5.0 m -65.97 -39.65 90.56 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.952 -0.388 . . . . 10.0 109.952 178.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -60.54 -45.72 92.82 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -64.3 -30.88 71.91 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.715 -0.675 . . . . 10.0 109.551 178.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -67.6 -38.17 83.6 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.885 -0.783 . . . . 10.0 108.885 178.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 427' ' ' TRP . . . . . 0.456 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 44.4 m95 -67.05 -41.66 86.13 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 108.178 -1.045 . . . . 10.0 108.178 177.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -60.56 -40.52 91.93 Favored 'General case' 0 C--N 1.333 -0.11 0 N-CA-C 108.349 -0.982 . . . . 10.0 108.349 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -63.95 -46.53 84.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.447 178.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 50.0 mt -61.69 -28.82 69.67 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.106 179.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 431' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 67.6 mm-40 -64.96 -46.43 81.55 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.612 -0.885 . . . . 10.0 108.612 177.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -62.64 -40.91 98.5 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 108.405 -0.961 . . . . 10.0 108.405 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 433' ' ' GLU . . . . . 0.408 ' CD ' ' HE ' ' A' ' 345' ' ' ARG . 10.3 mt-10 -60.08 -55.43 34.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.115 -0.948 . . . . 10.0 110.914 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 3.1 p -59.14 -38.3 79.36 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.967 0.358 . . . . 10.0 111.967 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -63.55 -50.6 68.88 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 110.03 -0.359 . . . . 10.0 110.03 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.8 -48.03 76.57 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.677 -0.773 . . . . 10.0 111.358 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 74.5 mt -57.74 -40.04 78.73 Favored 'General case' 0 C--O 1.22 -0.455 0 O-C-N 123.556 0.21 . . . . 10.0 110.986 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -66.47 -33.56 75.97 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.706 -0.398 . . . . 10.0 110.914 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -67.52 -41.38 84.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.839 -0.8 . . . . 10.0 108.839 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 440' ' ' GLU . . . . . 0.464 ' O ' ' HB2' ' C' ' 444' ' ' ASP . 28.0 mt-10 -69.84 -53.48 17.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.328 -0.851 . . . . 10.0 109.77 178.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 80.7 mmm -57.92 -41.04 81.84 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.977 0.732 . . . . 10.0 112.977 -178.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 442' ' ' SER . . . . . 0.482 ' O ' ' HG3' ' C' ' 446' ' ' GLU . 33.4 p -60.91 -49.91 75.56 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.643 -0.423 . . . . 10.0 110.003 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 8.1 tttt -67.71 -37.92 82.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.741 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 444' ' ' ASP . . . . . 0.495 ' CG ' HH21 ' A' ' 334' ' ' ARG . 0.4 OUTLIER -58.32 -51.52 69.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.285 178.951 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 85.2 mt -65.98 -37.33 85.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.917 -0.583 . . . . 10.0 111.119 179.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 446' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' C' ' 442' ' ' SER . 38.1 mt-10 -63.3 -47.13 83.58 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.108 -0.701 . . . . 10.0 109.108 178.43 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 447' ' ' GLU . . . . . 0.531 ' HB3' ' HE ' ' A' ' 330' ' ' ARG . 10.9 mm-40 -65.84 -36.0 82.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.594 -0.73 . . . . 10.0 109.308 178.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.38 -47.12 93.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.871 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 69.7 mttt -66.28 -30.44 70.86 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.962 0.411 . . . . 10.0 110.87 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -86.3 5.29 35.22 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.543 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 451' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 323' ' ' TYR . 37.8 mttp -124.93 -36.67 2.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.703 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.0 -44.52 99.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 110.29 -0.263 . . . . 10.0 110.29 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 453' ' ' GLN . . . . . 0.819 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 41.0 mt-30 -59.31 -58.84 16.49 Favored Pre-proline 0 CA--C 1.535 0.365 0 CA-C-N 116.541 -0.3 . . . . 10.0 111.014 179.147 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 454' ' ' PRO . . . . . 0.819 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 33.0 Cg_exo -60.65 -34.77 91.78 Favored 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 122.035 1.824 . . . . 10.0 112.013 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 455' ' ' TYR . . . . . 0.497 ' O ' ' HB2' ' C' ' 459' ' ' PHE . 16.9 t80 -67.17 -50.14 62.2 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.209 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 28.1 mt -64.8 -39.94 94.41 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 110.203 -0.295 . . . . 10.0 110.203 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.73 -47.03 88.11 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 458' ' ' ASP . . . . . 0.608 ' HA ' ' HD2' ' C' ' 461' ' ' LYS . 2.2 t70 -72.73 -34.15 66.89 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.445 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 459' ' ' PHE . . . . . 0.497 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 0.7 OUTLIER -70.64 -32.33 69.59 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 178.893 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -62.51 -34.47 76.96 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 178.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 461' ' ' LYS . . . . . 0.608 ' HD2' ' HA ' ' C' ' 458' ' ' ASP . 58.4 mttt -66.09 -43.39 87.47 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.542 -0.91 . . . . 10.0 108.542 177.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 462' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' C' ' 458' ' ' ASP . 37.7 mmtm -60.93 -45.46 94.59 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.448 -0.797 . . . . 10.0 108.975 178.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -60.68 -39.53 88.82 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.395 178.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -66.97 -49.09 66.49 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 110.095 -0.335 . . . . 10.0 110.095 178.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 1.26 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 49.0 mt-10 -57.09 -37.5 71.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.816 0.341 . . . . 10.0 110.163 179.206 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.25 -52.56 10.58 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.903 -0.59 . . . . 10.0 111.078 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 74.3 mmm -60.79 -49.0 79.24 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.615 0.245 . . . . 10.0 111.47 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -67.27 -37.28 83.22 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.679 -0.489 . . . . 10.0 109.679 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 1.26 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 96.5 mt -61.96 -44.47 96.68 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 115.803 -0.635 . . . . 20.0 109.513 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 470' ' ' TYR . . . . . 0.496 ' HA ' ' HB2' ' C' ' 473' ' ' LYS . 22.2 m-30 -70.85 -22.95 62.25 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.497 179.187 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 26.9 mtt180 -67.76 -33.85 75.66 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 108.801 -0.814 . . . . 10.0 108.801 178.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -93.04 10.09 32.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.324 -0.853 . . . . 10.0 109.905 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 473' ' ' LYS . . . . . 0.535 ' HG2' HD22 ' A' ' 301' ' ' LEU . 75.9 mttt -121.46 -67.3 0.98 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.755 179.688 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 61.8 t -55.77 -42.2 69.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.01 -0.541 . . . . 10.0 112.229 -178.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -59.93 -62.61 5.55 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 112.293 0.479 . . . . 10.0 112.293 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 476' ' ' PRO . . . . . 0.543 ' HB2' ' HE2' ' A' ' 297' ' ' LYS . 28.8 Cg_endo -64.19 -32.97 62.22 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 121.69 1.594 . . . . 10.0 111.424 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 477' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' C' ' 477' ' ' LEU . 23.6 mt -65.9 -42.72 89.86 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 120.993 -0.283 . . . . 10.0 110.25 178.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 478' ' ' ARG . . . . . 0.439 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 58.4 mtt180 -62.88 -38.22 90.02 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -66.13 -50.73 62.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.892 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.27 -39.48 94.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.785 0.326 . . . . 10.0 110.198 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 17.9 mt -65.57 -33.71 76.54 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 178.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 482' ' ' GLN . . . . . 0.439 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 4.5 tt0 -71.93 -38.91 69.78 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 178.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -64.64 -43.1 94.76 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.352 -0.981 . . . . 10.0 108.352 177.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -69.25 -33.44 73.44 Favored Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 110.826 -0.91 . . . . 10.0 110.826 178.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.77 -45.58 70.99 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 486' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' C' ' 486' ' ' ARG . 57.0 mtt180 -61.73 -36.68 81.67 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.215 -0.661 . . . . 10.0 109.215 178.652 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -65.74 -49.32 68.83 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 177.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -63.43 -37.09 85.95 Favored 'General case' 0 C--O 1.226 -0.159 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.276 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 489' ' ' LEU . . . . . 0.609 ' O ' ' HB2' ' C' ' 493' ' ' GLN . 60.4 mt -64.95 -32.33 74.0 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 178.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 6.3 m80 -73.87 -43.14 59.5 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.26 -1.015 . . . . 10.0 108.26 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 491' ' ' GLU . . . . . 0.436 ' O ' ' HE2' ' C' ' 495' ' ' LYS . 22.5 mt-10 -58.77 -44.1 90.55 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.289 -0.869 . . . . 10.0 109.2 178.566 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 90.1 mt -74.95 -39.95 61.06 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 115.431 -0.804 . . . . 10.0 111.703 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 493' ' ' GLN . . . . . 0.609 ' HB2' ' O ' ' C' ' 489' ' ' LEU . 2.5 tt0 -62.57 -44.48 96.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.792 0.33 . . . . 10.0 110.607 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -75.27 4.65 6.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.412 0.625 . . . . 10.0 110.844 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.543 ' O ' ' HB2' ' C' ' 499' ' ' LEU . 0.6 OUTLIER -114.39 -46.33 2.98 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.18 178.484 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 74.1 mt -63.8 -35.82 81.87 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.992 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 497' ' ' SER . . . . . 0.44 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 22.9 m -62.68 -59.8 11.67 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 120.67 -0.412 . . . . 10.0 111.253 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 498' ' ' PRO . . . . . 0.44 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 30.4 Cg_endo -65.85 -40.78 15.75 Favored 'Trans proline' 0 C--N 1.356 0.936 0 C-N-CA 121.629 1.552 . . . . 10.0 111.721 178.542 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 499' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 12.8 mt -66.81 -37.07 83.81 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 121.237 -0.185 . . . . 10.0 110.837 179.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.71 -45.56 92.42 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.06 -1.216 . . . . 10.0 110.06 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -62.69 -42.01 99.41 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.237 -0.653 . . . . 10.0 109.237 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 502' ' ' GLU . . . . . 0.512 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 19.6 tt0 -65.27 -47.67 75.88 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.293 -0.867 . . . . 10.0 109.74 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 503' ' ' MET . . . . . 0.513 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 77.1 mmm -60.98 -36.83 80.47 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.999 -0.371 . . . . 10.0 109.999 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 504' ' ' ARG . . . . . 0.428 ' O ' ' HG3' ' C' ' 508' ' ' ARG . 90.8 mtt180 -62.54 -48.0 81.44 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -65.8 -38.29 88.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.02 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.513 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 56.3 mtt180 -60.93 -47.99 83.87 Favored 'General case' 0 CA--C 1.522 -0.125 0 N-CA-C 108.291 -1.003 . . . . 10.0 108.291 177.46 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.95 -42.89 95.05 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.43 -0.805 . . . . 10.0 109.878 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 508' ' ' ARG . . . . . 0.652 ' O ' ' HB2' ' C' ' 512' ' ' ASP . 57.1 mtt180 -59.65 -51.05 71.46 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 109.612 -0.514 . . . . 10.0 109.612 178.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 509' ' ' ALA . . . . . 0.767 ' HB1' ' HE3' ' A' ' 264' ' ' LYS . . . -59.57 -38.38 80.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.157 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 510' ' ' HIS . . . . . 0.404 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 11.2 m170 -71.27 -56.94 5.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.566 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 511' ' ' VAL . . . . . 0.417 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 75.9 t -61.46 -39.27 82.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.941 -179.288 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.652 ' HB2' ' O ' ' C' ' 508' ' ' ARG . 0.4 OUTLIER -61.75 -41.96 98.35 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.342 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.9 -36.46 82.31 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.968 -0.752 . . . . 10.0 108.968 178.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 514' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 93.1 mt -67.39 -37.78 83.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.258 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 515' ' ' ARG . . . . . 0.52 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 83.9 mtt180 -58.43 -56.01 27.63 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.16 0.505 . . . . 10.0 110.256 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.75 22.74 0.46 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.6 0.593 . . . . 10.0 112.6 -179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 517' ' ' HIS . . . . . 0.494 ' CG ' ' HE1' ' A' ' 257' ' ' TYR . 14.7 m80 -138.95 -43.48 0.47 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 121.87 -0.518 . . . . 10.0 111.562 179.389 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 86.0 mt -73.79 -38.43 64.63 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 519' ' ' ALA . . . . . 0.402 ' N ' ' HD2' ' C' ' 520' ' ' PRO . . . -61.79 -56.39 32.89 Favored Pre-proline 0 CA--C 1.535 0.397 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.373 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 520' ' ' PRO . . . . . 0.402 ' HD2' ' N ' ' C' ' 519' ' ' ALA . 18.1 Cg_endo -62.0 -38.08 60.2 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 121.549 1.499 . . . . 10.0 111.607 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 521' ' ' TYR . . . . . 0.4 ' O ' ' HB2' ' C' ' 524' ' ' GLU . 8.7 t80 -68.24 -39.28 82.33 Favored 'General case' 0 C--N 1.334 -0.091 0 C-N-CA 120.677 -0.409 . . . . 10.0 111.69 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 522' ' ' SER . . . . . 0.452 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 10.2 p -66.36 -34.28 77.62 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 109.119 -0.697 . . . . 10.0 109.119 178.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -68.73 -36.6 78.6 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 177.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 524' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' C' ' 521' ' ' TYR . 47.4 mt-10 -62.79 -44.78 95.29 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 107.64 -1.244 . . . . 10.0 107.64 176.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 93.5 mt -61.89 -43.8 98.1 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 114.962 -1.017 . . . . 10.0 109.69 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 526' ' ' ARG . . . . . 0.452 ' HG3' ' O ' ' C' ' 522' ' ' SER . 66.2 mtt180 -56.98 -45.66 82.76 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.991 -0.374 . . . . 10.0 109.991 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -62.72 -49.39 75.24 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.169 -0.469 . . . . 10.0 111.043 179.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 528' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' C' ' 528' ' ' ARG . 52.9 mtt85 -66.32 -42.4 88.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.162 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 67.2 mt -66.16 -33.48 75.87 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.416 -0.356 . . . . 10.0 110.25 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 530' ' ' ALA . . . . . 0.413 ' O ' ' HG3' ' C' ' 534' ' ' GLU . . . -64.84 -42.82 94.61 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.885 -0.784 . . . . 10.0 108.885 178.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 531' ' ' ALA . . . . . 0.404 ' O ' ' HB2' ' C' ' 534' ' ' GLU . . . -67.67 -40.69 84.43 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.621 178.591 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 532' ' ' ARG . . . . . 0.423 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 24.2 ttm180 -64.38 -42.32 96.22 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 34.8 mt -64.47 -36.95 85.84 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.959 -0.564 . . . . 10.0 109.566 178.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 534' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' C' ' 530' ' ' ALA . 25.1 mt-10 -58.41 -47.82 82.67 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.713 -0.847 . . . . 10.0 108.713 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.18 -37.99 89.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.557 -0.747 . . . . 10.0 109.769 178.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 536' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 76.7 mt -68.29 -27.03 65.96 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.627 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -81.65 -40.27 23.15 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -68.83 -53.45 21.4 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.517 -0.549 . . . . 10.0 109.517 178.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -66.94 -40.56 87.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.562 179.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 540' ' ' GLY . . . . . 0.433 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -63.46 -45.85 93.91 Favored Glycine 0 C--O 1.226 -0.348 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.989 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -61.33 -40.35 98.5 Favored Glycine 0 N--CA 1.449 -0.441 0 N-CA-C 110.754 -0.938 . . . . 10.0 110.754 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -66.19 -44.65 83.34 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 178.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 69.9 mtt180 -61.46 -39.5 91.07 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.747 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 544' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 62.6 mt -61.35 -41.8 97.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.717 0.294 . . . . 10.0 110.569 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -70.58 -38.78 74.09 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.4 -0.593 . . . . 10.0 109.4 178.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -63.22 -49.22 75.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.257 -0.883 . . . . 10.0 109.709 178.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -59.14 -42.52 90.85 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 115.694 -0.684 . . . . 10.0 109.913 178.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.3 m170 -60.83 -48.68 80.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.962 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -62.56 -47.82 82.19 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.864 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.65 -31.66 72.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.138 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 551' ' ' ALA . . . . . 0.503 ' O ' ' HG ' ' C' ' 555' ' ' LEU . . . -66.26 -49.98 65.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.251 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.23 -35.24 75.0 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.937 0.399 . . . . 10.0 110.507 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -69.09 -31.46 70.19 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.479 179.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 62.1 m170 -82.74 -26.02 32.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.518 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 555' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' C' ' 551' ' ' ALA . 82.2 mt -64.48 -35.38 80.74 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.636 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.88 -42.57 94.71 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.937 -0.764 . . . . 10.0 108.937 178.432 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.75 -38.39 88.97 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.647 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 51.8 mt -66.32 -34.64 78.45 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 178.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 70.9 m -66.23 -31.4 72.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.582 178.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 560' ' ' GLU . . . . . 0.424 ' O ' ' HD2' ' C' ' 564' ' ' PRO . 3.1 mm-40 -64.63 -25.21 67.86 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 121.515 0.674 . . . . 10.0 109.518 178.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 561' ' ' LYS . . . . . 0.747 ' HA ' ' HB3' ' C' ' 565' ' ' ALA . 0.0 OUTLIER -98.64 -27.36 14.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.532 179.324 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -79.47 -27.2 41.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 10.0 112.087 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 563' ' ' LYS . . . . . 0.953 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 89.1 mttt -105.88 -73.87 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 564' ' ' PRO . . . . . 0.953 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 32.4 Cg_exo -60.3 -52.49 3.99 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.279 1.986 . . . . 10.0 112.876 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 565' ' ' ALA . . . . . 0.747 ' HB3' ' HA ' ' C' ' 561' ' ' LYS . . . -63.15 -45.58 91.22 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.672 0.619 . . . . 10.0 112.672 -179.406 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 566' ' ' LEU . . . . . 0.508 HD23 HD12 ' C' ' 569' ' ' LEU . 12.0 mt -62.57 -36.6 83.19 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.85 -0.34 . . . . 10.0 111.061 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 567' ' ' GLU . . . . . 1.162 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 53.3 tt0 -67.9 -36.14 79.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.974 -0.75 . . . . 10.0 108.974 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -68.57 -44.4 74.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.487 -0.778 . . . . 10.0 109.323 178.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 569' ' ' LEU . . . . . 0.508 HD12 HD23 ' C' ' 566' ' ' LEU . 77.5 mt -61.42 -46.29 90.74 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.534 179.228 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 570' ' ' ARG . . . . . 0.559 ' HA ' ' HB2' ' C' ' 573' ' ' LEU . 45.5 mtt180 -71.09 -29.35 65.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.92 0.391 . . . . 10.0 110.391 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 571' ' ' GLN . . . . . 1.162 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 99.0 mt-30 -65.3 -29.69 70.48 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.667 -0.697 . . . . 20.0 109.98 178.107 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -90.15 -27.0 22.3 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 109.519 -1.432 . . . . 10.0 109.519 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 573' ' ' LEU . . . . . 0.559 ' HB2' ' HA ' ' C' ' 570' ' ' ARG . 14.5 mt -59.12 -43.08 91.92 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.56 0.207 . . . . 10.0 111.56 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 93.8 mt -55.57 -61.04 6.86 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 112.126 0.417 . . . . 10.0 112.126 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -58.85 -35.98 97.72 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 122.092 1.861 . . . . 10.0 111.737 178.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 18.0 t -65.41 -45.21 93.74 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 110.052 -0.351 . . . . 10.0 110.052 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 63.2 mt -63.13 -38.7 92.2 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 578' ' ' GLU . . . . . 0.412 ' O ' HG23 ' C' ' 582' ' ' VAL . 54.8 mt-10 -65.17 -49.32 70.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.887 178.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 2.8 p -62.5 -41.39 98.79 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.025 0.44 . . . . 10.0 110.175 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -64.71 -41.02 96.3 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.805 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -61.33 -47.16 87.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.12 178.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 582' ' ' VAL . . . . . 0.412 HG23 ' O ' ' C' ' 578' ' ' GLU . 84.1 t -60.43 -42.24 90.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.869 -0.419 . . . . 10.0 109.869 179.077 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 20.0 m -64.29 -44.27 92.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.319 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 584' ' ' PHE . . . . . 0.445 ' O ' ' HG ' ' C' ' 588' ' ' LEU . 8.2 m-85 -66.06 -46.64 77.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.842 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 29.5 mt -55.65 -48.48 74.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.803 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 586' ' ' SER . . . . . 0.423 ' O ' ' HG3' ' C' ' 590' ' ' GLU . 5.1 m -66.56 -42.14 87.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.175 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -61.65 -42.51 99.01 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.287 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 588' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' C' ' 584' ' ' PHE . 84.7 mt -59.09 -40.82 86.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.06 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 589' ' ' GLU . . . . . 0.449 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 15.8 mt-10 -66.62 -38.4 86.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.961 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 590' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' C' ' 586' ' ' SER . 51.8 mt-10 -72.6 -40.46 66.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.084 0.469 . . . . 10.0 110.853 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 8.4 m-30 -66.25 -44.93 82.3 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.962 -0.563 . . . . 10.0 112.172 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 2.7 p -59.5 -33.48 71.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.81 0.338 . . . . 10.0 111.699 -179.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 593' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 86.8 mttt -69.0 -20.23 64.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.194 0.521 . . . . 10.0 111.349 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.13 -2.93 51.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.891 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 81.9 mt -119.79 16.59 12.7 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.12 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 64.6 t30 . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.616 -0.707 . . . . 10.0 109.664 179.811 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.6 ttt . . . . . 0 C--O 1.233 0.234 0 CA-C-O 121.064 0.459 . . . . 10.0 110.321 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.36 132.54 47.24 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.628 -0.715 . . . . 10.0 111.446 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.552 ' OE2' ' H42' ' A' ' 23' ' ' PCW . 0.7 OUTLIER -96.22 124.14 40.11 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.458 -0.571 . . . . 10.0 109.458 178.993 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -114.76 120.97 41.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.785 0.326 . . . . 10.0 110.452 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.557 ' HG2' ' H62' ' A' ' 23' ' ' PCW . 23.9 mtmm -91.01 111.05 22.34 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.248 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.462 HD22 HD23 ' B' ' 159' ' ' LEU . 15.0 mt -107.75 119.62 39.95 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.478 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 55.4 t -103.44 124.25 57.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 120.914 0.388 . . . . 10.0 110.632 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 22.9 t -98.8 112.53 31.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.564 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 22.9 m -109.41 161.6 7.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.789 0.328 . . . . 10.0 111.075 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 156.95 -179.67 32.57 Favored Glycine 0 N--CA 1.446 -0.661 0 N-CA-C 111.22 -0.752 . . . . 10.0 111.22 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -83.66 173.87 11.0 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.957 0.408 . . . . 10.0 111.11 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -84.6 118.07 4.64 Favored Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 120.597 -0.811 . . . . 10.0 112.016 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 110.96 -1.94 28.61 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.419 -0.896 . . . . 10.0 112.959 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 27.8 m -73.05 -38.69 56.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 111.996 0.369 . . . . 10.0 111.996 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 113.9 33.72 1.8 Allowed Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.383 -0.913 . . . . 10.0 113.264 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.403 ' HB2' ' HE3' ' B' ' 16' ' ' LYS . 38.5 mtmt -62.28 -58.79 6.41 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.835 0.35 . . . . 10.0 111.119 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 17' ' ' SER . . . . . 0.409 ' O ' HG13 ' B' ' 21' ' ' ILE . 0.8 OUTLIER -57.89 -33.22 68.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.519 -0.764 . . . . 10.0 111.616 -179.537 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.54 -41.45 94.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.955 0.407 . . . . 10.0 110.273 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 91.5 mt -67.4 -39.23 85.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.012 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 2.1 m -64.42 -49.28 72.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.879 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' ILE . . . . . 0.409 HG13 ' O ' ' B' ' 17' ' ' SER . 68.8 mt -64.08 -31.11 52.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.107 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.606 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 9.2 tp-100 -68.92 -30.56 69.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.661 0.267 . . . . 10.0 110.906 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.2 tp -87.6 -35.36 18.12 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.182 0.515 . . . . 10.0 111.088 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 43.7 mm -80.83 -55.57 8.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 112.548 0.573 . . . . 10.0 112.548 -178.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' GLN . . . . . 0.434 ' OE1' ' HA ' ' D' ' 840' ' ' VAL . 15.3 mt-30 -96.98 -15.58 21.03 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.735 0.642 . . . . 10.0 112.735 -178.161 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.606 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 86.2 m-20 65.58 29.73 10.88 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.71 0.767 . . . . 10.0 109.208 -178.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -128.76 138.09 51.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.858 -1.064 . . . . 10.0 109.479 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -94.61 139.17 31.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.301 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 m -103.39 114.16 42.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.057 -0.519 . . . . 10.0 110.752 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -91.55 6.82 44.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.343 0.592 . . . . 10.0 109.782 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -94.72 158.73 15.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.306 -0.861 . . . . 10.0 110.207 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.567 ' HA ' H5'1 ' B' ' 201' ' ' GNP . 2.2 t80 -105.43 79.96 1.52 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.0 0.428 . . . . 10.0 110.054 179.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 33' ' ' ASP . . . . . 0.483 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 1.6 t0 -98.64 130.81 27.08 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.383 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 34' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 17.4 Cg_exo -69.16 -172.84 0.55 Allowed 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.196 2.598 . . . . 10.0 112.286 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -169.94 143.48 2.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.389 -0.369 . . . . 10.0 111.121 -179.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.584 ' HB ' ' HB ' ' D' ' 821' ' ' VAL . 11.5 mt -115.99 -62.58 2.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 108.458 -0.942 . . . . 10.0 108.458 178.368 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.472 ' O ' HG23 ' D' ' 821' ' ' VAL . 2.5 tt0 -154.74 92.5 1.48 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.298 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 38' ' ' ASP . . . . . 0.624 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 61.1 m-20 -109.21 160.05 16.42 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.187 179.675 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.6 p -148.24 138.3 22.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 112.274 0.472 . . . . 10.0 112.274 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 40' ' ' TYR . . . . . 0.604 ' CE2' HG22 ' D' ' 840' ' ' VAL . 1.5 m-85 -128.55 151.5 49.38 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.847 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 41' ' ' ARG . . . . . 0.616 ' NH1' ' HB2' ' D' ' 817' ' ' LYS . 5.1 ttp180 -137.25 126.46 24.64 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.521 0.2 . . . . 10.0 110.634 -178.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 8.6 tttm -151.06 141.03 22.02 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.369 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -88.94 135.14 33.7 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.14 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 21.7 m -137.54 167.21 23.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.852 0.358 . . . . 10.0 111.227 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 58.9 t -115.48 114.41 46.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.669 -0.696 . . . . 10.0 109.744 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 46.1 mt -127.27 121.0 56.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.337 -179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 66.25 21.88 10.99 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.432 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.51 -20.39 50.88 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 121.033 -0.604 . . . . 10.0 112.45 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -88.46 150.43 23.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.997 0.427 . . . . 10.0 110.907 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 9.8 t -103.58 137.5 41.57 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 108.505 -0.924 . . . . 10.0 108.505 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 3.6 p -147.84 153.24 38.89 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.954 0.407 . . . . 10.0 111.529 -178.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 26.5 tp -100.93 117.03 34.18 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.619 -0.882 . . . . 10.0 108.619 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.553 ' O ' ' HA ' ' B' ' 41' ' ' ARG . 46.7 mt -92.43 120.52 33.0 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.464 0.542 . . . . 10.0 112.464 -178.771 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.54 ' OD2' ' H71' ' A' ' 23' ' ' PCW . 5.0 t70 -104.77 90.75 3.58 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 106.992 -1.484 . . . . 10.0 106.992 177.638 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 13.5 mt -84.9 134.56 26.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.729 -0.669 . . . . 10.0 112.055 -177.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.493 HD12 ' O ' ' B' ' 38' ' ' ASP . 63.7 tp -112.36 111.12 21.76 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.582 -0.735 . . . . 10.0 111.348 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.624 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 6.5 t70 -89.95 91.04 8.42 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.34 -0.985 . . . . 10.0 108.34 178.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 81.7 p -78.36 171.7 14.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.87 -178.122 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.04 158.71 27.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.692 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -82.86 -47.83 5.72 Favored Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 110.573 -1.011 . . . . 10.0 110.573 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -127.31 118.99 25.26 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.28 -0.637 . . . . 20.0 109.28 178.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.417 ' OE2' ' HB2' ' B' ' 68' ' ' ARG . 8.9 tt0 -137.71 166.95 22.7 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.502 -179.035 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -115.59 -160.49 0.75 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.053 -0.521 . . . . 10.0 109.969 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 64' ' ' TYR . . . . . 0.403 ' CZ ' ' H72' ' A' ' 8' ' ' PCW . 26.9 t80 -71.38 104.56 3.23 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.75 -0.463 . . . . 10.0 109.75 178.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 68.4 m -136.99 135.49 37.68 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.974 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 66' ' ' ALA . . . . . 0.44 ' HB2' ' H61' ' A' ' 8' ' ' PCW . . . -65.96 -33.55 76.08 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.543 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 63.6 mmm -61.65 -41.52 97.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 10.0 109.984 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.467 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 58.9 ttt85 -64.18 -45.77 86.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.604 -0.726 . . . . 10.0 110.797 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.448 ' OD1' HG12 ' B' ' 103' ' ' VAL . 2.6 t0 -62.05 -38.38 88.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.194 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.649 ' HB2' ' H73' ' A' ' 27' ' ' PCW . 18.7 tp60 -69.02 -47.4 65.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.626 -0.716 . . . . 10.0 112.099 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 71' ' ' TYR . . . . . 0.467 ' CE2' ' HA ' ' B' ' 68' ' ' ARG 0.292 0.2 OUTLIER -69.01 -23.18 64.06 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 114.14 1.163 . . . . 10.0 114.14 -178.722 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' B' B ' 72' ' ' MET . . . . . 0.597 ' HB3' HG21 ' B' ' 103' ' ' VAL . 55.4 mtm -87.42 -25.67 23.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.198 0.523 . . . . 10.0 110.3 178.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 73' ' ' ARG . . . . . 0.637 HH21 ' HA ' ' B' ' 103' ' ' VAL . 15.4 ttm180 -67.34 -28.7 68.19 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.914 -0.584 . . . . 10.0 111.363 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -89.63 -1.45 58.02 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.346 0.499 . . . . 10.0 112.346 -179.092 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.27 149.66 34.27 Favored Glycine 0 C--O 1.237 0.305 0 C-N-CA 120.647 -0.787 . . . . 10.0 113.102 -179.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -102.99 -55.35 2.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.061 0.457 . . . . 10.0 109.873 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 77' ' ' GLY . . . . . 0.428 ' HA3' HD11 ' B' ' 163' ' ' ILE . . . -115.01 142.77 17.83 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 110.992 -0.843 . . . . 10.0 110.992 179.433 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 73.8 m-85 -122.35 126.34 47.83 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.121 0.486 . . . . 10.0 112.155 -178.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.889 ' HG ' HD22 ' B' ' 159' ' ' LEU . 56.5 mt -98.79 117.59 33.61 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.864 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 9.6 m -91.21 91.57 8.27 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 50.0 t -90.01 119.96 38.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.08 0.467 . . . . 10.0 112.167 -178.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.767 ' HB3' HD11 ' B' ' 93' ' ' ILE . 15.2 p90 -132.12 140.06 48.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.021 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -82.77 128.03 34.0 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.829 -0.434 . . . . 10.0 109.829 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 84' ' ' ILE . . . . . 0.817 HD11 ' HA ' ' B' ' 118' ' ' CYS . 43.1 pt -72.25 -5.9 6.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 112.083 0.401 . . . . 10.0 112.083 -179.149 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 85' ' ' ASN . . . . . 0.404 ' OD1' ' HD2' ' B' ' 117' ' ' LYS . 2.0 p-10 -98.45 1.14 46.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.942 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -129.23 119.45 24.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.635 -0.712 . . . . 10.0 110.335 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.67 -38.11 76.94 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 -178.585 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 52.3 tttp -59.73 -39.12 83.67 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.906 0.384 . . . . 10.0 111.062 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 49.2 m -59.42 -38.18 79.99 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.701 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -68.62 -36.71 79.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.116 0.484 . . . . 10.0 111.115 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -79.82 -30.72 40.54 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.683 -179.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.36 -16.28 63.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.19 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 93' ' ' ILE . . . . . 0.767 HD11 ' HB3' ' B' ' 82' ' ' PHE . 38.7 mm -56.74 -42.29 76.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.677 179.209 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -66.6 -36.99 83.94 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.912 0.387 . . . . 10.0 110.223 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -62.82 -39.36 94.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.042 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -78.96 -34.09 44.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.385 -0.371 . . . . 10.0 111.061 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -57.68 -50.01 74.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.314 179.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 98' ' ' GLU . . . . . 0.51 ' HA ' ' HD3' ' B' ' 101' ' ' LYS . 33.9 mm-40 -68.2 -32.44 72.66 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.993 -0.548 . . . . 10.0 111.026 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -63.38 -47.43 82.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.002 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 100' ' ' ILE . . . . . 0.574 ' HA ' HG22 ' B' ' 103' ' ' VAL . 55.3 mt -63.13 -35.8 73.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.29 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 101' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' B' ' 98' ' ' GLU . 49.7 mtpt -62.62 -31.4 72.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.513 179.106 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.01 -20.06 33.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.85 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.637 ' HA ' HH21 ' B' ' 73' ' ' ARG . 15.0 m -87.99 -33.72 6.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.599 -0.441 . . . . 10.0 111.586 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -95.95 -15.84 22.1 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.473 179.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 105' ' ' ASP . . . . . 0.487 ' OD2' ' H72' ' A' ' 30' ' ' PCW . 5.0 m-20 63.12 48.11 3.89 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.454 -0.794 . . . . 10.0 112.054 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 9.2 t -166.68 164.88 16.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.659 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -101.58 -20.21 15.15 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -91.91 77.15 5.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.626 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.472 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 39.6 t -123.43 132.83 24.28 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.26 -179.491 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 110' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 21.5 Cg_exo -65.71 106.97 0.98 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.852 2.368 . . . . 10.0 111.881 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 111' ' ' MET . . . . . 0.461 ' HB2' HG21 ' B' ' 139' ' ' ILE . 61.4 mtt -127.81 152.34 47.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.862 -0.608 . . . . 10.0 109.891 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 112' ' ' VAL . . . . . 0.572 ' HB ' HD23 ' B' ' 79' ' ' LEU . 88.6 t -135.67 127.99 46.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.744 -0.465 . . . . 10.0 109.744 179.229 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 18.7 tp -80.43 114.52 19.38 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 45.3 t -111.15 110.23 31.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.518 -178.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -86.35 128.89 9.1 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 109.335 -1.506 . . . . 10.0 109.335 178.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -114.89 155.94 25.92 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 117.42 0.61 . . . . 10.0 112.372 -178.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 117' ' ' LYS . . . . . 0.423 ' HB3' HD12 ' B' ' 120' ' ' LEU . 80.3 mttt 71.99 46.05 0.37 Allowed 'General case' 0 N--CA 1.462 0.146 0 O-C-N 124.174 0.921 . . . . 10.0 112.65 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 118' ' ' CYS . . . . . 0.817 ' HA ' HD11 ' B' ' 84' ' ' ILE . 26.3 p -79.0 -15.31 58.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.032 0.444 . . . . 10.0 110.642 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -86.22 1.29 51.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.165 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.423 HD12 ' HB3' ' B' ' 117' ' ' LYS . 24.4 mt -100.27 137.09 19.93 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.568 179.317 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.92 -3.16 13.5 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.914 2.409 . . . . 10.0 112.326 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 13.2 t -85.51 26.47 0.93 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.923 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 -64.52 107.0 1.26 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.052 0.453 . . . . 10.0 111.927 -179.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 2.8 m -97.25 -34.47 11.08 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.762 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 46.5 t -87.41 119.24 34.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.894 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 126' ' ' ASP . . . . . 0.656 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 27.8 t70 -72.78 153.8 40.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.521 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.25 -41.88 85.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.858 -0.61 . . . . 10.0 112.152 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -69.64 -38.03 77.0 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.308 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 129' ' ' GLN . . . . . 0.656 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 75.9 mt-30 -55.39 -45.38 76.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.179 0.514 . . . . 10.0 110.517 179.431 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.97 -41.96 77.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.458 -0.792 . . . . 10.0 110.929 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -60.43 -40.68 91.95 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.959 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -62.5 -45.5 92.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.9 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 32.3 tp -62.85 -45.86 90.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.873 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.67 -45.97 90.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.968 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -61.05 -31.8 71.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.516 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 32.3 m -70.8 -29.81 66.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.459 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -93.5 -6.78 46.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.797 0.332 . . . . 10.0 110.879 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 75.09 29.72 60.13 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.976 -0.631 . . . . 10.0 111.843 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 139' ' ' ILE . . . . . 0.461 HG21 ' HB2' ' B' ' 111' ' ' MET . 49.0 pt -122.02 154.82 61.44 Favored Pre-proline 0 C--N 1.329 -0.306 0 N-CA-C 110.55 -0.167 . . . . 10.0 110.55 -179.427 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -80.51 150.96 19.57 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.922 2.415 . . . . 10.0 112.268 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -113.14 121.51 44.74 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.502 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 11.9 mm -118.12 117.9 56.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.54 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -82.9 123.76 29.7 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.023 -1.103 . . . . 10.0 108.023 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 144' ' ' THR . . . . . 0.537 ' HA ' ' O ' ' B' ' 150' ' ' GLN . 76.3 p -135.89 172.66 12.69 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 113.568 0.951 . . . . 10.0 113.568 -177.419 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -163.8 121.41 1.81 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 113.953 -1.476 . . . . 10.0 107.635 178.142 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -72.61 -25.63 61.38 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.317 0.488 . . . . 10.0 112.317 -178.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 22.5 tttt -66.26 -47.96 72.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.848 0.356 . . . . 10.0 111.6 -179.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.1 0.82 41.45 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.2 -0.455 . . . . 10.0 111.522 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 18.3 ttt85 54.5 47.81 21.92 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.18 -179.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 150' ' ' GLN . . . . . 0.537 ' O ' ' HA ' ' B' ' 144' ' ' THR . 32.8 tt0 -90.05 111.85 23.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.609 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 66.94 10.19 55.31 Favored Glycine 0 CA--C 1.519 0.286 0 N-CA-C 114.594 0.598 . . . . 10.0 114.594 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 90.6 t -59.68 -49.15 84.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 117.046 0.423 . . . . 10.0 111.119 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -63.75 -45.01 91.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.301 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -61.64 -38.35 87.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.863 -0.608 . . . . 10.0 112.055 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.92 -50.63 72.69 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.838 0.352 . . . . 10.0 110.915 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -65.81 -41.52 91.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.816 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 157' ' ' TYR . . . . . 0.407 ' O ' ' HG3' ' B' ' 161' ' ' ARG . 13.5 m-30 -63.01 -41.67 99.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.682 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 98.8 m -57.89 -41.5 82.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.798 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.889 HD22 ' HG ' ' B' ' 79' ' ' LEU . 30.3 tp -58.06 -50.75 72.38 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.212 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 39.3 t -62.73 -38.88 82.84 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.458 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 161' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' B' ' 161' ' ' ARG . 43.7 mtm-85 -61.76 -34.36 75.71 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.495 179.054 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -76.42 -37.13 57.52 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.194 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 163' ' ' ILE . . . . . 0.529 HG13 ' O ' ' B' ' 159' ' ' LEU . 78.5 mt -64.01 -44.5 97.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.849 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 29.0 ttm180 -59.53 -52.19 66.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.761 0.315 . . . . 10.0 110.646 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -61.19 -33.52 73.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.156 0.503 . . . . 10.0 110.244 179.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -65.09 -39.43 93.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.591 -0.731 . . . . 10.0 111.042 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 167' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' B' ' 163' ' ' ILE . 67.7 mttt -70.48 -42.64 71.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.455 -0.338 . . . . 10.0 110.464 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -71.56 -15.46 62.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.265 0.555 . . . . 10.0 110.145 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -80.5 -39.2 28.39 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.957 -0.757 . . . . 10.0 108.957 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 170' ' ' MET . . . . . 0.451 ' O ' ' H71' ' A' ' 26' ' ' PCW . 17.0 mmt -67.99 -30.5 69.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.454 -0.794 . . . . 10.0 111.781 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 12.9 m -70.92 -13.18 61.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.782 0.325 . . . . 10.0 111.322 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 54.1 mttp -99.22 -2.4 36.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.83 0.348 . . . . 10.0 110.7 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 173' ' ' ASP . . . . . 0.532 ' OD1' ' H81' ' A' ' 1' ' ' PCW . 23.3 t70 -87.86 151.34 22.92 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.272 -179.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . -178.6 -139.29 3.45 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.183 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 175' ' ' LYS . . . . . 0.435 ' NZ ' ' HN1' ' A' ' 35' ' ' 17F . 1.6 ttpm? -79.31 81.12 5.62 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.901 0.381 . . . . 10.0 110.86 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 56.1 tptt -146.96 113.15 5.86 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.835 -0.432 . . . . 10.0 109.835 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 177' ' ' LYS . . . . . 0.516 ' HZ3' ' HN1' ' A' ' 38' ' ' 17F . 61.8 tttt -121.53 125.84 47.77 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.11 0.481 . . . . 10.0 110.572 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 4.6 tptp -86.84 -17.72 32.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.835 -0.621 . . . . 10.0 111.406 -179.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -123.75 105.49 9.72 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.108 0.48 . . . . 10.0 111.632 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 19.4 ttmm -96.64 94.04 7.09 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 1.3 m -132.0 102.43 5.82 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.765 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -87.21 38.49 0.82 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.374 0.607 . . . . 10.0 110.259 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 7.5 t -160.1 147.98 16.68 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.771 -0.649 . . . . 10.0 109.86 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -117.25 38.09 3.66 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.209 0.528 . . . . 10.0 110.254 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 7.1 m . . . . . 0 C--N 1.321 -0.631 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.176 -179.552 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.266 0 N-CA-C 111.79 -0.524 . . . . 10.0 111.79 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 809' ' ' THR . . . . . 0.422 HG21 HD11 ' B' ' 36' ' ' ILE . 36.1 p -121.42 118.08 28.49 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.359 -0.238 . . . . 10.0 110.359 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 3.5 t -101.69 134.23 42.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.036 0.446 . . . . 10.0 111.209 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 38.3 mtpt -83.35 114.54 21.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.653 -0.703 . . . . 10.0 110.326 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 44.4 t -100.88 122.61 53.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 813' ' ' TYR . . . . . 0.495 ' HB2' ' HA ' ' D' ' 876' ' ' ILE . 77.4 m-85 -89.86 137.76 32.06 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.462 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 814' ' ' LEU . . . . . 0.652 HD13 ' HD2' ' D' ' 841' ' ' ARG . 19.4 mt -109.35 147.92 37.0 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 115.647 -0.706 . . . . 10.0 110.782 -178.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 815' ' ' PRO . . . . . 0.484 ' HB3' ' HA ' ' D' ' 878' ' ' GLU . 65.2 Cg_endo -73.93 56.76 3.69 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.322 2.681 . . . . 10.0 111.79 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 816' ' ' ASN . . . . . 0.593 ' OD1' ' HB3' ' B' ' 41' ' ' ARG . 0.7 OUTLIER -163.47 33.48 0.09 Allowed 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 107.975 -1.12 . . . . 10.0 107.975 -179.535 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' D' D ' 817' ' ' LYS . . . . . 0.616 ' HB2' ' NH1' ' B' ' 41' ' ' ARG . 31.3 mtpt 52.51 39.79 28.57 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 114.357 -1.292 . . . . 10.0 111.66 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -139.18 -173.94 3.73 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 113.23 0.826 . . . . 10.0 113.23 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.51 172.02 17.81 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.678 -0.692 . . . . 10.0 112.218 -177.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 12.1 t -150.99 139.26 20.28 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.346 -1.353 . . . . 10.0 107.346 177.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 821' ' ' VAL . . . . . 0.584 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 2.3 t -110.03 107.53 23.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 120.331 -0.548 . . . . 10.0 111.295 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 10.6 t -109.49 143.59 19.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.01 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.57 136.37 39.26 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.521 -0.309 . . . . 10.0 110.73 179.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 59.1 t -89.02 127.45 41.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.917 0.389 . . . . 10.0 110.418 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 825' ' ' ARG . . . . . 0.443 ' HB2' ' SD ' ' D' ' 828' ' ' MET . 51.3 mtp180 -131.01 155.23 47.2 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.77 154.13 36.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.007 0.432 . . . . 10.0 110.883 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 95.49 -55.59 1.71 Allowed Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.817 -0.706 . . . . 10.0 113.071 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 828' ' ' MET . . . . . 0.443 ' SD ' ' HB2' ' D' ' 825' ' ' ARG . 10.2 ptm -64.67 147.73 52.42 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.406 0.622 . . . . 10.0 112.483 -179.1 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 829' ' ' SER . . . . . 0.661 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.1 OUTLIER -100.05 177.88 4.96 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.429 -0.805 . . . . 10.0 110.777 -179.667 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' D' D ' 830' ' ' VAL . . . . . 0.525 ' O ' ' HB2' ' D' ' 834' ' ' LEU . 69.6 t -59.06 -44.54 91.63 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 179.203 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 831' ' ' TYR . . . . . 0.637 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 27.4 t80 -55.83 -34.23 65.2 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.32 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -68.5 -64.58 0.84 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.675 -178.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 1.2 m -61.69 -38.56 88.29 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.382 0.512 . . . . 10.0 112.382 -179.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 834' ' ' LEU . . . . . 0.576 ' HB3' ' HZ3' ' D' ' 863' ' ' TRP . 3.7 mm? -75.4 -17.55 60.17 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.933 0.716 . . . . 10.0 112.933 -178.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 835' ' ' ASP . . . . . 0.416 ' HB2' ' O ' ' D' ' 831' ' ' TYR . 32.1 t70 -62.13 -48.88 78.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.95 0.405 . . . . 10.0 109.939 179.274 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 836' ' ' LYS . . . . . 0.406 ' O ' ' HB ' ' D' ' 840' ' ' VAL . 3.4 mmmm -67.43 -25.93 66.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.362 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -81.67 -18.34 44.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.57 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 838' ' ' LEU . . . . . 0.595 HD12 ' HG3' ' D' ' 845' ' ' GLN . 16.3 mt -99.26 -47.12 5.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.042 0.448 . . . . 10.0 111.007 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 839' ' ' LYS . . . . . 0.442 ' HA ' ' HD3' ' D' ' 839' ' ' LYS . 28.9 mmtp -62.01 -27.49 68.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.898 -0.592 . . . . 10.0 111.061 -179.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 840' ' ' VAL . . . . . 0.83 HG13 ' HG3' ' D' ' 841' ' ' ARG . 10.1 p -57.73 -22.84 19.09 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 O-C-N 123.739 0.649 . . . . 10.0 111.208 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 841' ' ' ARG . . . . . 0.83 ' HG3' HG13 ' D' ' 840' ' ' VAL . 2.5 mtp-105 -120.6 10.15 11.0 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.224 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 73.49 33.35 58.59 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.975 -0.631 . . . . 10.0 112.801 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 90.8 mt -104.93 142.69 34.31 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -108.56 153.82 22.83 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.523 -0.308 . . . . 10.0 111.22 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 845' ' ' GLN . . . . . 0.595 ' HG3' HD12 ' D' ' 838' ' ' LEU . 23.8 mp0 -76.49 51.36 0.72 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.245 0.545 . . . . 10.0 111.795 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -118.79 -71.74 0.72 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.85 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -92.73 32.45 1.24 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.817 -0.629 . . . . 10.0 111.597 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 36.2 m -125.0 137.84 54.23 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.74 -0.467 . . . . 10.0 109.74 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 4.7 p -126.9 137.8 56.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.622 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 850' ' ' VAL . . . . . 0.47 HG22 HG22 ' D' ' 877' ' ' VAL . 43.4 t -101.58 126.85 55.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 121.066 0.46 . . . . 10.0 111.05 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -109.32 144.74 37.08 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.9 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 852' ' ' ARG . . . . . 0.785 ' HD3' HD11 ' D' ' 870' ' ' LEU . 27.8 mtm180 -92.13 179.43 5.58 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.252 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 853' ' ' LEU . . . . . 0.473 HD23 HD11 ' D' ' 876' ' ' ILE . 0.2 OUTLIER -123.32 56.76 1.17 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.333 0.587 . . . . 10.0 110.455 -179.583 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 61.4 mt -83.21 100.96 7.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.816 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 855' ' ' LYS . . . . . 0.413 ' HE2' ' HA ' ' D' ' 855' ' ' LYS . 10.7 mmpt? 63.8 14.37 8.23 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.938 -0.573 . . . . 10.0 111.302 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 102.62 -13.26 56.62 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 121.067 -0.587 . . . . 10.0 111.92 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -83.05 130.53 35.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.007 0.432 . . . . 10.0 110.649 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 858' ' ' LYS . . . . . 0.565 ' HG2' H132 ' A' ' 3' ' ' PCW . 1.6 mppt? -84.07 104.37 14.08 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.102 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.95 136.68 41.36 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.962 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 42.3 t -67.07 126.41 26.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.922 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 5.1 m -119.49 142.85 47.91 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -86.89 162.49 17.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.785 0.326 . . . . 10.0 111.591 -178.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 863' ' ' TRP . . . . . 0.637 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 73.0 m95 -78.97 -25.3 43.49 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.886 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -72.95 -22.94 60.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.705 -0.679 . . . . 10.0 111.319 -179.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 5.3 m -62.96 146.19 53.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.388 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 866' ' ' ALA . . . . . 0.661 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -78.0 149.79 34.0 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.107 -0.331 . . . . 10.0 110.107 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 867' ' ' ILE . . . . . 0.591 HD11 HD11 ' D' ' 875' ' ' LEU . 7.9 tp -92.0 -10.41 9.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.111 0.481 . . . . 10.0 111.498 -179.338 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -55.07 -52.68 69.07 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 113.749 1.018 . . . . 10.0 113.749 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -77.51 9.85 2.73 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 121.864 1.709 . . . . 10.0 113.369 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 870' ' ' LEU . . . . . 0.785 HD11 ' HD3' ' D' ' 852' ' ' ARG . 1.3 mm? -104.25 4.7 34.09 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.045 0.387 . . . . 10.0 112.045 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -69.22 104.14 2.12 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.501 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 145.17 -13.55 1.87 Allowed Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.05 -1.071 . . . . 10.0 113.811 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -128.42 -174.85 3.34 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 117.554 0.677 . . . . 10.0 112.201 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -109.33 153.05 24.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.142 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 875' ' ' LEU . . . . . 0.591 HD11 HD11 ' D' ' 867' ' ' ILE . 47.8 mt -121.18 128.53 52.56 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.178 -0.305 . . . . 10.0 110.178 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 876' ' ' ILE . . . . . 0.649 HG21 ' H32' ' A' ' 3' ' ' PCW . 2.4 mp -113.65 122.23 67.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.835 0.35 . . . . 10.0 110.806 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 877' ' ' VAL . . . . . 0.48 HG11 HD21 ' D' ' 838' ' ' LEU . 17.6 t -106.42 130.13 58.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 878' ' ' GLU . . . . . 0.484 ' HA ' ' HB3' ' D' ' 815' ' ' PRO . 0.0 OUTLIER -128.1 163.34 24.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.765 0.317 . . . . 10.0 110.962 179.707 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 59.0 t -93.24 130.0 42.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.433 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 49.2 mt . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.551 -0.738 . . . . 10.0 110.46 179.54 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PCW . . . . . 0.66 H352 ' H32' ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PCW . . . . . 0.414 H342 H362 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PCW . . . . . 0.649 ' H32' HG21 ' D' ' 876' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PCW . . . . . 0.509 H431 H221 ' A' ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PCW . . . . . 0.609 H452 ' H34' ' A' ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PCW . . . . . 0.541 H432 H172 ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PCW . . . . . 0.548 ' H2 ' ' H52' ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PCW . . . . . 0.519 H471 ' H19' ' A' ' 8' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PCW . . . . . 0.88 ' H41' ' H31' ' A' ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PCW . . . . . 0.451 H141 H432 ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PCW . . . . . 0.497 H422 H152 ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PCW . . . . . 0.712 ' H42' ' N1 ' ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PCW . . . . . 0.862 H122 ' H37' ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PCW . . . . . 0.677 H421 ' H12' ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PCW . . . . . 0.409 H372 H152 ' A' ' 15' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PCW . . . . . 0.764 H451 ' H60' ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PCW . . . . . 0.734 ' H39' ' H18' ' A' ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PCW . . . . . 0.517 H432 H211 ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PCW . . . . . 0.453 H152 H261 ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PCW . . . . . 0.557 ' H31' H121 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PCW . . . . . 0.424 ' O1P' ' H83' ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PCW . . . . . 0.593 H483 H422 ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PCW . . . . . 0.617 ' H2 ' H131 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PCW . . . . . 0.522 H181 H181 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PCW . . . . . 0.701 H122 ' H12' ' A' ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PCW . . . . . 0.694 ' H19' ' H72' ' A' ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PCW . . . . . 0.649 ' H73' ' HB2' ' B' ' 70' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PCW . . . . . 0.659 H461 H482 ' A' ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PCW . . . . . 0.555 H431 H212 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PCW . . . . . 0.842 H352 H122 ' A' ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PCW . . . . . 0.701 ' H12' H122 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PCW . . . . . 0.559 H262 H462 ' A' ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' 17F . . . . . 0.573 ' H49' H462 ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' 17F . . . . . 0.677 ' H12' H421 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' 17F . . . . . 0.66 ' H32' H352 ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' 17F . . . . . 0.609 ' H34' H452 ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' 17F . . . . . 0.862 ' H37' H122 ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' 17F . . . . . 0.734 ' H18' ' H39' ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' 17F . . . . . 0.764 ' H60' H451 ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' 17F . . . . . 0.698 ' H61' H361 ' A' ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PCW . . . . . 0.545 H332 H252 ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PCW . . . . . 0.842 ' H71' ' HN1' ' A' ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PCW . . . . . 0.605 ' H81' ' O2P' ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PCW . . . . . 0.649 ' H62' HN1A ' A' ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PCW . . . . . 0.574 H171 ' H30' ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PCW . . . . . 0.805 ' H11' H381 ' A' ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PCW . . . . . 0.573 H452 ' H56' ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PCW . . . . . 0.614 H241 H481 ' A' ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PCW . . . . . 0.594 H242 H161 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PCW . . . . . 0.419 H321 H18A ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PCW . . . . . 0.501 H462 H231 ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PCW . . . . . 0.745 H121 ' H19' ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PCW . . . . . 0.778 H212 H151 ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PCW . . . . . 0.85 H131 H331 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PCW . . . . . 0.554 H272 ' H46' ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PCW . . . . . 0.879 H132 H331 ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PCW . . . . . 0.586 ' H61' ' O1P' ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PCW . . . . . 0.507 ' O2P' ' H81' ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PCW . . . . . 0.61 ' H51' ' H8A' ' A' ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' PCW . . . . . 0.507 ' H81' ' O2P' ' A' ' 58' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PCW . . . . . 0.463 ' O31' ' H41' ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PCW . . . . . 0.536 H142 ' H19' ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PCW . . . . . 0.659 H482 H461 ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PCW . . . . . 0.778 H151 H212 ' A' ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PCW . . . . . 0.459 H142 ' H5 ' ' A' ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PCW . . . . . 0.739 ' H41' ' H30' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PCW . . . . . 0.676 H151 H341 ' A' ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PCW . . . . . 0.51 H262 H241 ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PCW . . . . . 0.502 H451 H411 ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PCW . . . . . 0.805 H381 ' H11' ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PCW . . . . . 0.617 H272 ' H45' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' 17F . . . . . 0.573 ' H56' H452 ' A' ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' 17F . . . . . 0.615 ' H70' H141 ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' 17F . . . . . 0.842 ' HN1' ' H71' ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' 17F . . . . . 0.465 ' H70' ' H73' ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' 17F . . . . . 0.649 HN1A ' H62' ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' 17F . . . . . 0.739 ' H30' ' H41' ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' 17F . . . . . 0.478 ' H42' H262 ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' 17F . . . . . 0.584 ' H9A' H19A ' A' ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 201' ' ' GNP . . . . . 0.567 H5'1 ' HA ' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.621 ' HA ' HD12 ' A' ' 204' ' ' LEU . 52.6 mt . . . . . 0 C--O 1.236 0.375 0 CA-C-O 120.845 0.355 . . . . 10.0 110.652 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -64.57 -49.4 71.34 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 115.798 -0.637 . . . . 10.0 111.077 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 96.0 mt -77.07 14.63 0.84 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.871 0.367 . . . . 10.0 111.574 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 204' ' ' LEU . . . . . 0.621 HD12 ' HA ' ' A' ' 201' ' ' LEU . 90.0 mt -113.71 -59.95 1.95 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.357 179.647 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -73.31 -38.08 65.97 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.004 0.372 . . . . 10.0 112.004 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 206' ' ' ASN . . . . . 0.412 ' O ' HG23 ' A' ' 210' ' ' VAL . 23.2 t-20 -63.97 -41.74 97.47 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 16.8 m0 -69.23 -29.06 66.92 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.409 -0.814 . . . . 10.0 110.565 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -60.71 -48.74 80.45 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 109.177 -0.675 . . . . 10.0 109.177 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.9 m -57.75 -45.7 85.53 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 210' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 206' ' ' ASN . 63.0 t -60.52 -37.51 75.21 Favored 'Isoleucine or valine' 0 C--O 1.231 0.11 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.178 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 24.3 m -61.52 -45.2 95.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.113 -0.494 . . . . 10.0 109.778 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.27 -38.28 89.78 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.743 -0.466 . . . . 10.0 109.743 179.027 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 24.1 m -61.94 -42.91 99.65 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.749 -0.463 . . . . 10.0 109.749 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -63.27 -41.53 99.03 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.372 -0.377 . . . . 10.0 110.201 178.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 14.9 m -64.87 -48.78 73.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.08 -0.509 . . . . 10.0 109.867 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -61.38 -33.31 73.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.762 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 23.9 mt -70.86 -39.4 72.93 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.065 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 38.1 mtt180 -68.1 -39.85 82.75 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -70.07 -12.98 62.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.142 178.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -95.49 -42.79 8.28 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.415 -0.811 . . . . 10.0 108.898 178.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 38.1 mt -59.27 -32.58 70.15 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.119 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -55.28 -69.36 1.29 Allowed Glycine 0 C--N 1.332 0.312 0 N-CA-C 111.244 -0.742 . . . . 10.0 111.244 178.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -59.41 -37.02 92.39 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.316 2.011 . . . . 10.0 111.199 178.012 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 224' ' ' VAL . . . . . 0.532 ' O ' ' HB2' ' A' ' 228' ' ' PHE . 5.9 t -57.54 -48.86 82.14 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.199 0 CA-C-N 116.523 -0.308 . . . . 10.0 111.242 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 9.5 p -66.14 -38.3 87.82 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.873 -0.331 . . . . 10.0 110.395 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -62.4 -50.92 69.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.451 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -66.95 -38.47 86.18 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.392 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 228' ' ' PHE . . . . . 0.532 ' HB2' ' O ' ' A' ' 224' ' ' VAL . 1.6 t80 -62.24 -44.73 95.91 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 178.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 229' ' ' TRP . . . . . 0.668 ' HA ' ' HB2' ' A' ' 232' ' ' LEU . 0.9 OUTLIER -70.66 -34.08 71.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.696 179.461 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -60.33 -39.36 86.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.508 0.671 . . . . 10.0 109.367 178.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -78.54 -35.05 46.69 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 232' ' ' LEU . . . . . 0.668 ' HB2' ' HA ' ' A' ' 229' ' ' TRP . 14.5 mt -61.77 -35.61 78.66 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.406 179.05 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -61.58 -47.75 84.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.271 -0.422 . . . . 10.0 109.967 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -64.27 -36.97 85.82 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.048 -0.523 . . . . 10.0 109.66 179.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.15 -49.37 70.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.485 -0.78 . . . . 10.0 110.013 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 3.1 p -67.02 -36.57 82.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.301 -0.409 . . . . 10.0 111.013 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -62.04 -49.64 75.18 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -62.09 -47.58 88.95 Favored Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 111.248 -0.741 . . . . 10.0 111.248 178.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 69.7 mt -62.72 -38.08 89.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.544 0.211 . . . . 10.0 111.329 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 30.2 ttm180 -66.95 -44.03 81.61 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 178.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -61.07 -44.7 96.97 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 108.362 -0.977 . . . . 10.0 108.362 178.318 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 242' ' ' GLU . . . . . 0.42 ' OE1' ' HB3' ' C' ' 528' ' ' ARG . 20.5 mt-10 -59.11 -55.88 29.36 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.225 -0.898 . . . . 10.0 109.892 178.619 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 243' ' ' MET . . . . . 0.42 ' HA ' ' HB3' ' A' ' 246' ' ' ASP . 81.4 mmm -58.57 -35.18 71.97 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 112.763 0.653 . . . . 10.0 112.763 -179.288 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 244' ' ' SER . . . . . 0.473 ' O ' ' HG3' ' A' ' 248' ' ' GLU . 51.1 m -62.07 -38.02 87.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.168 0.508 . . . . 10.0 109.762 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -84.15 -40.43 18.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.004 -0.543 . . . . 10.0 109.539 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 246' ' ' ASP . . . . . 0.42 ' HB3' ' HA ' ' A' ' 243' ' ' MET . 12.8 t70 -56.61 -51.58 68.13 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.068 179.281 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 52.8 mt -60.02 -41.72 92.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.928 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 248' ' ' GLU . . . . . 0.473 ' HG3' ' O ' ' A' ' 244' ' ' SER . 7.3 mt-10 -66.67 -49.22 66.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.623 -0.262 . . . . 10.0 110.882 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.04 -43.47 98.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.017 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 250' ' ' VAL . . . . . 0.583 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 41.9 t -67.25 -46.95 82.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.577 0 CA-C-N 116.429 -0.35 . . . . 10.0 111.323 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.452 ' O ' HG12 ' A' ' 254' ' ' VAL . 53.6 mttm -68.15 -47.46 68.01 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.449 0.537 . . . . 10.0 112.449 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.53 -29.95 71.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.553 0.216 . . . . 10.0 111.285 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -92.8 -26.8 17.54 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 121.142 -0.223 . . . . 10.0 111.563 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.583 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 1.1 p -64.0 -28.5 45.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.573 0.225 . . . . 10.0 110.922 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 255' ' ' GLN . . . . . 0.492 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 61.6 mt-30 -61.33 -62.13 6.54 Favored Pre-proline 0 CA--C 1.533 0.314 0 N-CA-C 109.487 -0.56 . . . . 10.0 109.487 178.122 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 256' ' ' PRO . . . . . 0.492 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 15.5 Cg_endo -62.44 -31.6 80.79 Favored 'Trans proline' 0 C--N 1.359 1.114 0 C-N-CA 121.633 1.555 . . . . 10.0 111.262 177.654 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 257' ' ' TYR . . . . . 0.482 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 5.5 m-30 -62.53 -53.57 52.82 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 178.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 49.1 mt -68.99 -34.3 75.07 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.763 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -59.93 -45.19 93.4 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.976 -0.749 . . . . 10.0 108.976 178.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -63.88 -43.92 94.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.359 -0.837 . . . . 10.0 109.625 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -63.81 -39.74 94.96 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.681 179.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -65.25 -40.08 93.53 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 178.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 39.1 mttp -63.73 -47.24 81.87 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.562 -0.903 . . . . 10.0 108.562 178.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.633 ' HE3' ' HB1' ' C' ' 509' ' ' ALA . 13.2 mptt -58.34 -51.33 70.25 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.543 -0.753 . . . . 10.0 109.446 178.14 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -56.06 -38.65 70.92 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.956 179.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -63.81 -45.13 91.02 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -61.31 -48.04 83.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.18 -0.464 . . . . 10.0 109.795 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 268' ' ' GLU . . . . . 0.496 ' OE1' ' HD2' ' C' ' 506' ' ' ARG . 1.9 mt-10 -61.49 -52.58 63.91 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.865 -0.607 . . . . 10.0 111.075 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 89.4 mmm -62.13 -47.7 83.43 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.549 0.574 . . . . 10.0 112.549 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -59.71 -44.78 93.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.498 0.19 . . . . 10.0 110.601 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 41.4 mt -67.43 -37.33 82.87 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.843 -0.428 . . . . 10.0 109.843 178.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 272' ' ' TYR . . . . . 0.422 ' O ' HG23 ' A' ' 276' ' ' VAL . 2.5 m-30 -60.42 -50.52 73.25 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.571 -0.529 . . . . 10.0 109.571 178.455 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 273' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 273' ' ' ARG . 0.0 OUTLIER -62.06 -42.24 98.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.244 179.554 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -61.62 -23.54 66.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.458 -0.792 . . . . 10.0 110.694 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.657 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 14.8 mmtp -94.52 -40.6 9.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.673 178.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 276' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 272' ' ' TYR . 26.0 t -50.61 -44.38 25.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 O-C-N 123.175 0.297 . . . . 10.0 111.784 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 277' ' ' GLU . . . . . 0.477 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 1.3 mt-10 -57.18 -62.18 5.71 Favored Pre-proline 0 CA--C 1.536 0.432 0 N-CA-C 113.041 0.756 . . . . 10.0 113.041 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 278' ' ' PRO . . . . . 0.477 ' HD3' ' HB2' ' A' ' 277' ' ' GLU . 32.2 Cg_endo -67.03 -37.94 17.66 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 121.902 1.735 . . . . 10.0 112.344 179.004 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.657 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 33.7 mt -62.77 -42.45 99.69 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.624 0.249 . . . . 10.0 110.423 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 280' ' ' ARG . . . . . 0.496 ' O ' ' HB2' ' A' ' 284' ' ' GLN . 10.5 ttt180 -64.23 -36.46 84.15 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.14 -0.689 . . . . 10.0 109.14 178.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.56 -42.85 95.4 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.976 -0.556 . . . . 10.0 109.786 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -64.98 -46.37 81.76 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.59 -0.522 . . . . 10.0 109.59 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 89.0 mt -63.75 -40.66 97.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.119 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 284' ' ' GLN . . . . . 0.496 ' HB2' ' O ' ' A' ' 280' ' ' ARG . 1.4 mt-30 -65.48 -50.35 65.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.188 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -58.78 -46.17 88.15 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.557 -0.534 . . . . 10.0 109.557 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.75 -43.93 97.03 Favored Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 111.101 -0.8 . . . . 10.0 111.101 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.3 -44.23 92.26 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 110.585 -0.154 . . . . 10.0 110.585 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 -56.0 -45.41 79.04 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.829 0.347 . . . . 10.0 110.105 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -68.68 -56.82 6.89 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.692 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 37.3 mttt -55.45 -39.49 70.38 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.203 -0.453 . . . . 10.0 112.131 -179.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 291' ' ' LEU . . . . . 0.597 ' O ' ' HG3' ' A' ' 295' ' ' GLN . 39.4 mt -69.88 -43.51 71.69 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.889 -0.411 . . . . 10.0 109.889 178.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 292' ' ' HIS . . . . . 0.477 ' O ' ' HG3' ' A' ' 296' ' ' GLU . 53.5 t60 -65.9 -39.07 90.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.123 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -61.54 -39.38 90.84 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.739 -0.837 . . . . 10.0 108.739 178.123 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 59.0 mt -69.06 -38.13 78.92 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.218 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 295' ' ' GLN . . . . . 0.597 ' HG3' ' O ' ' A' ' 291' ' ' LEU . 55.7 mt-30 -60.69 -41.47 95.22 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.169 0.509 . . . . 10.0 109.906 178.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 296' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 292' ' ' HIS . 31.7 mt-10 -71.5 -4.68 28.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.269 -0.878 . . . . 10.0 111.276 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 297' ' ' LYS . . . . . 0.462 ' HD3' ' HA ' ' A' ' 297' ' ' LYS . 9.4 mmtp -111.2 -43.2 3.77 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 178.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 87.8 mt -60.76 -32.16 71.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.021 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 299' ' ' SER . . . . . 0.503 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 13.1 m -69.36 -63.46 2.03 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 112.052 0.39 . . . . 10.0 112.052 179.502 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 300' ' ' PRO . . . . . 0.503 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 43.3 Cg_endo -68.03 -46.81 2.08 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 121.902 1.734 . . . . 10.0 112.942 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.487 HD13 ' HG2' ' C' ' 473' ' ' LYS . 89.5 mt -67.64 -32.6 73.41 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.645 -0.502 . . . . 10.0 109.645 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -69.45 -46.47 55.72 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 109.681 -1.368 . . . . 10.0 109.681 178.21 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -60.15 -42.34 94.69 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -62.36 -44.06 97.36 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.959 178.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 4.1 tpt -64.83 -37.83 88.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.316 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 306' ' ' ARG . . . . . 0.483 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 47.5 mtt180 -69.31 -38.1 78.09 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 178.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 307' ' ' ASP . . . . . 0.516 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 38.1 t70 -65.73 -45.34 83.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.762 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 308' ' ' ARG . . . . . 0.591 ' HG3' ' CD2' ' C' ' 469' ' ' LEU . 13.9 mmt180 -68.45 -28.41 67.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.654 -0.703 . . . . 10.0 109.386 178.537 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 309' ' ' ALA . . . . . 0.531 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -67.47 -34.28 76.84 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.692 -0.855 . . . . 10.0 108.692 177.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 310' ' ' ARG . . . . . 0.516 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 74.4 mtt180 -60.83 -49.54 77.08 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 108.432 -0.951 . . . . 10.0 108.432 177.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -66.62 -39.85 88.5 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.69 178.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 312' ' ' HIS . . . . . 0.531 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.2 OUTLIER -54.29 -54.72 36.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.596 -0.729 . . . . 10.0 110.031 178.992 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 61.7 t -73.05 -38.21 55.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.534 -0.757 . . . . 10.0 111.968 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -58.88 -53.18 61.26 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 110.392 -0.225 . . . . 10.0 110.392 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -60.97 -31.04 70.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.289 0.566 . . . . 10.0 109.918 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 316' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 316' ' ' LEU . 13.6 mt -71.42 -40.91 70.14 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.732 178.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 84.9 mtt180 -64.22 -43.64 94.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.604 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 2.8 m -65.07 -15.53 62.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.616 179.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 12.0 m80 -101.14 -39.76 7.52 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.22 -0.445 . . . . 10.0 110.322 178.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 47.5 mt -60.96 -40.03 91.8 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.593 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.62 -60.59 8.82 Favored Pre-proline 0 CA--C 1.535 0.381 0 O-C-N 123.135 0.272 . . . . 10.0 111.309 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -66.71 -36.3 25.15 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 121.337 1.358 . . . . 10.0 111.517 178.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 -58.68 -48.74 80.06 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.638 0.256 . . . . 10.0 111.035 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 324' ' ' SER . . . . . 0.449 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 49.7 p -67.59 -38.62 84.27 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 325' ' ' ASP . . . . . 0.741 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 7.6 t0 -63.52 -40.93 98.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.194 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -64.36 -40.9 96.76 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 108.276 -1.009 . . . . 10.0 108.276 177.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 68.7 mt -63.25 -33.74 76.14 Favored 'General case' 0 C--O 1.221 -0.412 0 CA-C-N 115.386 -0.824 . . . . 10.0 109.604 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 328' ' ' ARG . . . . . 0.741 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 75.8 mtt180 -62.59 -42.49 99.6 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.382 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -70.43 -47.51 60.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.942 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 330' ' ' ARG . . . . . 0.528 ' O ' ' HG2' ' A' ' 334' ' ' ARG . 4.3 ttm180 -61.55 -48.98 78.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.051 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 49.3 mt -62.35 -34.67 77.11 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 116.539 -0.301 . . . . 10.0 110.477 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.9 -47.26 85.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -63.76 -43.23 97.03 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.03 178.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 334' ' ' ARG . . . . . 0.657 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 3.6 mmt85 -58.97 -52.06 67.38 Favored 'General case' 0 C--O 1.227 -0.108 0 N-CA-C 109.425 -0.583 . . . . 10.0 109.425 178.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 58.1 mt -63.82 -37.38 87.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.36 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -61.5 -45.14 95.49 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.268 -0.271 . . . . 10.0 110.268 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.17 -39.68 86.48 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 82.2 mt -67.53 -19.56 65.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.579 -0.737 . . . . 10.0 111.084 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 33.9 mtpt -91.47 -46.38 8.02 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.633 -0.506 . . . . 10.0 109.633 178.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -58.8 -53.38 59.05 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.983 -0.747 . . . . 10.0 108.983 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 341' ' ' ASN . . . . . 0.407 ' OD1' ' HB3' ' C' ' 432' ' ' LYS . 66.5 m-20 -76.17 -23.6 54.73 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.477 178.385 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -66.71 -46.09 78.55 Favored Glycine 0 CA--C 1.507 -0.455 0 N-CA-C 111.308 -0.717 . . . . 10.0 111.308 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.95 -38.38 95.95 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 110.113 -1.195 . . . . 10.0 110.113 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.13 -43.13 92.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.072 -0.714 . . . . 10.0 109.072 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 345' ' ' ARG . . . . . 0.539 ' HD3' ' OE2' ' C' ' 433' ' ' GLU . 19.2 mtm180 -60.19 -49.96 75.57 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.074 178.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 94.8 mt -60.03 -44.39 94.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.42 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.72 -48.16 80.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.032 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 348' ' ' GLU . . . . . 0.431 ' HB3' ' NZ ' ' A' ' 352' ' ' LYS . 4.7 mt-10 -62.03 -36.6 82.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.295 179.498 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -66.97 -38.66 86.48 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.543 -0.54 . . . . 10.0 109.543 178.338 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 34.5 m-70 -66.02 -39.5 90.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 10.0 109.975 178.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -63.88 -47.12 81.91 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.127 -0.694 . . . . 10.0 109.127 178.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 352' ' ' LYS . . . . . 0.456 ' NZ ' ' HB3' ' C' ' 425' ' ' GLU . 27.7 mttp -66.85 -33.28 75.26 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.762 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.11 -44.61 79.52 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 56.8 m -61.13 -47.32 86.8 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -61.59 -44.53 96.83 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.905 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 356' ' ' HIS . . . . . 0.448 ' HB2' ' O ' ' A' ' 352' ' ' LYS . 0.1 OUTLIER -58.35 -48.28 81.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.154 179.359 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.508 HD21 H152 ' A' ' 2' ' ' PCW . 62.7 mt -61.11 -35.57 77.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.574 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 19.2 m -63.9 -51.98 62.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.015 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.36 -30.88 71.76 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.087 0.47 . . . . 10.0 110.098 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 19.4 mt -68.23 -35.4 77.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.423 178.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 26.6 p -67.22 -27.73 67.48 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.561 -0.533 . . . . 10.0 109.561 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -77.23 -0.85 26.8 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 115.613 -0.722 . . . . 10.0 110.068 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.567 ' HG2' HG22 ' C' ' 411' ' ' THR . 89.7 mttt -116.78 -42.33 2.98 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.396 -0.82 . . . . 10.0 108.823 178.496 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -63.29 -21.14 66.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.538 -0.756 . . . . 10.0 111.573 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.969 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 94.2 mttt -104.98 -69.24 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.457 0 N-CA-C 112.172 0.434 . . . . 10.0 112.172 179.291 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.969 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 23.1 Cg_exo -66.28 -50.33 1.51 Allowed 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.502 2.134 . . . . 10.0 113.319 -178.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 367' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -64.62 -43.37 93.95 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.678 0.275 . . . . 10.0 111.74 -179.214 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 368' ' ' LEU . . . . . 0.465 HD23 ' HA ' ' A' ' 368' ' ' LEU . 13.8 mt -67.11 -35.99 80.96 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.763 -0.375 . . . . 10.0 110.278 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 369' ' ' GLU . . . . . 0.687 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 5.8 tt0 -66.11 -38.2 87.61 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.527 -0.916 . . . . 10.0 108.527 178.211 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.04 -43.06 96.69 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 178.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 371' ' ' LEU . . . . . 0.449 HD12 HD23 ' A' ' 368' ' ' LEU . 19.0 mt -62.28 -45.58 92.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.601 -0.727 . . . . 10.0 110.638 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 372' ' ' ARG . 17.9 mtt180 -67.53 -37.84 83.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.943 0.402 . . . . 10.0 109.941 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.687 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.7 mt-30 -67.27 -16.92 64.56 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 115.569 -0.741 . . . . 20.0 111.34 178.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -96.3 -40.36 3.99 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 108.746 -1.742 . . . . 10.0 108.746 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 62.4 mt -58.24 -36.84 73.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.66 -0.27 . . . . 10.0 111.672 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 376' ' ' LEU . . . . . 0.42 ' O ' ' HG2' ' A' ' 380' ' ' GLU . 96.1 mt -59.65 -63.8 3.78 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 120.925 -0.31 . . . . 10.0 111.364 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.416 ' CD ' ' HB2' ' A' ' 376' ' ' LEU . 19.7 Cg_endo -61.83 -35.14 80.3 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 121.994 1.796 . . . . 10.0 111.676 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 6.1 t -61.26 -49.5 84.33 Favored 'Isoleucine or valine' 0 C--O 1.231 0.108 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 178.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 34.3 mt -63.06 -33.66 75.92 Favored 'General case' 0 C--O 1.224 -0.255 0 N-CA-C 109.759 -0.459 . . . . 10.0 109.759 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 380' ' ' GLU . . . . . 0.442 ' O ' HG23 ' A' ' 384' ' ' VAL . 6.0 mm-40 -61.51 -55.51 30.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.017 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.3 p -63.37 -35.45 80.44 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.006 0.432 . . . . 10.0 110.136 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.9 m-30 -63.76 -47.33 81.39 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.144 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -57.8 -40.5 80.07 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 384' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 380' ' ' GLU . 68.8 t -58.09 -50.82 76.86 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.103 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.844 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -66.45 -34.63 78.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.731 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 386' ' ' PHE . . . . . 0.535 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 22.0 m-30 -69.34 -45.58 69.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.904 0.383 . . . . 10.0 110.109 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.45 -38.02 89.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.223 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 388' ' ' SER . . . . . 0.573 ' HB2' ' HD3' ' C' ' 594' ' ' LYS . 3.4 p -74.71 -31.89 61.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.8 0.333 . . . . 10.0 110.906 179.53 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -71.16 -34.89 71.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.367 179.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 390' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 87.3 mt -59.37 -37.19 77.28 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.256 179.248 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -64.43 -45.3 88.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.469 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 392' ' ' GLU . . . . . 0.424 ' O ' ' HE2' ' A' ' 396' ' ' LYS . 19.8 mm-40 -61.12 -49.95 75.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.518 -0.765 . . . . 10.0 111.609 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -57.4 -43.87 84.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.708 0.29 . . . . 10.0 111.228 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 27.5 m -63.98 -50.26 69.28 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.277 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -62.99 -38.15 90.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.864 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 396' ' ' LYS . . . . . 0.552 ' HD2' ' HB2' ' C' ' 587' ' ' ALA . 0.1 OUTLIER -70.69 -40.17 73.06 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.298 -0.41 . . . . 10.0 112.06 -179.338 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 397' ' ' LEU . . . . . 0.701 HD21 H261 ' A' ' 32' ' ' PCW . 64.8 mt -68.69 -46.58 68.65 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.059 0.457 . . . . 10.0 110.648 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 11.5 p30 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.236 -179.768 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.5 mm? . . . . . 0 CA--C 1.522 -0.13 0 CA-C-O 121.111 0.482 . . . . 10.0 110.222 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.59 15.81 18.86 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.706 -0.679 . . . . 10.0 109.92 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 92.7 mt -64.51 -31.41 72.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.758 -0.655 . . . . 10.0 110.277 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 85.2 mt -71.67 -31.51 66.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.395 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -67.32 -45.98 74.85 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.892 -0.781 . . . . 10.0 108.892 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -64.31 -40.32 95.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.439 178.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -35.85 79.6 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.328 179.132 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -60.55 -49.18 78.59 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.008 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 1.1 m -59.27 -42.14 90.51 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.936 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 408' ' ' VAL . . . . . 0.431 ' O ' ' HB2' ' C' ' 412' ' ' PHE . 70.8 t -64.41 -44.22 97.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.316 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 30.0 m -62.4 -45.99 90.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.396 -0.366 . . . . 10.0 110.496 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 25.2 m -63.17 -45.55 91.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.467 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 411' ' ' THR . . . . . 0.567 HG22 ' HG2' ' A' ' 363' ' ' LYS . 12.8 p -67.14 -36.94 82.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.698 0.285 . . . . 10.0 111.11 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 412' ' ' PHE . . . . . 0.431 ' HB2' ' O ' ' C' ' 408' ' ' VAL . 2.7 t80 -67.87 -39.72 83.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.994 179.024 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 47.4 m -64.34 -43.28 95.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.307 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -66.14 -32.42 73.86 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.245 0.545 . . . . 10.0 109.969 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 415' ' ' LEU . . . . . 0.403 ' O ' ' HG ' ' C' ' 419' ' ' LEU . 7.7 mt -65.62 -44.24 87.1 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.067 -0.716 . . . . 10.0 109.067 177.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 416' ' ' ARG . . . . . 0.517 ' HA ' HD12 ' C' ' 419' ' ' LEU . 98.6 mtt180 -65.6 -34.3 77.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.259 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 417' ' ' GLU . . . . . 0.458 ' O ' ' HD2' ' C' ' 421' ' ' PRO . 42.2 mt-10 -65.58 -40.69 93.04 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.362 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -67.56 -33.91 75.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.862 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 419' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' C' ' 416' ' ' ARG . 85.7 mt -62.11 -12.84 21.58 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-N 115.722 -0.672 . . . . 10.0 111.867 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -74.32 -75.72 0.76 Allowed Glycine 0 CA--C 1.522 0.509 0 C-N-CA 120.494 -0.86 . . . . 10.0 111.058 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 421' ' ' PRO . . . . . 0.458 ' HD2' ' O ' ' C' ' 417' ' ' GLU . 16.2 Cg_endo -58.33 -39.6 82.82 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 123.12 2.547 . . . . 10.0 112.612 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 49.0 t -59.89 -43.12 91.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 87.8 m -68.44 -39.19 81.59 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.823 -0.436 . . . . 10.0 109.823 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -61.1 -48.31 82.27 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 425' ' ' GLU . . . . . 0.456 ' HB3' ' NZ ' ' A' ' 352' ' ' LYS . 69.1 mt-10 -62.69 -47.72 82.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.36 -0.837 . . . . 10.0 109.783 178.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -57.59 -41.12 80.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.3 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -67.84 -42.36 81.55 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.175 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 428' ' ' ASP . . . . . 0.489 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 3.9 t70 -63.59 -37.75 88.5 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.321 -0.622 . . . . 10.0 109.321 179.011 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -67.84 -43.39 79.62 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.486 -0.779 . . . . 10.0 108.96 178.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 30.5 mt -61.28 -36.57 80.42 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.915 -0.584 . . . . 10.0 109.74 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -67.4 -33.87 76.08 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.241 178.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 432' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 56.9 mttp -67.59 -47.78 68.75 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.028 -1.101 . . . . 10.0 108.028 177.411 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 433' ' ' GLU . . . . . 0.539 ' OE2' ' HD3' ' A' ' 345' ' ' ARG . 42.3 mt-10 -59.72 -47.6 85.01 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 114.951 -1.022 . . . . 10.0 111.106 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 2.8 p -63.41 -37.37 87.02 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.599 0.238 . . . . 10.0 110.825 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -62.98 -49.51 74.41 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.753 -0.832 . . . . 10.0 108.753 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.48 -46.38 93.94 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.885 -0.886 . . . . 10.0 110.885 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 59.2 mt -59.27 -34.12 71.88 Favored 'General case' 0 C--O 1.222 -0.385 0 CA-C-O 120.503 0.192 . . . . 10.0 110.564 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 52.3 mtt85 -69.24 -36.49 77.23 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 178.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -72.11 -33.02 67.51 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.997 -0.742 . . . . 10.0 108.997 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 440' ' ' GLU . . . . . 0.657 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 47.2 mt-10 -71.06 -53.39 14.86 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.182 -0.917 . . . . 10.0 109.197 178.135 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 441' ' ' MET . . . . . 0.564 ' HA ' ' HB3' ' C' ' 444' ' ' ASP . 64.1 mtt -65.58 -29.16 69.73 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.616 0.969 . . . . 10.0 113.616 -178.576 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 1.8 p -61.17 -47.46 86.08 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.018 -0.673 . . . . 10.0 109.442 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -78.07 -39.61 41.11 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.954 -0.567 . . . . 10.0 109.855 178.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 444' ' ' ASP . . . . . 0.564 ' HB3' ' HA ' ' C' ' 441' ' ' MET . 11.8 t70 -56.04 -60.32 3.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.095 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 96.0 mt -60.31 -41.97 94.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.954 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.91 -39.79 90.89 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.851 -0.339 . . . . 10.0 110.91 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.67 -38.08 80.11 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.739 -0.838 . . . . 10.0 108.739 178.362 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 8.9 t -58.98 -43.42 88.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.292 0 CA-C-N 115.753 -0.658 . . . . 10.0 109.232 178.255 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -65.97 -40.77 91.54 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 178.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -74.48 -3.97 33.93 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.491 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 451' ' ' LYS . . . . . 0.677 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 4.1 mttp -106.34 -42.94 4.91 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.412 178.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 31.3 t -61.77 -41.47 90.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.678 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 453' ' ' GLN . . . . . 0.671 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 69.2 mt-30 -55.41 -60.48 8.27 Favored Pre-proline 0 CA--C 1.536 0.433 0 O-C-N 123.164 0.29 . . . . 10.0 111.461 179.173 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 454' ' ' PRO . . . . . 0.671 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 21.4 Cg_exo -67.74 -26.46 38.93 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 122.106 1.871 . . . . 10.0 111.334 178.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 455' ' ' TYR . . . . . 0.677 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.1 OUTLIER -64.23 -53.11 54.33 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 179.284 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 68.1 mt -66.31 -38.3 87.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.729 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 457' ' ' ASP . . . . . 0.449 ' HB3' ' HA ' ' C' ' 454' ' ' PRO . 1.5 t70 -59.57 -44.9 93.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.327 178.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 458' ' ' ASP . . . . . 0.518 ' HA ' ' HZ2' ' C' ' 461' ' ' LYS . 2.8 t70 -78.96 -33.6 45.09 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.917 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 459' ' ' PHE . . . . . 0.453 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 0.1 OUTLIER -62.85 -43.4 98.91 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 178.666 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -63.66 -42.18 98.11 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 123.368 0.417 . . . . 10.0 110.051 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 461' ' ' LYS . . . . . 0.518 ' HZ2' ' HA ' ' C' ' 458' ' ' ASP . 4.3 mttp -58.8 -43.09 90.42 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.213 0.53 . . . . 10.0 109.621 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -72.72 -40.6 65.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.306 -0.861 . . . . 10.0 110.436 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 1.2 m95 -62.49 -38.81 91.35 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.337 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -67.72 -42.97 81.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.161 178.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 0.595 ' HB3' HD11 ' C' ' 469' ' ' LEU . 38.7 mt-10 -62.61 -35.53 79.85 Favored 'General case' 0 C--N 1.333 -0.117 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 178.651 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -76.73 -48.21 19.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.148 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 9.8 ttt -61.4 -57.06 13.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.001 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -65.56 -38.67 90.25 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.252 -0.647 . . . . 10.0 109.252 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 0.595 HD11 ' HB3' ' C' ' 465' ' ' GLU . 96.4 mt -59.34 -36.27 75.39 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.358 -0.837 . . . . 20.0 109.925 178.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -77.19 -39.38 48.99 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.62 178.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -60.98 -38.65 86.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.996 0.427 . . . . 10.0 110.189 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -81.4 6.74 13.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.536 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 473' ' ' LYS . . . . . 0.487 ' HG2' HD13 ' A' ' 301' ' ' LEU . 51.3 mttp -123.0 -50.29 1.93 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.277 178.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 78.0 t -61.12 -36.89 75.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.691 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.28 -59.49 10.84 Favored Pre-proline 0 CA--C 1.534 0.327 0 N-CA-C 111.758 0.281 . . . . 10.0 111.758 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -60.96 -37.39 77.24 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 121.584 1.523 . . . . 10.0 111.051 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 38.5 mt -67.06 -33.85 76.4 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.006 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 24.9 mtt180 -63.55 -38.61 91.78 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 178.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -64.98 -45.76 84.27 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 178.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.68 -44.18 94.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.716 178.762 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 63.3 mt -65.92 -41.82 90.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.922 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -63.72 -49.68 72.11 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -65.06 -42.13 94.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.928 0.394 . . . . 10.0 110.278 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.54 -36.42 93.33 Favored Glycine 0 N--CA 1.447 -0.615 0 N-CA-C 111.011 -0.835 . . . . 10.0 111.011 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 485' ' ' ALA . . . . . 0.441 ' O ' ' HG ' ' C' ' 489' ' ' LEU . . . -76.12 -39.84 54.19 Favored 'General case' 0 C--O 1.219 -0.511 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 63.2 mtt180 -61.89 -43.78 98.16 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.978 -0.749 . . . . 10.0 108.978 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -65.74 -40.06 91.76 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 108.812 -0.81 . . . . 10.0 108.812 178.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -65.77 -34.81 79.04 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 109.614 -0.514 . . . . 10.0 109.614 178.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 489' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' C' ' 485' ' ' ALA . 57.9 mt -65.48 -41.44 93.29 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.728 -0.841 . . . . 10.0 108.728 178.461 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -68.55 -40.44 80.65 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.722 -0.844 . . . . 10.0 108.722 178.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -60.29 -44.26 95.52 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 108.521 -0.918 . . . . 10.0 108.521 177.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 46.7 mt -69.87 -33.06 71.73 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.854 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -61.09 -40.14 92.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.924 0.393 . . . . 10.0 110.56 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -79.57 11.66 2.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.586 0.708 . . . . 10.0 110.36 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.58 ' O ' ' HB2' ' C' ' 499' ' ' LEU . 54.7 mttp -125.59 -57.6 1.45 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.628 -0.715 . . . . 10.0 109.806 178.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 90.2 mt -60.71 -35.22 75.77 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.443 0.534 . . . . 10.0 112.443 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 497' ' ' SER . . . . . 0.812 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 6.8 m -76.13 -62.84 0.67 Allowed Pre-proline 0 CA--C 1.538 0.517 0 C-N-CA 121.052 -0.259 . . . . 10.0 111.457 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 498' ' ' PRO . . . . . 0.812 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 52.1 Cg_exo -58.73 -54.54 2.76 Favored 'Trans proline' 0 C--N 1.357 1.015 0 C-N-CA 122.077 1.851 . . . . 10.0 111.787 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 499' ' ' LEU . . . . . 0.58 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 48.1 mt -65.92 -27.58 68.3 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 109.926 -0.398 . . . . 10.0 109.926 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -65.86 -47.12 77.89 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 110.127 -1.189 . . . . 10.0 110.127 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -64.8 -39.46 93.62 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.879 -0.785 . . . . 10.0 108.879 178.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -61.72 -52.39 64.46 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.64 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 88.0 mmm -58.87 -38.16 78.15 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.359 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -63.79 -45.57 89.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.853 0.359 . . . . 10.0 110.262 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 505' ' ' ASP . . . . . 0.441 ' O ' ' HB3' ' C' ' 508' ' ' ARG . 26.0 t70 -68.17 -45.52 73.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.696 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.496 ' HD2' ' OE1' ' A' ' 268' ' ' GLU . 13.4 mtt180 -63.73 -43.1 97.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.243 179.42 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -65.14 -33.42 75.97 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 177.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 508' ' ' ARG . . . . . 0.441 ' HB3' ' O ' ' C' ' 505' ' ' ASP . 37.5 ttm180 -62.94 -43.92 97.48 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 108.685 -0.858 . . . . 10.0 108.685 178.077 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 509' ' ' ALA . . . . . 0.633 ' HB1' ' HE3' ' A' ' 264' ' ' LYS . . . -65.74 -33.45 75.9 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.657 -0.702 . . . . 10.0 109.36 178.25 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 510' ' ' HIS . . . . . 0.543 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 6.2 m-70 -66.76 -51.12 59.55 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.103 -0.703 . . . . 10.0 109.103 178.472 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 511' ' ' VAL . . . . . 0.418 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 95.9 t -64.25 -42.33 95.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.659 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.52 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 34.9 t70 -61.95 -39.01 90.64 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 179.059 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -64.98 -40.22 94.65 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.332 -0.988 . . . . 10.0 108.332 177.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 514' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 87.6 mt -62.29 -29.71 70.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.472 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 515' ' ' ARG . . . . . 0.52 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 75.5 mtt180 -66.11 -30.68 71.22 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.396 -0.594 . . . . 10.0 109.396 178.404 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.4 10.94 33.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.605 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 517' ' ' HIS . . . . . 0.468 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 1.8 m-70 -122.82 -49.64 1.98 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.332 -0.395 . . . . 10.0 111.435 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 89.8 mt -86.62 -42.77 13.18 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 519' ' ' ALA . . . . . 0.425 ' N ' ' HD2' ' C' ' 520' ' ' PRO . . . -56.18 -56.3 32.66 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 111.793 0.294 . . . . 10.0 111.793 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 520' ' ' PRO . . . . . 0.425 ' HD2' ' N ' ' C' ' 519' ' ' ALA . 25.6 Cg_endo -62.99 -29.89 76.05 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 121.857 1.704 . . . . 10.0 110.627 178.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 521' ' ' TYR . . . . . 0.407 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 0.0 OUTLIER -64.28 -39.63 94.32 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.886 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 15.8 m -62.52 -40.56 97.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.669 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 523' ' ' ASP . . . . . 0.479 ' O ' ' HG3' ' C' ' 527' ' ' GLN . 0.3 OUTLIER -65.68 -47.58 74.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.392 179.328 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -65.01 -37.08 86.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.615 -0.72 . . . . 10.0 110.804 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 23.8 mt -64.11 -38.41 90.95 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.117 -0.698 . . . . 10.0 109.117 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 50.6 mtt85 -62.94 -37.5 87.28 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.069 178.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 527' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' C' ' 523' ' ' ASP . 88.3 mt-30 -59.87 -42.92 94.78 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 179.274 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 528' ' ' ARG . . . . . 0.42 ' HB3' ' OE1' ' A' ' 242' ' ' GLU . 10.0 mtt180 -74.0 -44.44 54.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.103 179.268 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 68.0 mt -58.38 -38.82 78.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.031 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 530' ' ' ALA . . . . . 0.469 ' O ' ' HG2' ' C' ' 534' ' ' GLU . . . -62.6 -40.15 96.03 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.407 -0.361 . . . . 10.0 110.331 179.166 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.75 -41.33 79.08 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.127 -0.694 . . . . 10.0 109.127 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 532' ' ' ARG . . . . . 0.438 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 19.1 ttm180 -60.18 -42.29 94.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.357 -0.838 . . . . 10.0 109.108 178.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.68 -32.39 73.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.626 -0.716 . . . . 10.0 110.48 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 534' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' C' ' 538' ' ' GLU . 9.6 mm-40 -67.38 -44.65 78.39 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.567 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.57 -39.67 94.98 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.226 178.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 536' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 93.8 mt -68.7 -22.73 64.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.748 179.243 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -83.15 -47.25 11.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.289 -0.414 . . . . 10.0 109.972 179.027 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 538' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' C' ' 534' ' ' GLU . 9.3 mm-40 -64.69 -53.73 42.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.184 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -68.13 -43.28 78.72 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.311 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -58.49 -51.12 60.66 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.964 -0.636 . . . . 10.0 111.821 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.43 -41.88 99.74 Favored Glycine 0 N--CA 1.451 -0.361 0 N-CA-C 111.677 -0.569 . . . . 10.0 111.677 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -64.14 -50.35 68.56 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.982 -0.377 . . . . 10.0 109.982 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 543' ' ' ARG . . . . . 0.455 HH11 ' HD2' ' C' ' 543' ' ' ARG . 50.9 mtt180 -58.3 -35.55 72.0 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.624 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 33.2 mt -62.19 -47.09 86.03 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.696 -0.483 . . . . 10.0 109.696 178.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -64.45 -39.53 93.99 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.89 -0.596 . . . . 10.0 109.635 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 78.9 mt-10 -65.46 -47.69 75.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.777 178.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 15.7 m-30 -60.03 -40.86 90.8 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.323 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 29.8 m-70 -62.63 -46.14 89.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.827 0.346 . . . . 10.0 110.378 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.06 -47.5 77.11 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.354 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.39 -32.24 73.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.636 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.22 -37.1 80.5 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 23.1 m -66.2 -47.44 73.87 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.398 -0.964 . . . . 10.0 108.398 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -61.85 -33.98 75.16 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.717 -0.674 . . . . 10.0 109.521 178.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -74.0 -33.62 63.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.141 179.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 44.0 mt -69.34 -44.02 72.47 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.78 -0.452 . . . . 10.0 109.78 178.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 10.1 m -61.97 -40.73 96.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.471 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 557' ' ' THR . . . . . 0.534 ' HA ' ' HG2' ' C' ' 560' ' ' GLU . 4.6 p -72.87 -17.57 61.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.247 0.546 . . . . 10.0 110.526 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 558' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' C' ' 558' ' ' LEU . 15.6 mt -87.09 -40.2 14.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.858 -0.61 . . . . 10.0 109.513 178.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.5 p -67.26 -28.03 67.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.217 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 560' ' ' GLU . . . . . 0.534 ' HG2' ' HA ' ' C' ' 557' ' ' THR . 2.7 pt-20 -72.75 -5.49 38.16 Favored 'General case' 0 C--N 1.339 0.12 0 CA-C-O 121.405 0.621 . . . . 10.0 110.106 178.809 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 561' ' ' LYS . . . . . 0.564 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 12.4 mptt -116.79 -39.3 3.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.241 177.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -65.87 -16.58 63.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.856 -0.611 . . . . 10.0 111.179 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 563' ' ' LYS . . . . . 0.944 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 95.9 mttt -103.59 -70.29 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.409 0 CA-C-O 119.311 -0.376 . . . . 10.0 111.199 178.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 564' ' ' PRO . . . . . 0.944 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 26.2 Cg_exo -64.04 -49.75 3.58 Favored 'Trans proline' 0 C--N 1.36 1.154 0 C-N-CA 122.405 2.07 . . . . 10.0 113.263 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 565' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -64.58 -38.95 92.78 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 121.14 -0.224 . . . . 10.0 111.54 -179.493 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 566' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' C' ' 566' ' ' LEU . 7.1 mt -66.64 -38.62 87.26 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.29 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -66.63 -36.87 83.62 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 178.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.62 -47.28 84.45 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.742 -0.836 . . . . 10.0 108.742 177.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 569' ' ' LEU . . . . . 0.447 HD12 HD23 ' C' ' 566' ' ' LEU . 89.4 mt -61.59 -40.89 96.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.455 178.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 570' ' ' ARG . . . . . 0.429 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 65.6 mtt180 -65.62 -46.93 77.41 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.015 -0.365 . . . . 10.0 110.015 178.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 571' ' ' GLN . . . . . 0.532 ' HA ' HD12 ' C' ' 574' ' ' LEU . 98.5 mt-30 -65.86 -22.74 66.55 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 115.788 -0.642 . . . . 20.0 111.983 179.433 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -86.15 -40.09 7.64 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 109.189 -1.564 . . . . 10.0 109.189 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 29.8 mt -64.88 -32.13 73.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.579 -0.31 . . . . 10.0 111.624 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 574' ' ' LEU . . . . . 0.532 HD12 ' HA ' ' C' ' 571' ' ' GLN . 35.7 mt -54.35 -62.28 4.22 Favored Pre-proline 0 CA--C 1.54 0.581 0 N-CA-C 112.357 0.502 . . . . 10.0 112.357 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -66.05 -31.09 46.72 Favored 'Trans proline' 0 C--N 1.357 0.974 0 C-N-CA 121.966 1.777 . . . . 10.0 111.001 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 11.6 t -64.65 -46.37 92.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.058 -0.519 . . . . 10.0 109.828 179.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 46.3 mt -64.71 -38.6 91.54 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 578' ' ' GLU . . . . . 0.46 ' O ' HG23 ' C' ' 582' ' ' VAL . 28.7 mt-10 -60.17 -50.84 72.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.55 178.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 2.7 p -68.27 -38.13 81.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.678 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -60.21 -44.44 95.14 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.246 178.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 581' ' ' LYS . . . . . 0.462 ' O ' ' HG ' ' C' ' 585' ' ' LEU . 68.5 mttm -62.1 -36.89 83.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.654 178.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 582' ' ' VAL . . . . . 0.46 HG23 ' O ' ' C' ' 578' ' ' GLU . 53.2 t -62.29 -46.3 96.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 178.648 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.63 -34.29 77.88 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.352 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -69.38 -44.44 71.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.287 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 585' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' C' ' 581' ' ' LYS . 88.0 mt -57.29 -47.2 82.06 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.538 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 1.9 p -68.81 -46.15 69.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.613 179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 587' ' ' ALA . . . . . 0.552 ' HB2' ' HD2' ' A' ' 396' ' ' LYS . . . -57.8 -54.0 51.88 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.441 -0.345 . . . . 10.0 111.743 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 88.9 mt -57.66 -41.06 80.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.804 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -71.4 -51.59 23.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.583 -0.28 . . . . 10.0 111.725 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -62.24 -40.69 97.0 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.944 0.35 . . . . 10.0 111.944 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 591' ' ' TYR . . . . . 0.477 ' O ' ' HG ' ' C' ' 595' ' ' LEU . 8.7 m-85 -64.46 -48.74 74.14 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.919 0.34 . . . . 10.0 111.919 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 11.8 p -63.18 -36.48 83.76 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 111.949 0.352 . . . . 10.0 111.949 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -63.8 -28.55 69.94 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.453 -0.34 . . . . 10.0 111.092 179.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 594' ' ' LYS . . . . . 0.573 ' HD3' ' HB2' ' A' ' 388' ' ' SER . 96.4 mttt -95.15 -15.49 23.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.428 -0.351 . . . . 10.0 111.504 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 595' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' C' ' 591' ' ' TYR . 60.9 mt -80.19 -25.07 39.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.293 -0.412 . . . . 10.0 111.381 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 40.5 t30 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.793 -0.623 . . . . 10.0 109.759 179.989 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 16.7 ptp . . . . . 0 C--O 1.233 0.234 0 N-CA-C 110.283 -0.266 . . . . 10.0 110.283 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.92 138.32 50.49 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.027 0.441 . . . . 10.0 111.317 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.565 ' OE2' ' H81' ' A' ' 28' ' ' PCW . 9.3 mt-10 -115.32 130.61 56.95 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.047 -0.723 . . . . 10.0 109.047 178.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -122.26 136.38 54.89 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.851 0.357 . . . . 10.0 110.91 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.525 ' HD3' ' HB2' ' B' ' 54' ' ' ASP . 27.1 mmtt -107.52 114.37 28.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.372 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.48 HD22 HD23 ' B' ' 159' ' ' LEU . 14.2 mt -109.47 132.1 54.45 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.389 -179.12 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.429 HG22 ' HB3' ' B' ' 56' ' ' LEU . 67.2 t -121.44 125.92 74.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.965 0.412 . . . . 10.0 110.916 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 3.6 t -93.19 113.14 27.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.555 HG21 HD11 ' B' ' 100' ' ' ILE . 20.9 m -96.72 168.43 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.993 0.425 . . . . 10.0 111.801 -179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 10' ' ' GLY . . . . . 0.483 ' HA2' ' CZ ' ' B' ' 96' ' ' TYR . . . 131.65 161.0 9.99 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 110.873 -0.891 . . . . 10.0 110.873 -179.463 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.12 -140.55 0.07 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.891 0.376 . . . . 10.0 110.89 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -101.69 159.51 18.33 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.69 -0.767 . . . . 10.0 111.684 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.97 -24.54 15.13 Favored Glycine 0 CA--C 1.519 0.311 0 C-N-CA 121.048 -0.596 . . . . 10.0 113.004 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.447 HG23 ' HG3' ' B' ' 16' ' ' LYS . 3.3 m -60.65 -50.74 79.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 112.317 0.488 . . . . 10.0 112.317 -179.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 105.23 35.84 3.04 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.783 -0.722 . . . . 10.0 113.351 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.447 ' HG3' HG23 ' B' ' 14' ' ' VAL . 50.6 mtmt -59.49 -54.06 50.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.166 0.508 . . . . 10.0 111.255 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.62 -37.65 76.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.593 -0.731 . . . . 10.0 111.863 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.72 -44.79 92.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.339 -0.392 . . . . 10.0 110.997 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 99.1 mt -66.98 -33.26 75.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.055 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' THR . . . . . 0.4 ' O ' HG12 ' B' ' 24' ' ' ILE . 7.1 m -71.15 -49.55 42.81 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.991 -0.549 . . . . 10.0 111.357 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 85.2 mt -63.31 -29.97 48.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.184 0.516 . . . . 10.0 110.43 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.597 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 6.3 tp-100 -66.75 -16.78 64.49 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.623 -0.717 . . . . 10.0 111.107 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 18.7 tp -106.5 -31.45 8.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.07 0.462 . . . . 10.0 110.901 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' ILE . . . . . 0.4 HG12 ' O ' ' B' ' 20' ' ' THR . 51.1 mm -76.04 -49.6 25.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.704 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -115.35 -8.97 12.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.764 0.316 . . . . 10.0 111.201 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.597 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 20.8 m120 65.83 41.53 3.8 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.317 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -133.75 142.79 48.09 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.018 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -99.97 137.23 38.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.491 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 19.1 m -89.87 159.55 2.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.906 0.384 . . . . 10.0 111.558 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -121.73 -19.92 6.63 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.351 0.596 . . . . 10.0 110.256 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -93.47 156.9 16.49 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.271 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.768 ' HA ' H5'1 ' B' ' 201' ' ' GNP . 11.1 t80 -86.28 104.83 16.18 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 110.111 -0.329 . . . . 10.0 110.111 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 33' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 31.9 t70 -77.54 115.77 52.43 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.757 179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 34' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 3.8 Cg_exo -78.31 62.59 8.16 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 123.24 2.626 . . . . 10.0 110.47 179.378 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 35' ' ' THR . . . . . 0.513 HG22 ' HA ' ' B' ' 59' ' ' ALA . 0.8 OUTLIER -61.01 130.97 49.08 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.291 -0.868 . . . . 10.0 112.118 -179.628 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.438 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 74.3 mt -121.42 -53.12 3.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.106 -0.952 . . . . 10.0 108.566 178.418 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.28 104.79 3.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.514 -0.767 . . . . 10.0 109.345 179.493 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -159.0 137.5 10.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.423 -0.353 . . . . 10.0 111.269 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 15.4 m -135.76 149.63 49.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.812 0.339 . . . . 10.0 111.137 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -126.07 142.31 51.57 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 41' ' ' ARG . . . . . 0.528 ' HD3' ' OD2' ' B' ' 54' ' ' ASP . 30.2 ttp180 -129.06 133.05 47.54 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 111.838 0.31 . . . . 10.0 111.838 -178.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 30.1 mtpt -143.56 175.0 10.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.872 -0.604 . . . . 10.0 110.417 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -115.11 120.27 39.23 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 39.2 t -131.01 132.93 63.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.67 0.272 . . . . 10.0 110.651 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 38.9 t -78.61 111.66 15.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 108.635 -0.876 . . . . 10.0 108.635 178.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 46' ' ' ILE . . . . . 0.772 HD11 HD11 ' B' ' 53' ' ' LEU . 38.3 mt -114.28 117.7 56.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 120.883 0.373 . . . . 10.0 111.17 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.627 ' HB2' HH22 ' B' ' 164' ' ' ARG . 35.9 m-20 59.85 32.08 21.08 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.476 -0.783 . . . . 10.0 111.076 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.07 -29.93 7.13 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.69 -0.687 . . . . 10.0 113.004 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -84.8 146.59 27.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.906 0.384 . . . . 10.0 111.286 -179.308 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 14.8 t -102.86 139.19 38.75 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.899 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 3.0 p -154.12 158.45 40.44 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.316 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.551 HD13 ' H82' ' A' ' 6' ' ' PCW . 96.6 mt -93.67 120.56 34.1 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.235 -0.654 . . . . 10.0 109.235 179.282 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.772 HD11 HD11 ' B' ' 46' ' ' ILE . 63.7 mt -105.86 124.19 49.18 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.533 0.568 . . . . 10.0 112.533 -178.361 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.528 ' OD2' ' HD3' ' B' ' 41' ' ' ARG . 0.5 OUTLIER -107.77 110.49 22.32 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 107.591 -1.262 . . . . 10.0 107.591 177.84 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 22.8 mt -99.94 114.92 39.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 120.836 0.35 . . . . 10.0 111.489 -178.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.429 ' HB3' HG22 ' B' ' 7' ' ' VAL . 26.4 tp -94.49 112.13 23.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.931 -0.577 . . . . 10.0 111.147 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -93.67 94.83 8.81 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 178.658 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 37.6 p -67.51 161.74 24.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.174 -0.921 . . . . 10.0 113.157 -177.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.513 ' HA ' HG22 ' B' ' 35' ' ' THR . . . -65.61 165.24 12.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.578 -0.737 . . . . 10.0 111.112 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -84.28 -80.72 1.05 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.832 -0.699 . . . . 10.0 111.957 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -92.35 114.42 26.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.841 0.353 . . . . 20.0 110.718 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -150.05 160.93 43.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.493 -0.321 . . . . 10.0 110.22 -179.546 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 55.7 mm-40 -106.45 -170.61 1.75 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.009 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -80.12 76.75 6.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.201 0.524 . . . . 10.0 111.195 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.39 147.72 23.91 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.821 179.273 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.29 -35.63 77.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.9 0.381 . . . . 10.0 110.997 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 27.7 ttt -62.42 -37.02 84.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.794 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.65 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 55.8 ttt85 -60.95 -51.8 67.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.815 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.05 -35.35 78.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.776 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -61.17 -41.14 96.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.595 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 71' ' ' TYR . . . . . 0.65 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 2.5 p90 -84.09 -24.71 30.23 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 112.837 0.68 . . . . 10.0 112.837 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 53.1 mmm -76.36 -24.56 54.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.069 0.461 . . . . 10.0 111.242 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -79.73 -0.3 33.61 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.675 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.535 ' HA ' ' H63' ' A' ' 1' ' ' PCW . 0.1 OUTLIER -99.58 2.05 44.31 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.735 0.643 . . . . 10.0 112.735 -179.2 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -107.06 152.57 16.89 Favored Glycine 0 N--CA 1.454 -0.154 0 C-N-CA 120.248 -0.977 . . . . 10.0 113.108 -179.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -99.86 -60.6 1.5 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.964 0.411 . . . . 10.0 110.19 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -99.79 139.59 14.5 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.654 -0.703 . . . . 10.0 111.993 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -125.26 131.08 53.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.925 0.393 . . . . 10.0 111.082 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.776 ' HG ' HD22 ' B' ' 159' ' ' LEU . 77.6 mt -99.88 122.46 42.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.977 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 32.5 m -95.37 86.24 4.46 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.816 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.608 ' HA ' ' HB ' ' B' ' 114' ' ' VAL . 22.0 t -87.29 122.82 39.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.243 -178.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.825 ' HB3' HD11 ' B' ' 93' ' ' ILE . 38.9 p90 -130.04 169.3 15.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.41 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -104.94 123.16 47.28 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.504 179.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 2.3 pp -68.29 -10.97 13.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 112.01 0.374 . . . . 10.0 112.01 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 85' ' ' ASN . . . . . 0.566 ' HB3' ' O ' ' B' ' 122' ' ' SER . 0.9 OUTLIER -102.95 10.96 37.97 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.373 -0.376 . . . . 10.0 111.46 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -136.83 104.29 5.45 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.93 -38.21 75.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.791 -0.64 . . . . 10.0 112.008 -178.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -63.0 -39.48 94.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.702 0.287 . . . . 10.0 110.992 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 24.0 t -60.19 -37.56 80.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.969 -0.559 . . . . 10.0 110.644 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -71.21 -39.28 71.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.395 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -66.86 -33.38 75.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.003 0.43 . . . . 10.0 111.145 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.24 -8.23 53.66 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.283 0.475 . . . . 10.0 112.283 -178.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 93' ' ' ILE . . . . . 0.825 HD11 ' HB3' ' B' ' 82' ' ' PHE . 25.8 mm -60.84 -35.83 67.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.109 0.48 . . . . 10.0 110.04 178.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 94' ' ' HIS . . . . . 0.441 ' O ' ' HG2' ' B' ' 98' ' ' GLU . 6.6 t-80 -68.63 -29.95 68.55 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 179.052 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -68.86 -44.12 74.01 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.091 -0.707 . . . . 10.0 109.091 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 96' ' ' TYR . . . . . 0.483 ' CZ ' ' HA2' ' B' ' 10' ' ' GLY . 22.5 m-85 -64.41 -43.87 93.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.6 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -54.87 -51.78 64.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.268 -0.878 . . . . 10.0 111.181 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 98' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' B' ' 94' ' ' HIS . 8.6 mm-40 -66.93 -37.39 84.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.354 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 99' ' ' GLN . . . . . 0.475 ' O ' HG13 ' B' ' 103' ' ' VAL . 32.5 tt0 -60.35 -46.94 88.13 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.484 -0.325 . . . . 10.0 110.213 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 100' ' ' ILE . . . . . 0.555 HD11 HG21 ' B' ' 9' ' ' VAL . 52.6 mt -66.69 -43.34 90.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.815 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 101' ' ' LYS . . . . . 0.539 ' HG2' ' HA ' ' B' ' 107' ' ' GLU . 33.7 mtpt -59.0 -35.98 74.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.856 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 45.9 ttp85 -77.05 -46.38 23.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.872 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.532 HG22 ' HA ' ' B' ' 100' ' ' ILE . 21.1 m -63.39 -28.17 44.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -95.03 -11.53 28.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.53 -0.305 . . . . 10.0 111.004 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 16.9 t70 60.73 21.06 11.09 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.383 0.611 . . . . 10.0 111.099 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 14.0 m -144.74 140.38 28.49 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.268 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 107' ' ' GLU . . . . . 0.539 ' HA ' ' HG2' ' B' ' 101' ' ' LYS . 26.9 mp0 -84.95 -20.0 31.29 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.317 0.58 . . . . 10.0 109.849 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -89.16 78.01 7.44 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.233 -0.894 . . . . 10.0 110.322 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.416 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 89.5 t -127.07 130.63 23.73 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.529 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 110' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 24.1 Cg_exo -64.74 112.36 1.96 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.967 2.445 . . . . 10.0 111.607 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 111' ' ' MET . . . . . 0.586 ' HB2' HG21 ' B' ' 139' ' ' ILE . 54.1 mtt -130.21 158.27 40.19 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.598 -0.519 . . . . 10.0 109.598 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 112' ' ' VAL . . . . . 0.617 ' HB ' HD23 ' B' ' 79' ' ' LEU . 84.3 t -137.31 129.72 42.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 113' ' ' LEU . . . . . 0.495 ' HG ' ' HE1' ' B' ' 82' ' ' PHE . 15.2 tp -82.44 117.74 22.7 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.808 -0.812 . . . . 10.0 108.808 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 114' ' ' VAL . . . . . 0.608 ' HB ' ' HA ' ' B' ' 81' ' ' VAL . 38.7 t -109.75 111.49 36.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 120.94 0.4 . . . . 10.0 111.984 -178.04 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -91.86 88.08 1.33 Allowed Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 110.375 -1.09 . . . . 10.0 110.375 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 116' ' ' ASN . . . . . 0.426 ' HA ' ' O ' ' B' ' 144' ' ' THR . 61.8 t30 -87.46 162.9 17.01 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 -178.028 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 28.3 mttm 67.72 32.84 5.2 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.242 -0.89 . . . . 10.0 111.731 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 28.0 p -85.8 6.71 26.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.288 0.566 . . . . 10.0 110.32 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.69 -21.73 26.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.987 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 82.3 mt -77.61 142.17 65.91 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.429 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.35 -19.91 55.43 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.945 2.43 . . . . 10.0 112.151 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 122' ' ' SER . . . . . 0.566 ' O ' ' HB3' ' B' ' 85' ' ' ASN . 1.7 m -83.04 105.19 13.82 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 179.25 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -127.72 109.91 12.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.968 0.413 . . . . 10.0 111.657 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.05 -42.08 9.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.053 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 30.2 t -87.36 115.44 27.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.685 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -80.16 154.29 28.09 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.289 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 127' ' ' THR . . . . . 0.488 HG23 ' HE2' ' B' ' 141' ' ' PHE . 5.9 m -60.23 -33.92 72.95 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.694 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -61.88 -37.72 85.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.061 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -68.18 -41.63 81.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.179 0.514 . . . . 10.0 110.084 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.99 -48.11 69.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.286 -0.87 . . . . 10.0 111.482 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.472 ' HG3' ' O ' ' B' ' 127' ' ' THR . 92.4 mt-30 -61.81 -38.03 86.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.956 0.408 . . . . 10.0 110.53 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -62.06 -51.5 67.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.744 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 55.6 tp -64.59 -41.77 96.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.003 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.76 -41.21 95.01 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.686 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -63.39 -40.23 96.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.41 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 12.9 m -66.03 -37.76 86.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.646 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 7.3 m-30 -73.87 -29.63 62.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.701 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 88.71 28.39 21.7 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 110.643 -0.983 . . . . 10.0 110.643 -178.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 139' ' ' ILE . . . . . 0.586 HG21 ' HB2' ' B' ' 111' ' ' MET . 46.0 pt -126.41 154.55 74.95 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.439 -0.38 . . . . 10.0 110.461 -179.107 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.21 157.05 29.85 Favored 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.448 2.098 . . . . 10.0 111.756 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.488 ' HE2' HG23 ' B' ' 127' ' ' THR . 37.9 t80 -119.57 126.89 52.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.606 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 36.6 mm -124.41 128.24 73.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.361 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -87.87 125.94 34.76 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.37 -0.974 . . . . 10.0 108.37 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 144' ' ' THR . . . . . 0.426 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 40.6 p -123.3 138.13 54.69 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 113.323 0.86 . . . . 10.0 113.323 -177.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 7.7 t -107.47 125.17 50.92 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.094 -1.076 . . . . 10.0 108.094 178.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.24 -26.44 52.6 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.233 0.54 . . . . 10.0 110.41 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 46.5 tttp -77.26 -48.29 17.89 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.504 -0.771 . . . . 10.0 112.787 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 148' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' B' ' 149' ' ' ARG . 72.3 p -98.2 -10.99 23.21 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.629 0.603 . . . . 10.0 112.629 -178.383 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 149' ' ' ARG . . . . . 0.4 ' HB2' ' O ' ' B' ' 148' ' ' THR . 15.2 mtp-105 70.95 13.87 6.95 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 122.823 0.449 . . . . 10.0 111.329 -178.614 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 150' ' ' GLN . . . . . 0.403 ' O ' ' HA ' ' B' ' 144' ' ' THR . 36.9 tt0 -62.93 123.52 18.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.306 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 81.06 -13.78 30.29 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.938 -0.574 . . . . 10.0 113.97 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 86.9 t -61.71 -42.84 95.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.436 0.532 . . . . 10.0 112.436 -178.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -66.75 -48.26 69.67 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.852 0.316 . . . . 10.0 111.852 -179.035 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -66.77 -26.34 66.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.433 -0.349 . . . . 10.0 111.606 -179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.8 -47.69 85.19 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.966 0.413 . . . . 10.0 110.034 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -66.57 -40.14 88.82 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.958 178.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 19.3 m-30 -63.45 -45.39 91.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.065 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 69.8 m -57.79 -41.92 83.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.81 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.776 HD22 ' HG ' ' B' ' 79' ' ' LEU . 41.5 tp -57.66 -47.59 81.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.448 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.31 -36.42 76.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.232 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 77.7 mtt180 -66.8 -38.0 85.64 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.509 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 162' ' ' GLU . . . . . 0.539 ' HA ' ' HE3' ' B' ' 165' ' ' LYS . 76.0 mm-40 -65.05 -40.85 95.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.834 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 163' ' ' ILE . . . . . 0.49 HG13 ' O ' ' B' ' 159' ' ' LEU . 70.7 mt -61.25 -40.99 87.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.98 179.102 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 164' ' ' ARG . . . . . 0.627 HH22 ' HB2' ' B' ' 47' ' ' ASP . 0.5 OUTLIER -63.93 -40.0 95.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.038 179.465 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 165' ' ' LYS . . . . . 0.539 ' HE3' ' HA ' ' B' ' 162' ' ' GLU . 28.5 mtmt -61.34 -33.62 73.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.097 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 24.3 t-80 -65.0 -39.11 92.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.066 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 167' ' ' LYS . . . . . 0.728 ' HB3' ' H71' ' A' ' 4' ' ' PCW . 16.2 mmtt -69.01 -45.61 70.08 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.963 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -65.86 -47.03 76.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.963 -0.562 . . . . 10.0 111.938 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 54.5 tttm -56.66 -45.16 81.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.671 0.272 . . . . 10.0 111.533 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -65.85 -26.18 67.54 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 111.899 0.333 . . . . 10.0 111.899 -179.639 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 171' ' ' SER . . . . . 0.416 ' OG ' ' H62' ' A' ' 4' ' ' PCW . 14.7 m -82.83 -23.44 33.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.808 0.337 . . . . 10.0 111.794 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp -114.24 14.08 18.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.691 -178.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.05 1.98 14.06 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 83.88 58.38 2.25 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.917 -0.659 . . . . 10.0 112.862 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 175' ' ' LYS . . . . . 0.46 ' HE2' ' H31' ' A' ' 32' ' ' PCW . 17.4 mttp -86.21 -30.79 22.14 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.914 0.388 . . . . 10.0 111.345 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -76.61 -8.5 57.36 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.185 0.517 . . . . 10.0 110.901 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -106.03 7.85 32.08 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.029 179.268 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 178' ' ' LYS . . . . . 0.452 ' HB3' ' HE2' ' B' ' 178' ' ' LYS . 39.0 mtpt 55.51 56.44 6.27 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.146 -0.934 . . . . 10.0 112.486 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 1.6 ttpm? -91.11 87.11 6.43 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.081 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 30.0 tttm 75.74 85.36 0.09 Allowed 'General case' 0 N--CA 1.469 0.487 0 O-C-N 124.095 0.872 . . . . 10.0 112.396 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 4.0 m -119.2 -56.29 2.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.898 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt 64.54 166.94 0.16 Allowed 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.735 0.643 . . . . 10.0 112.735 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.28 -5.18 56.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.112 -0.495 . . . . 10.0 111.213 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -160.76 132.46 5.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.582 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 71.7 m . . . . . 0 C--N 1.325 -0.469 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.789 179.492 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.44 0 N-CA-C 111.955 -0.458 . . . . 10.0 111.955 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 809' ' ' THR . . . . . 0.472 ' HB ' ' CG1' ' D' ' 821' ' ' VAL . 6.7 p -123.59 135.47 53.99 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.709 0.29 . . . . 10.0 110.972 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 6.8 t -118.5 133.85 64.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 110.206 -0.294 . . . . 10.0 110.206 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 811' ' ' LYS . . . . . 0.464 ' HE3' ' HB2' ' D' ' 811' ' ' LYS . 14.9 mtmt -87.69 112.92 22.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.485 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 39.1 t -91.52 124.78 44.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 109.736 -0.468 . . . . 10.0 109.736 179.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -88.97 115.01 26.22 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.765 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 83.0 mt -88.86 143.01 30.94 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.272 -179.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 815' ' ' PRO . . . . . 0.457 ' O ' ' H63' ' A' ' 11' ' ' PCW . 49.3 Cg_endo -68.44 -9.26 25.45 Favored 'Trans proline' 0 N--CA 1.476 0.451 0 C-N-CA 123.213 2.609 . . . . 10.0 112.666 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -88.39 18.59 4.37 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.735 -0.468 . . . . 10.0 109.735 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 26.4 mttt 61.87 47.29 6.14 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.547 0.689 . . . . 10.0 110.838 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -146.1 -177.19 5.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.758 -1.11 . . . . 10.0 108.639 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.92 165.23 37.35 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.952 -0.299 . . . . 10.0 111.351 -179.458 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 9.7 t -151.21 152.29 33.07 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.584 179.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 821' ' ' VAL . . . . . 0.472 ' CG1' ' HB ' ' D' ' 809' ' ' THR . 90.1 t -112.82 120.34 62.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 120.971 0.415 . . . . 10.0 110.934 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 31.3 m -113.13 157.51 13.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.612 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.21 133.09 35.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.621 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 13.1 t -86.98 109.29 18.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.556 -0.293 . . . . 10.0 110.328 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 -127.47 150.38 49.68 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -79.76 164.19 23.88 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 120.886 0.374 . . . . 10.0 110.696 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 89.25 -56.73 3.95 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 121.041 -0.599 . . . . 10.0 112.591 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 16.4 ptm -65.36 139.92 58.61 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.11 0.481 . . . . 10.0 111.268 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 829' ' ' SER . . . . . 0.914 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.0 OUTLIER -92.3 172.99 8.04 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.611 -179.374 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D ' 830' ' ' VAL . . . . . 0.455 ' O ' ' HB2' ' D' ' 834' ' ' LEU . 90.5 t -60.83 -35.52 65.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.119 -0.697 . . . . 10.0 109.119 179.081 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 831' ' ' TYR . . . . . 0.629 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 87.0 t80 -58.68 -38.37 78.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.514 -0.766 . . . . 10.0 110.255 178.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -67.04 -58.49 4.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.958 -0.564 . . . . 10.0 111.444 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 1.3 m -61.27 -42.62 98.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.705 -0.68 . . . . 10.0 112.747 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 834' ' ' LEU . . . . . 0.674 HD11 HG21 ' D' ' 877' ' ' VAL . 0.5 OUTLIER -73.68 -24.14 59.92 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.96 0.356 . . . . 10.0 111.96 -179.273 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D ' 835' ' ' ASP . . . . . 0.544 ' HB2' ' O ' ' D' ' 831' ' ' TYR . 35.1 t70 -59.45 -49.67 76.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.978 0.418 . . . . 10.0 110.605 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -60.69 -32.96 72.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.532 -0.758 . . . . 10.0 111.523 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -78.89 -33.4 45.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.774 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 90.1 mt -81.82 -43.79 17.8 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -179.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 5.3 mmtp -61.79 -36.71 81.88 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 -179.146 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 3.4 p -72.49 -14.19 16.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.063 0.459 . . . . 10.0 111.459 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 841' ' ' ARG . . . . . 0.423 HH22 ' HB3' ' B' ' 41' ' ' ARG . 1.2 mmt180 -105.02 -6.58 19.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.215 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 83.9 26.59 40.86 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.803 -0.713 . . . . 10.0 112.478 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 8.1 mp -117.5 158.5 24.42 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.101 -0.333 . . . . 10.0 110.101 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -123.99 164.27 19.69 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -79.32 50.07 1.05 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.897 0.38 . . . . 10.0 110.562 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -102.8 -74.57 0.63 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.462 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 847' ' ' CYS . . . . . 0.636 ' HA ' ' H71' ' A' ' 29' ' ' PCW . 75.3 m -87.03 -16.96 34.09 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.793 -0.639 . . . . 10.0 111.237 -179.791 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 29.3 m -66.85 134.31 51.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.207 -0.452 . . . . 10.0 111.355 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 7.0 p -130.81 140.42 48.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.452 -0.573 . . . . 10.0 109.452 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 15.4 t -109.67 131.82 59.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.098 0.475 . . . . 10.0 111.584 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 851' ' ' TYR . . . . . 0.462 ' CE1' HG22 ' D' ' 860' ' ' VAL . 95.5 m-85 -117.48 157.21 26.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.356 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -110.35 153.79 24.44 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.021 -0.733 . . . . 10.0 109.021 178.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 853' ' ' LEU . . . . . 0.633 HD12 ' HB2' ' D' ' 874' ' ' GLU . 27.3 mt -105.04 51.86 0.75 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.853 0.359 . . . . 10.0 111.856 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 854' ' ' ILE . . . . . 0.718 ' HB ' ' H72' ' A' ' 13' ' ' PCW . 18.1 mt -72.29 86.95 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.398 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 855' ' ' LYS . . . . . 0.617 ' HD2' ' O1 ' ' A' ' 37' ' ' 17F . 65.1 mmtt 67.29 41.16 2.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.963 -1.017 . . . . 10.0 112.377 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 86.42 -33.17 3.71 Favored Glycine 0 C--N 1.332 0.312 0 CA-C-N 115.914 -0.584 . . . . 10.0 113.852 178.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 857' ' ' ARG . . . . . 0.669 ' HB2' ' H82' ' A' ' 13' ' ' PCW . 23.1 mmt-85 -70.58 114.34 8.58 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.783 0.325 . . . . 10.0 111.376 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 858' ' ' LYS . . . . . 0.849 ' H ' HN1A ' A' ' 34' ' ' 17F . 0.8 OUTLIER -66.94 100.14 0.7 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.804 179.999 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D ' 859' ' ' THR . . . . . 0.469 ' OG1' ' H81' ' A' ' 13' ' ' PCW . 1.4 m -97.38 112.73 24.43 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.105 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 860' ' ' VAL . . . . . 0.462 HG22 ' CE1' ' D' ' 851' ' ' TYR . 2.0 t -58.17 150.88 4.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.989 -0.551 . . . . 10.0 110.799 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 4.3 t -137.53 166.72 23.22 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.34 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -106.67 160.25 15.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.681 0.277 . . . . 10.0 110.701 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 863' ' ' TRP . . . . . 0.629 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 73.3 m95 -76.86 -27.65 55.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.014 0.435 . . . . 10.0 110.688 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.33 -36.44 82.19 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.385 -0.825 . . . . 10.0 111.688 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.52 142.16 40.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.928 -0.578 . . . . 10.0 111.53 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 866' ' ' ALA . . . . . 0.914 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -78.16 162.12 26.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.831 -0.433 . . . . 10.0 109.831 179.174 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 867' ' ' ILE . . . . . 0.617 ' HA ' HD23 ' D' ' 870' ' ' LEU . 8.3 tp -87.7 1.66 6.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.118 0.485 . . . . 10.0 111.242 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -60.17 -53.21 67.21 Favored Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 113.688 0.995 . . . . 10.0 113.688 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.68 18.29 1.0 Allowed 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.222 1.948 . . . . 10.0 112.974 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 870' ' ' LEU . . . . . 0.703 HD12 ' HG2' ' D' ' 873' ' ' GLU . 2.9 mm? -106.99 20.57 18.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.386 0.612 . . . . 10.0 110.585 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -67.0 107.68 2.34 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.902 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 89.96 15.13 58.29 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.877 -0.677 . . . . 10.0 112.214 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 873' ' ' GLU . . . . . 0.703 ' HG2' HD12 ' D' ' 870' ' ' LEU . 10.0 tp10 -102.11 148.91 24.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.511 0.196 . . . . 10.0 110.544 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 874' ' ' GLU . . . . . 0.633 ' HB2' HD12 ' D' ' 853' ' ' LEU . 24.8 mt-10 -105.88 109.38 21.31 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 62.3 mt -87.26 118.21 26.53 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.286 0.476 . . . . 10.0 112.286 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 876' ' ' ILE . . . . . 0.807 HG23 ' H81' ' A' ' 9' ' ' PCW . 32.3 mt -103.18 114.59 43.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.499 179.036 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 877' ' ' VAL . . . . . 0.674 HG21 HD11 ' D' ' 834' ' ' LEU . 18.6 t -102.83 126.31 57.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.978 -0.379 . . . . 10.0 109.978 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 878' ' ' GLU . . . . . 0.478 ' OE1' ' H81' ' A' ' 11' ' ' PCW . 16.8 mm-40 -123.66 164.86 18.24 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.162 179.446 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 879' ' ' VAL . . . . . 0.593 ' O ' ' H42' ' A' ' 25' ' ' PCW . 48.5 t -112.13 108.63 26.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.856 0.36 . . . . 10.0 110.182 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 880' ' ' LEU . . . . . 0.733 ' HB2' ' H62' ' A' ' 29' ' ' PCW . 68.3 mt . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.266 -0.873 . . . . 10.0 109.798 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PCW . . . . . 0.677 ' C6 ' HN1A ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PCW . . . . . 0.53 H271 H483 ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PCW . . . . . 0.57 ' O2P' ' H63' ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PCW . . . . . 0.728 ' H71' ' HB3' ' B' ' 167' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PCW . . . . . 0.751 H431 H352 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PCW . . . . . 0.853 H152 H132 ' A' ' 24' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PCW . . . . . 0.606 ' H19' H432 ' A' ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PCW . . . . . 0.525 ' H73' ' O1P' ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PCW . . . . . 0.807 ' H81' HG23 ' D' ' 876' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PCW . . . . . 0.515 ' C7 ' HN1A ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PCW . . . . . 0.72 H322 ' H2 ' ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PCW . . . . . 0.797 ' H11' H121 ' A' ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PCW . . . . . 0.718 ' H72' ' HB ' ' D' ' 854' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PCW . . . . . 0.749 H131 H151 ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PCW . . . . . 0.639 ' H63' ' O1 ' ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PCW . . . . . 0.708 H352 ' H8A' ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PCW . . . . . 0.751 H352 H431 ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PCW . . . . . 0.629 ' H82' ' O1P' ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PCW . . . . . 0.756 ' H2 ' ' H11' ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PCW . . . . . 0.435 H241 H252 ' A' ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PCW . . . . . 0.489 ' H32' ' H31' ' A' ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PCW . . . . . 0.726 ' H52' ' H2 ' ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PCW . . . . . 0.756 ' H11' ' H2 ' ' A' ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PCW . . . . . 0.853 H132 H152 ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PCW . . . . . 0.62 H142 H381 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PCW . . . . . 0.785 ' H12' H132 ' A' ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PCW . . . . . 0.535 ' H83' ' O2P' ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PCW . . . . . 0.565 ' H81' ' OE2' ' B' ' 3' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PCW . . . . . 0.733 ' H62' ' HB2' ' D' ' 880' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PCW . . . . . 1.001 ' H73' ' HN1' ' A' ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PCW . . . . . 0.845 ' H2 ' ' H52' ' A' ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PCW . . . . . 0.732 ' H61' ' N1 ' ' A' ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' 17F . . . . . 0.621 ' H4 ' ' H11' ' A' ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' 17F . . . . . 0.849 HN1A ' H ' ' D' ' 858' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' 17F . . . . . 0.677 HN1A ' C6 ' ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' 17F . . . . . 0.664 ' H71' H271 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' 17F . . . . . 0.617 ' O1 ' ' HD2' ' D' ' 855' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' 17F . . . . . 0.751 ' O1 ' ' H81' ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' 17F . . . . . 0.708 ' H8A' H352 ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' 17F . . . . . 1.001 ' HN1' ' H73' ' A' ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PCW . . . . . 0.624 ' H32' H122 ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PCW . . . . . 0.623 H432 H231 ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PCW . . . . . 0.743 H221 H462 ' A' ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PCW . . . . . 0.48 H322 ' O3P' ' A' ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PCW . . . . . 0.69 H152 ' H19' ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PCW . . . . . 0.591 H432 H372 ' A' ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PCW . . . . . 0.591 H372 H432 ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PCW . . . . . 0.591 H341 H121 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PCW . . . . . 0.575 H341 H341 ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PCW . . . . . 0.578 H252 ' H78' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PCW . . . . . 0.743 H462 H221 ' A' ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PCW . . . . . 0.624 H122 ' H32' ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PCW . . . . . 0.543 ' H31' ' C3 ' ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PCW . . . . . 0.591 H121 H341 ' A' ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PCW . . . . . 0.48 ' O3P' H322 ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PCW . . . . . 0.656 H331 H131 ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PCW . . . . . 0.932 ' H42' HN1A ' A' ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PCW . . . . . 0.687 H121 H382 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PCW . . . . . 0.819 H342 ' H9A' ' A' ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' PCW . . . . . 0.538 H231 H251 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PCW . . . . . 0.687 H382 H121 ' A' ' 58' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PCW . . . . . 0.705 H472 H151 ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PCW . . . . . 0.654 H241 H261 ' A' ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PCW . . . . . 0.543 ' C3 ' ' H31' ' A' ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PCW . . . . . 0.519 ' H2 ' ' H41' ' A' ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PCW . . . . . 0.506 H241 H362 ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PCW . . . . . 0.813 ' H61' ' H8 ' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PCW . . . . . 0.711 ' H83' ' O1P' ' A' ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PCW . . . . . 0.584 H371 H132 ' A' ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PCW . . . . . 0.593 ' H41' ' O1P' ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PCW . . . . . 0.53 H431 ' H31' ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PCW . . . . . 0.723 H241 H352 ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' 17F . . . . . 0.498 ' H10' H261 ' A' ' 8' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' 17F . . . . . 0.69 ' H19' H152 ' A' ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' 17F . . . . . 0.559 ' H49' H481 ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' 17F . . . . . 0.446 ' H45' H182 ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' 17F . . . . . 0.819 ' H9A' H342 ' A' ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' 17F . . . . . 0.813 ' H8 ' ' H61' ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' 17F . . . . . 0.489 ' H78' H441 ' A' ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' 17F . . . . . 0.932 HN1A ' H42' ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 201' ' ' GNP . . . . . 0.768 H5'1 ' HA ' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 74.1 mt . . . . . 0 CA--C 1.521 -0.143 0 CA-C-O 120.919 0.39 . . . . 10.0 110.103 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -74.64 -17.47 60.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.287 0.565 . . . . 10.0 109.632 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 90.7 mt -69.26 -25.77 64.44 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.535 -0.757 . . . . 10.0 109.56 178.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 74.7 mt -69.77 -40.93 75.78 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.784 -0.643 . . . . 10.0 109.624 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.47 -36.07 82.79 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 178.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 41.0 t-20 -65.22 -52.7 52.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.273 -0.876 . . . . 10.0 109.094 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 4.2 m0 -58.61 -38.98 79.17 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.984 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -60.96 -39.63 90.26 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.128 0.49 . . . . 10.0 110.241 178.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 17.8 m -68.78 -22.25 64.29 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.572 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 90.5 t -85.13 -42.41 16.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.747 -0.66 . . . . 10.0 110.081 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.6 -33.43 75.88 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 121.066 -0.254 . . . . 10.0 110.868 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 13.6 p -71.81 -37.54 70.35 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.794 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.49 -37.12 71.31 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.977 -0.379 . . . . 10.0 109.977 179.049 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -64.53 -39.67 94.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.864 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 1.7 p -70.24 -42.76 71.78 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.486 -0.561 . . . . 10.0 109.486 178.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 216' ' ' LYS . . . . . 0.649 ' HD2' HG22 ' C' ' 557' ' ' THR . 20.2 mmtp -62.14 -32.54 73.14 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.553 178.09 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 14.7 mt -72.29 -49.16 36.86 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.426 -0.807 . . . . 10.0 109.98 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 218' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' A' ' 218' ' ' ARG . 8.2 ttm180 -60.3 -43.19 96.53 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.665 -0.243 . . . . 10.0 111.337 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -62.06 -21.26 64.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.251 -0.432 . . . . 10.0 111.283 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -99.66 -30.08 12.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.086 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 38.9 mt -64.09 -34.55 78.29 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.392 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -55.44 -68.44 1.69 Allowed Glycine 0 N--CA 1.451 -0.348 0 N-CA-C 110.287 -1.125 . . . . 10.0 110.287 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -55.07 -38.71 93.32 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.429 2.086 . . . . 10.0 111.353 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 5.7 t -58.31 -48.69 84.24 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 120.37 0.129 . . . . 10.0 111.118 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 9.3 p -66.78 -36.53 82.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.841 0.353 . . . . 10.0 110.504 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -65.8 -51.06 62.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.134 -0.485 . . . . 10.0 109.785 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -61.24 -44.06 97.87 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.124 179.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -63.25 -47.45 82.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.042 179.191 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 2.4 m95 -63.06 -42.2 99.63 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.714 -0.221 . . . . 10.0 110.807 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -69.05 -41.46 77.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.803 0.335 . . . . 10.0 110.475 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 231' ' ' ASN . . . . . 0.505 ' ND2' ' HG3' ' C' ' 543' ' ' ARG . 17.3 t-20 -61.98 -45.08 95.19 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.352 -0.981 . . . . 10.0 108.352 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 65.4 mt -67.94 -32.76 73.43 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.382 -0.826 . . . . 10.0 110.118 178.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -60.52 -45.68 92.94 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 109.598 -0.519 . . . . 10.0 109.598 178.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 31.0 mttt -60.73 -42.57 97.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.33 178.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -66.14 -47.38 74.25 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.415 -0.811 . . . . 10.0 110.495 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 22.7 p -63.85 -38.19 90.18 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 116.873 -0.149 . . . . 10.0 111.317 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -63.66 -47.88 79.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.995 0.426 . . . . 10.0 109.908 179.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -61.58 -47.04 92.88 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 109.573 -1.411 . . . . 10.0 109.573 178.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 28.6 mt -59.98 -35.16 74.4 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 115.435 -0.383 . . . . 10.0 110.96 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 59.5 mtt180 -66.96 -42.14 85.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.934 0.397 . . . . 10.0 110.141 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -67.47 -43.25 81.45 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.108 -0.701 . . . . 10.0 109.108 178.374 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -64.42 -44.95 89.62 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 115.441 -0.799 . . . . 10.0 109.965 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 243' ' ' MET . . . . . 0.515 ' HA ' ' HB2' ' A' ' 246' ' ' ASP . 27.6 mmm -61.7 -30.48 70.78 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.337 179.1 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 70.7 m -63.91 -48.66 75.74 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 108.272 -1.01 . . . . 10.0 108.272 178.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -66.09 -44.55 84.07 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 246' ' ' ASP . . . . . 0.515 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.3 OUTLIER -54.07 -60.17 3.69 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 115.398 -0.819 . . . . 10.0 110.076 179.523 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 82.7 mt -61.64 -50.54 72.13 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.077 -0.51 . . . . 10.0 112.193 -179.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -57.28 -52.23 66.17 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.038 0.385 . . . . 10.0 112.038 -178.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -67.11 -42.19 84.94 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.63 0.233 . . . . 10.0 111.63 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 250' ' ' VAL . . . . . 0.511 HG22 ' HE1' ' C' ' 521' ' ' TYR . 24.5 t -65.37 -43.03 94.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.365 0 C-N-CA 121.156 -0.218 . . . . 10.0 111.215 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -66.6 -48.53 69.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.772 0.32 . . . . 10.0 110.806 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -60.28 -42.9 96.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.647 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -75.63 -29.06 59.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.41 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.459 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.8 OUTLIER -57.82 -31.85 41.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.593 179.623 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -60.75 -66.45 1.53 Allowed Pre-proline 0 N--CA 1.448 -0.525 0 CA-C-O 119.036 -0.506 . . . . 10.0 111.132 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.05 -31.95 83.79 Favored 'Trans proline' 0 C--N 1.357 0.998 0 C-N-CA 121.637 1.558 . . . . 10.0 112.053 178.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 257' ' ' TYR . . . . . 0.429 ' O ' ' HB2' ' A' ' 261' ' ' PHE . 5.5 m-30 -61.16 -50.3 73.74 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 120.741 0.305 . . . . 10.0 110.421 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 97.5 mt -80.63 -33.66 35.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.482 . . . . 10.0 111.179 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 259' ' ' ASP . . . . . 0.413 ' O ' ' HG3' ' A' ' 263' ' ' LYS . 15.1 t70 -64.31 -49.43 71.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.58 -0.282 . . . . 10.0 111.104 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -66.85 -39.19 87.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.06 0.457 . . . . 10.0 109.864 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 261' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' A' ' 257' ' ' TYR . 0.3 OUTLIER -64.35 -31.33 72.49 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.066 -0.716 . . . . 10.0 109.066 178.169 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -69.0 -40.81 78.48 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.006 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 263' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 259' ' ' ASP . 82.4 mttt -56.09 -48.05 76.87 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.093 -1.077 . . . . 10.0 108.093 178.246 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.413 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 14.5 mptt -63.86 -47.78 79.36 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.564 -1.198 . . . . 10.0 110.157 179.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -37.22 75.53 Favored 'General case' 0 N--CA 1.464 0.239 0 O-C-N 123.314 0.384 . . . . 10.0 111.204 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -62.99 -49.64 73.87 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.995 -0.743 . . . . 10.0 108.995 178.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -63.47 -38.35 90.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 10.0 109.667 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 268' ' ' GLU . . . . . 0.526 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 22.5 mt-10 -60.47 -52.93 63.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.522 179.114 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 81.0 mmm -66.18 -42.69 88.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.473 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -65.15 -48.73 72.5 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.549 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 45.5 mt -64.59 -35.85 82.31 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 272' ' ' TYR . . . . . 0.526 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 15.1 t80 -62.13 -49.93 73.9 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 54.8 mtt85 -65.34 -41.21 94.14 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.709 0.29 . . . . 10.0 110.415 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.39 -31.67 67.89 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.488 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.722 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 56.4 mttp -90.5 -42.25 10.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.021 178.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 276' ' ' VAL . . . . . 0.441 ' O ' ' HB2' ' A' ' 280' ' ' ARG . 5.6 t -53.53 -44.73 57.5 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.404 0 N-CA-C 112.255 0.465 . . . . 10.0 112.255 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -53.66 -62.0 4.34 Favored Pre-proline 0 CA--C 1.542 0.646 0 N-CA-C 112.556 0.576 . . . . 10.0 112.556 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 278' ' ' PRO . . . . . 0.506 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 29.3 Cg_endo -65.56 -36.84 31.93 Favored 'Trans proline' 0 C--N 1.353 0.816 0 C-N-CA 121.906 1.737 . . . . 10.0 112.287 178.39 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.868 HD22 ' HG2' ' C' ' 495' ' ' LYS . 58.1 mt -65.14 -34.22 77.87 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.098 0.475 . . . . 10.0 109.969 179.51 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 280' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 26.2 ttt180 -70.21 -35.13 73.69 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 108.065 -1.087 . . . . 10.0 108.065 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.75 -40.77 95.85 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.189 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 282' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 74.0 mt-10 -62.96 -43.04 99.89 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.704 -0.85 . . . . 10.0 108.704 178.056 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 63.9 mt -63.36 -37.62 87.99 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.429 -0.805 . . . . 10.0 109.918 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -68.3 -50.69 51.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.442 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -60.98 -43.53 98.67 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.37 -44.63 96.56 Favored Glycine 0 N--CA 1.438 -1.176 0 N-CA-C 110.486 -1.046 . . . . 10.0 110.486 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.82 -37.98 86.43 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 110.545 -0.169 . . . . 10.0 110.545 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -60.66 -42.26 96.66 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.765 -0.457 . . . . 10.0 109.765 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 11.1 tm0? -70.89 -49.82 41.72 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.751 -0.658 . . . . 10.0 109.713 178.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 46.8 mttt -56.68 -41.24 76.98 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.836 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 17.6 mt -70.52 -39.28 74.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.399 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.07 -41.23 99.4 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.4 -34.44 75.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.664 178.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 86.5 mt -75.51 -42.15 53.5 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.441 -0.799 . . . . 10.0 109.55 178.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -62.12 -39.19 91.7 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.393 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -77.5 14.98 0.86 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.745 178.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 297' ' ' LYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 23.8 mttp -133.07 -42.14 0.89 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.49 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 298' ' ' LEU . . . . . 0.41 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 93.3 mt -58.05 -32.67 68.23 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.361 179.606 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 299' ' ' SER . . . . . 0.434 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 3.1 m -82.57 -62.32 0.31 Allowed Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 300' ' ' PRO . . . . . 0.434 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 18.1 Cg_endo -60.46 -49.92 8.02 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 121.832 1.688 . . . . 10.0 112.597 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.5 HD13 ' HG2' ' C' ' 473' ' ' LYS . 98.2 mt -75.8 -13.12 60.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.006 0.431 . . . . 10.0 110.271 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 302' ' ' GLY . . . . . 0.41 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -83.63 -47.92 5.46 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 109.815 -1.314 . . . . 10.0 109.815 178.164 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 57.5 mt-10 -61.1 -44.94 96.59 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 304' ' ' GLU . . . . . 0.518 ' O ' ' HG3' ' A' ' 308' ' ' ARG . 1.9 mt-10 -64.4 -39.15 93.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.366 179.243 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 305' ' ' MET . . . . . 0.461 ' SD ' ' HE3' ' C' ' 473' ' ' LYS . 16.2 tpt -64.28 -39.3 93.65 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.228 -0.656 . . . . 10.0 109.228 178.477 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 306' ' ' ARG . . . . . 0.434 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 91.9 mtt180 -70.29 -39.83 74.62 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.284 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 307' ' ' ASP . . . . . 0.666 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 28.2 t70 -65.07 -43.71 91.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.958 0.408 . . . . 10.0 110.432 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 308' ' ' ARG . . . . . 1.13 ' CD ' HD21 ' C' ' 469' ' ' LEU . 11.7 mtp180 -69.92 -28.67 65.79 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.255 -0.646 . . . . 10.0 109.255 178.132 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 309' ' ' ALA . . . . . 0.629 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -71.81 -29.82 64.84 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 177.608 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 310' ' ' ARG . . . . . 0.666 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 77.9 mtt180 -62.58 -52.96 61.35 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.437 -0.949 . . . . 10.0 108.437 178.152 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -64.18 -35.36 80.53 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 312' ' ' HIS . . . . . 0.629 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.1 OUTLIER -57.08 -56.77 17.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.452 -0.794 . . . . 10.0 110.243 179.01 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 47.6 t -75.65 -39.69 39.76 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 CA-C-N 115.731 -0.668 . . . . 10.0 112.15 -179.114 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 314' ' ' ASP . . . . . 0.624 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 0.2 OUTLIER -59.96 -51.0 71.56 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 122.419 -0.176 . . . . 10.0 111.111 179.99 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -64.23 -26.43 68.5 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.351 -0.611 . . . . 10.0 109.351 178.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 316' ' ' LEU . . . . . 0.859 ' HG ' ' HE3' ' C' ' 462' ' ' LYS . 5.2 mt -71.79 -37.75 70.38 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.624 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 79.7 mtt180 -63.27 -49.94 72.12 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.32 -11.83 45.74 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.779 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -98.34 -41.58 7.77 Favored 'General case' 0 C--O 1.223 -0.331 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 178.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 320' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 316' ' ' LEU . 86.4 mt -65.6 -34.24 77.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.973 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 321' ' ' ALA . . . . . 0.412 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -55.31 -61.66 5.67 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.498 -0.319 . . . . 10.0 111.587 179.435 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.412 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 33.8 Cg_endo -66.86 -30.06 40.85 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.597 1.531 . . . . 10.0 111.541 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -63.79 -50.35 69.33 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 110.023 -0.362 . . . . 10.0 110.023 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 324' ' ' SER . . . . . 0.497 ' HA ' ' HB2' ' A' ' 327' ' ' LEU . 18.7 p -70.64 -34.54 72.17 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 110.181 -0.304 . . . . 10.0 110.181 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -59.05 -53.84 53.82 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -70.09 -29.41 66.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.69 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 327' ' ' LEU . . . . . 0.497 ' HB2' ' HA ' ' A' ' 324' ' ' SER . 9.3 mt -63.2 -39.13 93.74 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.422 -0.585 . . . . 10.0 109.422 178.224 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 38.3 mtt180 -64.56 -35.26 80.4 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 109.492 -0.559 . . . . 10.0 109.492 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -69.84 -45.63 67.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.832 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 330' ' ' ARG . . . . . 0.537 ' HD3' ' OD2' ' C' ' 444' ' ' ASP . 9.6 ttm180 -63.5 -44.54 94.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.785 -0.643 . . . . 10.0 109.879 179.34 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 60.2 mt -65.31 -36.93 85.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.046 178.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -64.43 -44.84 89.91 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.22 -0.659 . . . . 10.0 109.22 178.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -60.45 -44.42 95.84 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.944 178.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 334' ' ' ARG . . . . . 0.488 ' HA ' ' HG2' ' C' ' 440' ' ' GLU . 3.6 mtt180 -63.33 -52.14 63.09 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-N 115.773 -0.648 . . . . 10.0 110.335 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 79.5 mt -60.25 -36.73 78.43 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.853 0.358 . . . . 10.0 111.054 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 336' ' ' GLU . . . . . 0.683 ' HA ' ' HE3' ' A' ' 339' ' ' LYS . 36.0 tt0 -67.39 -44.39 78.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.243 179.303 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.51 -46.66 72.22 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 338' ' ' LEU . . . . . 0.534 ' HA ' ' HB3' ' A' ' 341' ' ' ASN . 82.8 mt -63.99 -19.54 65.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.16 179.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 339' ' ' LYS . . . . . 0.683 ' HE3' ' HA ' ' A' ' 336' ' ' GLU . 12.9 ttmt -67.56 -48.15 67.77 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.671 -0.863 . . . . 10.0 108.671 178.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -77.87 -41.99 34.94 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 341' ' ' ASN . . . . . 0.664 HD21 ' HA ' ' C' ' 433' ' ' GLU . 27.7 t-20 -56.93 -48.97 77.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.804 -1.089 . . . . 10.0 109.629 179.282 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -76.77 -35.79 39.04 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.496 -0.775 . . . . 10.0 111.693 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.25 -47.94 88.6 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.761 -0.733 . . . . 10.0 111.329 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 344' ' ' ALA . . . . . 0.532 ' O ' ' HG2' ' A' ' 348' ' ' GLU . . . -66.97 -38.78 86.71 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 -61.43 -41.71 97.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.116 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 75.6 mt -63.4 -40.9 98.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.905 -0.589 . . . . 10.0 109.725 179.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -65.47 -41.08 93.72 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 348' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 344' ' ' ALA . 75.5 mm-40 -60.48 -53.28 59.4 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.575 -0.739 . . . . 10.0 109.537 178.617 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -63.92 -28.92 70.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.444 -0.798 . . . . 10.0 111.636 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.91 -50.42 29.29 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.112 -0.329 . . . . 10.0 110.112 179.05 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.99 98.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.957 0.408 . . . . 10.0 110.09 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 352' ' ' LYS . . . . . 0.595 ' HG2' HG22 ' C' ' 422' ' ' VAL . 8.1 mtmm -70.13 -23.55 63.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.066 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -70.09 -39.69 75.4 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -38.3 90.58 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.04 -0.726 . . . . 10.0 109.04 178.563 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -66.87 -38.0 85.5 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.18 -0.674 . . . . 10.0 109.18 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -62.68 -49.49 74.93 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 115.623 -0.717 . . . . 10.0 109.494 178.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 84.5 mt -61.13 -39.65 90.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.343 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 358' ' ' SER . . . . . 0.415 ' O ' ' HG3' ' A' ' 362' ' ' GLU . 50.3 m -63.46 -52.87 59.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.534 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 359' ' ' THR . . . . . 0.43 ' HA ' ' OE1' ' A' ' 362' ' ' GLU . 3.2 p -67.15 -26.0 66.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.206 0.527 . . . . 10.0 110.751 179.564 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 20.6 tp -74.11 -37.63 64.07 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 72.6 m -64.63 -29.88 70.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.11 0.481 . . . . 10.0 109.982 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 362' ' ' GLU . . . . . 0.43 ' OE1' ' HA ' ' A' ' 359' ' ' THR . 46.4 mt-10 -70.05 -7.54 42.02 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.122 178.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.476 ' HD3' HG23 ' C' ' 411' ' ' THR . 34.0 mttp -115.92 -32.87 5.29 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.709 -0.678 . . . . 10.0 109.356 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.38 -24.78 63.01 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.664 -0.698 . . . . 10.0 111.105 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.905 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 94.9 mttt -106.79 -71.72 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 112.134 0.42 . . . . 10.0 112.134 179.078 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.905 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 39.4 Cg_exo -59.11 -53.87 3.22 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 122.194 1.93 . . . . 10.0 113.028 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 367' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -62.77 -48.16 80.36 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.824 0.305 . . . . 10.0 111.824 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 368' ' ' LEU . . . . . 0.546 HD23 HD12 ' A' ' 371' ' ' LEU . 9.9 mt -62.04 -37.29 84.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.804 0.335 . . . . 10.0 110.731 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 369' ' ' GLU . . . . . 0.643 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 41.9 tt0 -65.35 -44.62 87.11 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 178.478 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.51 -37.61 88.15 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 371' ' ' LEU . . . . . 0.546 HD12 HD23 ' A' ' 368' ' ' LEU . 42.0 mt -63.32 -43.6 97.34 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.195 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 57.7 mtt180 -64.93 -38.21 90.22 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 108.359 -0.978 . . . . 10.0 108.359 178.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.643 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.5 mt-30 -65.61 -21.57 66.59 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.205 -0.907 . . . . 20.0 112.157 179.155 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -93.15 -37.35 5.69 Favored Glycine 0 CA--C 1.523 0.594 0 N-CA-C 108.75 -1.74 . . . . 10.0 108.75 178.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 49.1 mt -59.45 -37.8 79.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.811 -0.195 . . . . 10.0 111.433 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 75.8 mt -56.09 -62.43 4.75 Favored Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 112.038 0.384 . . . . 10.0 112.038 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -64.1 -34.81 56.44 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 121.983 1.789 . . . . 10.0 112.037 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 25.3 t -63.66 -54.57 30.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.517 0.199 . . . . 10.0 110.811 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 36.3 mt -63.35 -35.84 81.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.637 0.256 . . . . 10.0 110.921 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 380' ' ' GLU . . . . . 0.467 ' O ' HG23 ' A' ' 384' ' ' VAL . 14.1 tt0 -64.5 -51.01 65.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.554 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 12.6 p -65.28 -36.95 85.68 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.768 0.318 . . . . 10.0 110.879 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -68.31 -36.24 79.02 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.69 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 49.6 mttt -65.8 -37.2 85.63 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.682 -0.488 . . . . 10.0 109.682 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 384' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 380' ' ' GLU . 87.2 t -63.49 -44.24 98.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.084 178.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.35 -37.91 71.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.086 -0.507 . . . . 10.0 110.907 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 386' ' ' PHE . . . . . 0.459 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 1.6 m-85 -67.68 -45.9 73.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.516 -0.311 . . . . 10.0 111.139 179.515 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 34.6 mt -59.97 -45.38 92.88 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.998 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 77.4 p -70.76 -28.86 65.0 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.715 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -69.2 -38.45 78.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.087 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 390' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 95.8 mt -57.51 -40.98 79.92 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.478 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -60.63 -46.02 91.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.667 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 392' ' ' GLU . . . . . 0.681 ' HA ' ' HD2' ' A' ' 395' ' ' LYS . 0.0 OUTLIER -61.68 -41.51 97.67 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.341 -0.845 . . . . 10.0 111.666 -179.58 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -60.85 -44.29 97.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.063 0.459 . . . . 10.0 109.788 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 8.9 m -60.46 -39.3 87.08 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.487 -0.779 . . . . 10.0 111.45 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 395' ' ' LYS . . . . . 0.681 ' HD2' ' HA ' ' A' ' 392' ' ' GLU . 87.2 mttt -60.88 -28.45 68.89 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.738 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.18 -20.26 28.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.858 0.361 . . . . 10.0 111.618 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 76.7 mt -85.23 -50.07 7.68 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.127 -0.488 . . . . 10.0 109.949 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 30.6 p30 . . . . . 0 N--CA 1.466 0.339 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.215 179.729 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 41.0 tp . . . . . 0 C--O 1.231 0.128 0 CA-C-O 121.219 0.533 . . . . 10.0 109.563 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -74.64 -27.14 60.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.412 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 11.3 mt -61.23 -27.1 68.2 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.799 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 77.0 mt -62.61 -42.09 99.38 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -71.03 -31.75 68.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.962 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 404' ' ' ASN . . . . . 0.489 ' O ' HG23 ' C' ' 408' ' ' VAL . 14.5 t-20 -64.88 -48.23 75.0 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.637 -0.875 . . . . 10.0 108.637 178.076 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 47.4 m0 -63.72 -37.01 85.75 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.522 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.18 -45.61 87.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.551 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 31.0 m -63.81 -36.63 84.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.738 -0.664 . . . . 10.0 109.997 178.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 408' ' ' VAL . . . . . 0.489 HG23 ' O ' ' C' ' 404' ' ' ASN . 89.3 t -67.46 -33.74 64.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 24.2 m -66.17 -40.17 90.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.736 -0.665 . . . . 10.0 109.215 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 410' ' ' SER . . . . . 0.446 ' O ' ' HG2' ' C' ' 414' ' ' LYS . 7.4 m -66.78 -37.17 84.04 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.494 -0.928 . . . . 10.0 108.494 177.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 411' ' ' THR . . . . . 0.476 HG23 ' HD3' ' A' ' 363' ' ' LYS . 76.6 m -63.18 -44.32 95.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.158 -0.928 . . . . 10.0 109.671 178.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 412' ' ' PHE . . . . . 0.438 ' HA ' HD12 ' C' ' 415' ' ' LEU . 1.1 m-85 -61.26 -38.35 86.41 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.306 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 32.2 m -62.33 -41.84 98.89 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.802 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 414' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' C' ' 410' ' ' SER . 73.4 mmtt -66.11 -31.86 72.97 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.778 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 415' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' C' ' 411' ' ' THR . 95.4 mt -69.16 -40.23 78.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.059 -0.519 . . . . 10.0 109.688 178.643 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -66.55 -44.85 81.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.338 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -64.92 -25.61 67.95 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.956 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 418' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' C' ' 414' ' ' LYS . 0.0 OUTLIER -79.22 -51.86 8.91 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.69 179.213 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 84.4 mt -52.69 -40.0 62.51 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.637 -0.711 . . . . 10.0 112.523 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -48.24 -79.3 0.07 OUTLIER Glycine 0 CA--C 1.523 0.543 0 O-C-N 123.6 0.563 . . . . 10.0 113.679 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -60.14 -35.87 90.8 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.621 2.214 . . . . 10.0 112.212 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 422' ' ' VAL . . . . . 0.595 HG22 ' HG2' ' A' ' 352' ' ' LYS . 35.9 t -60.56 -49.49 84.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 N-CA-C 112.132 0.419 . . . . 10.0 112.132 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 51.5 p -70.39 -34.58 72.74 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 121.097 -0.241 . . . . 10.0 111.118 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -60.13 -50.6 73.03 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -74.09 -24.72 59.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.511 179.195 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 426' ' ' PHE . . . . . 0.431 ' HB2' ' O ' ' C' ' 422' ' ' VAL . 48.8 t80 -68.59 -46.14 70.16 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.276 -0.639 . . . . 10.0 109.276 178.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -37.35 87.09 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 108.72 -0.844 . . . . 10.0 108.72 178.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -64.5 -44.45 90.91 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.63 -0.878 . . . . 10.0 108.63 177.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.88 -37.06 86.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.495 178.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 44.7 mt -63.13 -41.06 99.25 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 431' ' ' GLU . . . . . 0.539 ' HA ' ' OG1' ' C' ' 434' ' ' THR . 4.7 mm-40 -68.18 -35.06 77.42 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.969 -0.559 . . . . 10.0 110.403 178.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 38.0 mttp -62.56 -36.65 83.32 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.861 -1.163 . . . . 10.0 107.861 177.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 433' ' ' GLU . . . . . 0.664 ' HA ' HD21 ' A' ' 341' ' ' ASN . 38.2 tt0 -69.66 -48.75 58.71 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 114.96 -1.018 . . . . 10.0 110.172 179.115 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 434' ' ' THR . . . . . 0.539 ' OG1' ' HA ' ' C' ' 431' ' ' GLU . 0.3 OUTLIER -64.2 -36.01 82.67 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 116.792 -0.185 . . . . 10.0 110.736 179.727 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -63.93 -35.12 79.62 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.686 -0.487 . . . . 10.0 109.686 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -69.38 -45.39 60.75 Favored Glycine 0 N--CA 1.445 -0.748 0 N-CA-C 108.807 -1.717 . . . . 10.0 108.807 177.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 87.5 mt -64.32 -24.6 67.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.373 -0.413 . . . . 10.0 110.796 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 39.8 mtt180 -74.77 -3.49 31.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.24 0.543 . . . . 10.0 110.341 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -118.04 -38.37 3.23 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.112 -1.069 . . . . 10.0 108.112 177.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 440' ' ' GLU . . . . . 0.488 ' HG2' ' HA ' ' A' ' 334' ' ' ARG . 40.3 mt-10 -72.22 -59.8 2.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.092 -0.958 . . . . 10.0 110.73 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 441' ' ' MET . . . . . 0.46 ' HA ' ' HB3' ' C' ' 444' ' ' ASP . 93.3 mmm -66.43 -31.35 72.05 Favored 'General case' 0 C--O 1.225 -0.236 0 N-CA-C 112.908 0.706 . . . . 10.0 112.908 -178.269 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.3 p -62.66 -52.08 64.73 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 179.195 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -66.73 -40.23 88.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.996 -0.742 . . . . 10.0 108.996 178.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 444' ' ' ASP . . . . . 0.537 ' OD2' ' HD3' ' A' ' 330' ' ' ARG . 15.5 t70 -55.07 -53.83 50.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.705 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 445' ' ' LEU . . . . . 0.505 ' HA ' HG12 ' C' ' 448' ' ' VAL . 96.6 mt -63.88 -47.09 82.01 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.552 0.575 . . . . 10.0 112.552 -179.445 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -65.31 -38.46 90.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.903 0.382 . . . . 10.0 110.999 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 447' ' ' GLU . . . . . 0.486 ' O ' ' HG2' ' C' ' 451' ' ' LYS . 0.8 OUTLIER -72.79 -42.56 63.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.447 179.295 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 448' ' ' VAL . . . . . 0.505 HG12 ' HA ' ' C' ' 445' ' ' LEU . 2.3 p -65.55 -35.59 75.62 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.189 0 CA-C-N 116.656 -0.247 . . . . 10.0 110.981 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -66.0 -37.76 86.74 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.779 -0.823 . . . . 10.0 108.779 178.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -72.98 -11.46 60.58 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.322 -0.854 . . . . 10.0 110.033 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 451' ' ' LYS . . . . . 0.486 ' HG2' ' O ' ' C' ' 447' ' ' GLU . 35.9 mmtm -94.66 -40.16 9.96 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.214 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 452' ' ' VAL . . . . . 0.478 HG23 ' O ' ' C' ' 448' ' ' VAL . 59.5 t -59.62 -42.25 87.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.727 -0.67 . . . . 10.0 111.654 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 453' ' ' GLN . . . . . 0.892 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 18.5 mt-30 -54.32 -61.54 5.35 Favored Pre-proline 0 CA--C 1.537 0.468 0 O-C-N 122.97 0.169 . . . . 10.0 111.403 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 454' ' ' PRO . . . . . 0.892 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 23.9 Cg_exo -66.78 -28.99 42.99 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 122.171 1.914 . . . . 10.0 111.605 178.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -64.49 -52.02 60.01 Favored 'General case' 0 C--O 1.222 -0.367 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 43.3 mt -65.64 -43.52 89.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.358 179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -58.72 -51.45 69.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.99 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -71.97 -32.17 67.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.766 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 459' ' ' PHE . . . . . 0.528 ' HZ ' ' H39' ' A' ' 73' ' ' 17F . 50.9 t80 -67.7 -48.03 67.7 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -68.04 -29.58 68.6 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 461' ' ' LYS . . . . . 0.406 ' HB2' ' HE3' ' C' ' 461' ' ' LYS . 5.0 ttmt -65.23 -46.69 79.6 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.539 -0.911 . . . . 10.0 108.539 177.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 462' ' ' LYS . . . . . 0.859 ' HE3' ' HG ' ' A' ' 316' ' ' LEU . 19.2 mttm -69.37 -38.75 78.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.432 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 463' ' ' TRP . . . . . 0.426 ' O ' ' HB2' ' C' ' 467' ' ' MET . 0.0 OUTLIER -62.75 -31.8 72.82 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 178.628 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -69.77 -45.59 67.69 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 0.832 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 59.2 mt-10 -55.66 -43.55 76.39 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.208 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 466' ' ' GLU . . . . . 0.458 ' HA ' HD12 ' C' ' 469' ' ' LEU . 19.3 mt-10 -73.47 -34.1 65.19 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 115.275 -0.875 . . . . 10.0 110.884 179.36 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 467' ' ' MET . . . . . 0.426 ' HB2' ' O ' ' C' ' 463' ' ' TRP . 0.0 OUTLIER -62.45 -42.32 99.38 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.553 -0.906 . . . . 10.0 108.553 178.619 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -66.1 -47.21 74.97 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 107.894 -1.15 . . . . 10.0 107.894 177.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 1.13 HD21 ' CD ' ' A' ' 308' ' ' ARG . 96.2 mt -55.82 -44.62 78.05 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 115.217 -0.901 . . . . 20.0 111.489 178.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -62.6 -41.44 98.97 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 116.361 -0.381 . . . . 10.0 110.135 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 27.0 mtm180 -69.84 -36.93 75.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.964 0.412 . . . . 10.0 110.528 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -79.97 2.76 22.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.092 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 473' ' ' LYS . . . . . 0.5 ' HG2' HD13 ' A' ' 301' ' ' LEU . 29.3 mttm -120.51 -57.71 1.89 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.367 -0.378 . . . . 10.0 110.55 178.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 474' ' ' VAL . . . . . 0.576 HG13 ' H74' ' A' ' 76' ' ' 17F . 84.0 t -62.47 -42.77 97.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 112.752 0.649 . . . . 10.0 112.752 -179.022 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -61.28 -58.19 20.57 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 112.378 0.51 . . . . 10.0 112.378 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -60.48 -33.86 93.48 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 121.663 1.575 . . . . 10.0 110.51 178.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 12.2 mt -66.61 -44.11 82.96 Favored 'General case' 0 C--O 1.213 -0.828 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.315 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 478' ' ' ARG . . . . . 0.474 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 65.4 mtt180 -54.89 -41.39 70.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.886 0.374 . . . . 10.0 110.177 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -67.48 -56.78 8.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.523 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 480' ' ' GLU . . . . . 0.421 ' CD ' ' HZ1' ' A' ' 297' ' ' LYS . 0.1 OUTLIER -67.64 -34.61 77.32 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.148 0.796 . . . . 10.0 113.148 -179.211 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 30.5 mt -68.6 -35.26 77.09 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.331 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 482' ' ' GLN . . . . . 0.474 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 8.1 mt-30 -69.95 -36.84 75.59 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 177.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -67.8 -41.26 83.41 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.609 -0.886 . . . . 10.0 108.609 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -67.58 -35.04 85.62 Favored Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 110.061 -1.215 . . . . 10.0 110.061 177.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -70.32 -38.41 74.92 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 45.8 mtt180 -64.57 -39.4 93.68 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 108.484 -0.932 . . . . 10.0 108.484 177.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 487' ' ' GLN . . . . . 0.463 ' O ' ' HG3' ' C' ' 491' ' ' GLU . 10.9 mm-40 -63.81 -48.65 75.98 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.801 -0.815 . . . . 10.0 108.801 177.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -64.8 -35.83 82.37 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.583 179.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 17.4 mt -68.37 -43.27 77.73 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 178.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -62.04 -40.82 97.05 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 107.496 -1.298 . . . . 10.0 107.496 178.149 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 491' ' ' GLU . . . . . 0.725 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 30.6 mt-10 -60.59 -59.63 5.09 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.448 -0.945 . . . . 10.0 108.448 177.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 80.8 mt -52.04 -50.95 60.45 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 115.52 -0.764 . . . . 10.0 112.468 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -61.57 -41.77 97.87 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.689 0.255 . . . . 10.0 111.689 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -75.05 -12.98 60.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.674 0.273 . . . . 10.0 111.429 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.868 ' HG2' HD22 ' A' ' 279' ' ' LEU . 13.5 mttm -97.09 -44.09 7.12 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 178.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 95.1 mt -71.11 -29.66 65.54 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.937 0.717 . . . . 10.0 112.937 -179.096 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 49.3 m -61.21 -60.4 10.69 Favored Pre-proline 0 CA--C 1.537 0.462 0 C-N-CA 120.422 -0.511 . . . . 10.0 111.327 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -65.0 -35.38 43.32 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 121.717 1.611 . . . . 10.0 111.074 178.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 16.2 mt -67.91 -35.35 78.31 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 116.334 -0.393 . . . . 10.0 110.461 179.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -65.43 -45.3 90.95 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.212 -1.155 . . . . 10.0 110.212 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -64.41 -42.88 95.82 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 502' ' ' GLU . . . . . 0.497 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 23.2 tt0 -62.31 -43.83 97.91 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.586 178.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 503' ' ' MET . . . . . 0.524 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 65.8 mmm -62.29 -38.04 87.84 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.135 -0.484 . . . . 10.0 109.826 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 89.9 mtt180 -63.99 -42.46 97.19 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.45 -41.64 88.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.711 -0.677 . . . . 10.0 109.763 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.524 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 46.5 mtt180 -62.23 -43.49 98.71 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 108.586 -0.894 . . . . 10.0 108.586 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -61.53 -44.22 97.45 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.236 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 508' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' C' ' 508' ' ' ARG . 50.6 mtt180 -63.65 -42.02 98.17 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -75.9 10.91 1.59 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.192 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 510' ' ' HIS . . . . . 0.41 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 2.5 m-70 -128.97 -55.68 1.2 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.718 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 79.9 t -69.17 -46.41 77.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.826 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.646 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 13.6 t70 -66.81 -35.64 80.52 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 179.044 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.81 -39.2 90.67 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.052 -1.092 . . . . 10.0 108.052 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 514' ' ' LEU . . . . . 0.729 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 32.3 mt -68.67 -23.2 64.37 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.314 178.516 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 515' ' ' ARG . . . . . 0.646 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 68.2 mtt180 -64.68 -39.82 94.33 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.641 -0.874 . . . . 10.0 108.641 178.015 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -93.19 7.9 42.39 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.474 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 517' ' ' HIS . . . . . 0.729 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 32.3 m170 -113.74 -53.07 2.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.037 -0.528 . . . . 10.0 111.011 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 95.8 mt -77.42 -34.56 54.66 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.7 0.63 . . . . 10.0 112.7 -178.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -57.27 -57.18 26.66 Favored Pre-proline 0 CA--C 1.532 0.26 0 C-N-CA 120.52 -0.472 . . . . 10.0 110.945 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -67.48 -28.84 38.22 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 121.403 1.402 . . . . 10.0 110.628 178.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 521' ' ' TYR . . . . . 0.581 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 19.9 t80 -63.76 -48.38 77.22 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.004 179.588 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 9.1 p -71.01 -29.97 66.07 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.625 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -68.08 -44.0 77.26 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.958 -0.756 . . . . 10.0 108.958 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -66.15 -44.13 85.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.089 177.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 37.7 mt -61.64 -38.36 87.42 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 115.852 -0.613 . . . . 10.0 109.836 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -61.81 -38.99 90.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.141 -0.481 . . . . 10.0 109.911 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -67.81 -39.66 83.93 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 178.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 62.6 mtt180 -68.6 -37.2 79.6 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 178.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 75.0 mt -69.49 -34.98 75.12 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.124 -0.695 . . . . 10.0 109.124 178.02 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 530' ' ' ALA . . . . . 0.47 ' O ' ' HG2' ' C' ' 534' ' ' GLU . . . -64.04 -45.5 88.58 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 178.357 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.33 -40.88 98.54 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 178.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 8.2 ttm180 -60.97 -40.67 94.28 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.273 -0.876 . . . . 10.0 108.884 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 74.7 mt -68.53 -36.15 78.45 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.114 178.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 534' ' ' GLU . . . . . 0.483 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 5.6 mm-40 -59.38 -44.02 92.82 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 178.525 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -68.25 -46.56 70.13 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.356 -0.838 . . . . 10.0 109.445 178.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 58.6 mt -58.57 -30.05 66.87 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.393 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 537' ' ' LYS . . . . . 0.483 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 49.1 mtmt -74.89 -49.85 18.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.66 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -67.02 -49.57 64.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.861 0.362 . . . . 10.0 110.943 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 539' ' ' ASN . . . . . 0.44 ' HB3' ' OD1' ' A' ' 231' ' ' ASN . 88.8 m-20 -66.0 -36.6 83.74 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -67.52 -41.8 89.69 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 110.853 -0.899 . . . . 10.0 110.853 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -63.94 -37.65 94.93 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 110.215 -1.154 . . . . 10.0 110.215 178.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -67.89 -44.9 75.93 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.614 -0.884 . . . . 10.0 108.614 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 543' ' ' ARG . . . . . 0.505 ' HG3' ' ND2' ' A' ' 231' ' ' ASN . 34.3 mtt180 -56.77 -39.98 75.01 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 115.522 -0.763 . . . . 10.0 110.542 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 544' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' C' ' 548' ' ' HIS . 81.7 mt -62.61 -41.29 98.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.408 179.14 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -69.47 -45.08 69.86 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.457 -0.571 . . . . 10.0 109.457 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -59.84 -49.33 78.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.097 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -64.0 -39.21 93.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.985 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 548' ' ' HIS . . . . . 0.49 ' HB2' ' O ' ' C' ' 544' ' ' LEU . 1.7 t-80 -65.68 -42.96 90.66 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.172 0.511 . . . . 10.0 110.314 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -64.52 -51.82 60.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.616 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -33.77 74.57 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.373 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.41 -45.94 88.69 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.392 -0.595 . . . . 10.0 109.392 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 4.4 m -66.49 -38.1 86.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.726 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -68.96 -25.97 64.81 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.605 -0.725 . . . . 10.0 110.649 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 554' ' ' HIS . . . . . 0.466 ' HA ' ' OG1' ' C' ' 557' ' ' THR . 3.2 m-70 -87.5 -34.24 18.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.766 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 49.0 mt -63.6 -32.45 73.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.856 0.36 . . . . 10.0 110.413 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 1.1 p -76.4 -41.32 48.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.117 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 557' ' ' THR . . . . . 0.649 HG22 ' HD2' ' A' ' 216' ' ' LYS . 2.1 p -73.88 -12.75 60.76 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.336 0.588 . . . . 10.0 110.853 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 28.8 mt -91.31 -39.61 11.95 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.056 -0.72 . . . . 10.0 109.056 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 559' ' ' SER . . . . . 0.469 ' HA ' ' HB3' ' C' ' 562' ' ' ALA . 2.5 p -69.46 -24.88 63.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.784 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 560' ' ' GLU . . . . . 0.513 ' HG3' ' HD3' ' C' ' 561' ' ' LYS . 7.6 pt-20 -64.11 -19.97 65.64 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.337 0.589 . . . . 10.0 109.967 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 561' ' ' LYS . . . . . 0.513 ' HD3' ' HG3' ' C' ' 560' ' ' GLU . 13.2 mptt -114.53 -29.77 6.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.222 178.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 562' ' ' ALA . . . . . 0.469 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -73.8 -5.7 42.45 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.143 0.423 . . . . 10.0 112.143 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 563' ' ' LYS . . . . . 0.922 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 87.8 mttt -119.87 -70.11 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.583 0 CA-C-O 119.446 -0.312 . . . . 10.0 111.323 178.693 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 564' ' ' PRO . . . . . 0.922 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 32.4 Cg_exo -61.6 -51.72 3.83 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.08 1.853 . . . . 10.0 112.242 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 565' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -63.6 -40.73 97.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.463 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 566' ' ' LEU . . . . . 0.514 HD23 HD12 ' C' ' 569' ' ' LEU . 6.9 mt -63.96 -41.79 97.47 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 110.063 -0.347 . . . . 10.0 110.063 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 567' ' ' GLU . . . . . 0.706 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 36.9 mt-10 -63.56 -38.55 91.54 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 178.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.31 -38.77 81.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.153 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 569' ' ' LEU . . . . . 0.514 HD12 HD23 ' C' ' 566' ' ' LEU . 36.4 mt -62.55 -41.01 98.63 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -68.84 -30.92 69.56 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.468 -0.567 . . . . 10.0 109.468 178.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 571' ' ' GLN . . . . . 0.706 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.9 mt-30 -70.63 -14.42 62.47 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.337 -0.847 . . . . 20.0 110.47 178.303 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -98.6 -37.6 4.19 Favored Glycine 0 CA--C 1.523 0.568 0 N-CA-C 108.659 -1.776 . . . . 10.0 108.659 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 73.5 mt -56.34 -45.03 80.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.529 -0.335 . . . . 10.0 111.602 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 86.8 mt -56.97 -62.0 5.96 Favored Pre-proline 0 CA--C 1.537 0.448 0 N-CA-C 112.508 0.559 . . . . 10.0 112.508 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -61.22 -36.97 77.52 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 121.964 1.776 . . . . 10.0 111.948 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 9.6 t -64.38 -45.34 96.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.637 0.256 . . . . 10.0 110.372 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 29.8 mt -62.75 -38.0 88.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.777 0.322 . . . . 10.0 110.145 179.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 578' ' ' GLU . . . . . 0.426 ' O ' HG23 ' C' ' 582' ' ' VAL . 62.4 mt-10 -65.72 -48.55 71.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.176 178.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 26.9 m -63.41 -39.91 95.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.152 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -65.91 -38.31 88.37 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 178.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 581' ' ' LYS . . . . . 0.445 ' O ' ' HG ' ' C' ' 585' ' ' LEU . 64.6 mttt -61.73 -39.49 91.72 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.858 -0.61 . . . . 10.0 109.744 178.683 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 582' ' ' VAL . . . . . 0.426 HG23 ' O ' ' C' ' 578' ' ' GLU . 69.6 t -59.8 -48.83 86.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 108.82 -0.808 . . . . 10.0 108.82 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 12.0 m -61.47 -41.98 98.07 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.386 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -63.47 -47.37 82.08 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.082 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 585' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' C' ' 581' ' ' LYS . 80.1 mt -57.9 -46.28 85.17 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.306 -0.407 . . . . 10.0 110.406 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 14.7 m -65.33 -44.53 87.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.216 179.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -58.03 -50.5 73.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.285 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.5 mt -56.63 -44.65 81.44 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 116.185 -0.462 . . . . 10.0 110.816 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -63.61 -52.55 60.39 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.065 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 590' ' ' GLU . . . . . 0.431 ' HA ' ' HE2' ' C' ' 593' ' ' LYS . 55.9 mt-10 -58.78 -39.33 80.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.897 -0.592 . . . . 10.0 112.234 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -73.26 -44.13 59.87 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.001 0.371 . . . . 10.0 112.001 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 14.2 p -64.75 -27.98 69.27 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.507 0.558 . . . . 10.0 112.507 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 593' ' ' LYS . . . . . 0.431 ' HE2' ' HA ' ' C' ' 590' ' ' GLU . 45.0 mtmt -65.61 -33.18 75.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.894 0.378 . . . . 10.0 110.924 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 24.0 mttt -85.48 -34.85 21.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.348 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 91.3 mt -85.77 49.46 1.77 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.456 0.646 . . . . 10.0 109.604 178.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.246 0.915 0 CA-C-N 115.487 -0.778 . . . . 10.0 110.123 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 32.9 tpp . . . . . 0 C--O 1.234 0.247 0 CA-C-O 120.801 0.334 . . . . 10.0 110.284 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.69 155.19 39.23 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.165 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.708 ' HB2' ' H63' ' A' ' 16' ' ' PCW . 33.2 tt0 -115.96 125.25 52.28 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 179.005 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -119.05 101.01 7.71 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.027 0.441 . . . . 10.0 111.165 -179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.56 ' HE2' HN1A ' A' ' 39' ' ' 17F . 5.5 mtpp -81.95 102.71 11.1 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.305 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 21.2 mt -100.92 138.41 38.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.553 -178.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 46.0 t -112.55 126.73 69.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.794 0.33 . . . . 10.0 110.742 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.534 HG12 ' HD2' ' B' ' 16' ' ' LYS . 57.1 t -95.87 118.3 41.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.724 -0.473 . . . . 10.0 109.724 179.189 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.418 ' HB ' ' CD1' ' B' ' 96' ' ' TYR . 35.9 m -112.33 163.21 9.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.773 0.32 . . . . 10.0 110.802 -179.528 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 148.99 167.49 13.91 Favored Glycine 0 N--CA 1.447 -0.632 0 N-CA-C 111.378 -0.689 . . . . 10.0 111.378 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.59 158.32 35.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.924 0.392 . . . . 10.0 111.724 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.65 92.4 1.0 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 121.019 -0.61 . . . . 10.0 111.867 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 151.12 -10.98 0.77 Allowed Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 111.645 -0.582 . . . . 10.0 111.645 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 17.5 m -73.42 -18.91 17.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.857 0.36 . . . . 10.0 111.666 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 89.59 44.7 4.83 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.82 -0.705 . . . . 10.0 112.927 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.534 ' HD2' HG12 ' B' ' 8' ' ' VAL . 53.8 mtmt -62.26 -49.73 74.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.544 0.211 . . . . 10.0 111.226 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.0 p -62.43 -31.23 71.91 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.686 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.38 98.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.286 -0.415 . . . . 10.0 110.312 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 94.2 mt -68.37 -35.75 78.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.98 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.87 -47.42 53.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.84 0.352 . . . . 10.0 110.953 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 97.5 mt -63.93 -35.75 74.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.766 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.576 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 6.4 tp-100 -69.58 -14.83 63.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.081 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 15.0 tp -102.23 -34.81 9.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.869 0.366 . . . . 10.0 110.659 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' ILE . . . . . 0.453 HG13 ' CD2' ' B' ' 40' ' ' TYR . 49.3 mm -79.73 -64.21 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.905 -179.461 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 25' ' ' GLN . . . . . 0.582 ' OE1' ' HA ' ' D' ' 840' ' ' VAL . 5.2 mt-30 -93.21 -13.56 28.2 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.724 -178.562 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 95.3 m-20 64.48 40.66 6.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.654 -179.14 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -130.65 136.2 48.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.047 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -88.21 137.61 32.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.779 0.323 . . . . 10.0 110.774 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 1.7 m -99.69 151.96 4.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.361 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' ASP . . . . . 0.479 ' HA ' " H3'" ' B' ' 201' ' ' GNP . 32.5 t70 -121.17 -21.94 6.24 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.183 0.516 . . . . 10.0 111.363 -178.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.496 ' O ' H5'2 ' B' ' 201' ' ' GNP . 2.3 pm0 -77.0 157.22 31.33 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.358 0.599 . . . . 10.0 111.243 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.51 68.23 5.68 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.035 179.252 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.3 134.62 70.21 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.747 -0.66 . . . . 10.0 110.753 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -80.11 -164.72 0.29 Allowed 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.857 2.371 . . . . 10.0 111.783 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -173.33 141.47 0.92 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.279 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.902 HD11 HG21 ' D' ' 809' ' ' THR . 63.8 mt -121.92 -66.56 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 108.217 -1.031 . . . . 10.0 108.217 178.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.502 ' O ' HG23 ' D' ' 821' ' ' VAL . 1.8 tm-20 -148.11 93.43 2.17 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.702 -0.851 . . . . 10.0 108.702 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 38' ' ' ASP . . . . . 0.623 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 52.0 m-20 -114.61 160.56 19.16 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.551 -179.469 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.1 p -147.28 142.83 27.59 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.715 0.293 . . . . 10.0 111.608 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 40' ' ' TYR . . . . . 0.661 ' CE2' HG22 ' D' ' 840' ' ' VAL . 40.7 m-85 -131.56 141.06 49.62 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.245 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 41' ' ' ARG . . . . . 0.635 ' HB3' ' ND2' ' D' ' 816' ' ' ASN . 0.4 OUTLIER -120.34 131.04 54.68 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.573 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 58.1 tttp -139.93 144.15 36.95 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.23 -0.441 . . . . 10.0 109.962 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -113.44 118.23 33.94 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.971 -0.381 . . . . 10.0 109.971 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -143.65 169.09 11.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.012 0.434 . . . . 10.0 111.271 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 19.1 t -107.09 112.85 41.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 179.194 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 46' ' ' ILE . . . . . 0.41 HD13 HG21 ' B' ' 160' ' ' VAL . 50.3 mt -109.92 112.37 40.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.824 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 61.27 34.52 18.59 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.304 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.88 -8.73 78.91 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.927 -0.654 . . . . 10.0 112.791 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -100.52 113.43 26.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.833 0.349 . . . . 10.0 111.267 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 5.3 t -78.83 121.28 24.61 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.489 -0.93 . . . . 10.0 108.489 178.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -140.39 166.68 24.05 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.286 0.565 . . . . 10.0 112.47 -178.109 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 25.5 tp -107.02 122.1 45.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.256 -0.884 . . . . 10.0 109.112 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.449 ' O ' ' HA ' ' B' ' 41' ' ' ARG . 77.7 mt -99.98 117.35 34.08 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.284 -0.416 . . . . 10.0 111.561 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.448 ' O ' ' HA ' ' B' ' 5' ' ' LYS . 4.8 t70 -104.53 89.55 3.25 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.354 -1.35 . . . . 10.0 107.354 178.195 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 14.8 mt -82.69 136.58 22.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.641 -0.709 . . . . 10.0 112.306 -177.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.435 HD12 ' O ' ' B' ' 38' ' ' ASP . 47.3 tp -110.3 120.89 43.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.606 -0.725 . . . . 10.0 111.124 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.623 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 6.0 t0 -99.36 96.76 7.94 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.072 -0.714 . . . . 10.0 109.072 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 58' ' ' THR . . . . . 0.445 HG22 ' CE1' ' B' ' 71' ' ' TYR . 32.0 p -81.02 162.41 23.82 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.373 -0.83 . . . . 10.0 112.342 -178.359 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.493 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -76.51 156.47 32.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.905 178.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -84.31 -67.49 1.43 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.436 -0.888 . . . . 10.0 111.767 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -83.15 102.43 11.86 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.328 0.585 . . . . 20.0 111.257 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.418 ' OE1' ' HD2' ' B' ' 68' ' ' ARG . 0.4 OUTLIER -142.59 163.83 31.76 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.374 179.509 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -118.67 -161.46 0.84 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.698 -0.683 . . . . 10.0 109.312 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -80.44 110.27 15.74 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.982 0.42 . . . . 10.0 110.173 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 44.2 t -135.56 137.4 41.97 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.028 -0.533 . . . . 10.0 109.933 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.85 -38.46 78.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.055 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 90.4 mmm -60.81 -40.74 93.87 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.407 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.676 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 56.3 ttt85 -66.58 -48.43 69.61 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.482 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.479 ' O ' ' HG3' ' B' ' 73' ' ' ARG . 0.1 OUTLIER -59.88 -32.6 70.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.582 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.464 ' NE2' ' H82' ' A' ' 25' ' ' PCW . 23.5 mt-30 -61.35 -56.3 21.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.98 -0.554 . . . . 10.0 111.523 179.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 71' ' ' TYR . . . . . 0.676 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 5.4 p90 -72.55 -27.83 62.46 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.436 0.902 . . . . 10.0 113.436 -178.502 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 72' ' ' MET . . . . . 0.462 ' HB3' HG21 ' B' ' 103' ' ' VAL . 59.7 mtp -68.57 -21.27 64.54 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.939 0.348 . . . . 10.0 111.939 -179.478 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 73' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' B' ' 69' ' ' ASP . 66.9 mtt-85 -95.6 11.74 32.11 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.859 0.318 . . . . 10.0 111.859 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.3 m -113.01 18.16 18.29 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.408 0.623 . . . . 10.0 110.749 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -115.94 144.26 18.37 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.521 -0.847 . . . . 10.0 112.693 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -84.99 -67.9 0.76 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.214 -0.291 . . . . 10.0 110.214 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -105.19 152.4 17.27 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 111.149 -0.78 . . . . 10.0 111.149 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -124.75 127.46 47.26 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.116 0.484 . . . . 10.0 111.677 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.754 ' HG ' HD22 ' B' ' 159' ' ' LEU . 55.5 mt -95.33 113.43 25.1 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.883 -0.598 . . . . 10.0 110.03 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 3.2 m -87.37 86.31 7.23 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.934 -0.395 . . . . 10.0 109.934 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.462 ' HA ' ' HB ' ' B' ' 114' ' ' VAL . 28.6 t -88.31 126.3 41.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.138 0.494 . . . . 10.0 111.837 -178.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.644 ' HB3' HD11 ' B' ' 93' ' ' ILE . 29.4 p90 -133.14 157.9 44.17 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.114 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -94.16 121.71 35.94 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 84' ' ' ILE . . . . . 0.471 ' CD1' ' HA ' ' B' ' 118' ' ' CYS . 12.6 pt -68.46 -11.23 14.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 112.129 0.418 . . . . 10.0 112.129 -179.511 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -100.97 12.06 38.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.911 0.386 . . . . 10.0 110.963 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -137.6 113.13 9.45 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.0 0.428 . . . . 10.0 110.861 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.39 -37.71 88.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.908 -0.587 . . . . 10.0 112.321 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 17.3 tptp -63.79 -30.68 71.75 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.987 0.422 . . . . 10.0 110.878 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 15.2 t -66.42 -40.37 89.5 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.791 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -65.62 -35.67 81.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.356 0.598 . . . . 10.0 110.195 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -80.93 -1.72 44.75 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.679 -0.692 . . . . 10.0 111.574 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.19 -12.1 33.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.146 0.498 . . . . 10.0 110.024 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 93' ' ' ILE . . . . . 0.644 HD11 ' HB3' ' B' ' 82' ' ' PHE . 43.8 mm -60.26 -42.74 91.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.398 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -64.4 -37.79 88.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.26 -0.427 . . . . 10.0 109.871 179.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -59.03 -43.83 91.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.414 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 96' ' ' TYR . . . . . 0.418 ' CD1' ' HB ' ' B' ' 9' ' ' VAL . 2.9 m-85 -77.6 -34.92 53.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.95 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -55.17 -50.58 68.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.406 -0.361 . . . . 10.0 111.335 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -69.46 -35.79 75.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.081 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -63.9 -48.33 77.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.658 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 100' ' ' ILE . . . . . 0.502 ' HA ' HG22 ' B' ' 103' ' ' VAL . 65.2 mt -66.92 -38.05 80.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.273 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.84 -37.34 78.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.097 0.475 . . . . 10.0 110.422 179.185 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 64.3 ttp85 -71.43 -42.9 67.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.664 -0.698 . . . . 10.0 111.918 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' B' ' 100' ' ' ILE . 28.3 m -72.83 -30.0 31.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 N-CA-C 112.288 0.477 . . . . 10.0 112.288 -179.252 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 19.8 mmmt -88.0 -22.29 24.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.549 0.214 . . . . 10.0 111.169 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 26.0 t0 57.84 30.32 18.87 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.725 0.774 . . . . 10.0 110.782 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 3.0 m -127.44 143.28 51.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.381 -0.827 . . . . 10.0 109.756 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -75.06 -41.64 58.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.199 0.523 . . . . 10.0 110.487 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -106.24 109.03 20.84 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.573 0.701 . . . . 10.0 110.775 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.417 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 78.5 t -118.92 131.67 24.24 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.256 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 110' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 32.9 Cg_exo -59.63 101.76 0.15 Allowed 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.718 2.279 . . . . 10.0 111.381 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 111' ' ' MET . . . . . 0.565 ' HB2' HG21 ' B' ' 139' ' ' ILE . 65.8 mtt -127.16 149.67 49.86 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.154 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 112' ' ' VAL . . . . . 0.518 ' HB ' HD23 ' B' ' 79' ' ' LEU . 98.0 t -132.36 122.57 48.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.579 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 12.9 tp -76.87 115.68 16.87 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.274 -0.639 . . . . 10.0 109.274 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 114' ' ' VAL . . . . . 0.462 ' HB ' ' HA ' ' B' ' 81' ' ' VAL . 49.3 t -110.58 112.41 40.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.04 0.448 . . . . 10.0 111.425 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -95.56 95.51 1.85 Allowed Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.319 -1.112 . . . . 10.0 110.319 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -85.18 163.48 18.69 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -178.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 117' ' ' LYS . . . . . 0.51 ' HB3' HD12 ' B' ' 120' ' ' LEU . 92.5 mttt 72.13 33.19 1.62 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 115.38 -0.827 . . . . 10.0 112.208 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 118' ' ' CYS . . . . . 0.471 ' HA ' ' CD1' ' B' ' 84' ' ' ILE . 20.4 p -67.31 -17.0 64.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.761 0.315 . . . . 10.0 111.723 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -84.07 -8.93 58.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.464 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.51 HD12 ' HB3' ' B' ' 117' ' ' LYS . 34.2 mt -84.7 124.65 72.77 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 120.762 0.315 . . . . 10.0 111.429 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -75.77 42.67 0.97 Allowed 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.111 2.541 . . . . 10.0 112.248 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 26.7 m -134.75 30.49 3.42 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.899 -0.778 . . . . 10.0 108.899 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 40.8 ttm-85 -57.63 108.93 0.62 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.379 -0.828 . . . . 10.0 111.989 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 2.5 m -98.87 -27.6 13.84 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.635 -0.711 . . . . 10.0 109.151 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 40.4 t -106.96 114.24 45.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.187 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -76.98 154.36 33.62 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.34 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 127' ' ' THR . . . . . 0.554 HG23 ' HE2' ' B' ' 141' ' ' PHE . 3.8 m -55.7 -41.06 73.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.921 -0.581 . . . . 10.0 111.517 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 11.0 ttpp -62.21 -45.11 94.81 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.803 0.335 . . . . 10.0 110.973 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -56.91 -46.8 81.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.583 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.77 -40.42 84.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.477 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -63.9 -40.44 96.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.524 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -60.7 -42.31 96.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.094 0.474 . . . . 10.0 110.44 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 42.0 tp -68.39 -44.68 74.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.415 179.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.58 -45.35 92.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.218 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -61.8 -36.01 79.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.255 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 22.9 m -67.66 -25.57 65.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.47 -179.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -95.29 -6.01 42.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.453 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 72.59 31.49 62.86 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.865 -0.684 . . . . 10.0 111.75 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 139' ' ' ILE . . . . . 0.565 HG21 ' HB2' ' B' ' 111' ' ' MET . 49.5 pt -126.25 153.05 74.48 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 110.295 -0.261 . . . . 10.0 110.295 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -81.14 158.05 20.26 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.586 2.191 . . . . 10.0 112.389 179.548 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.554 ' HE2' HG23 ' B' ' 127' ' ' THR . 45.0 t80 -122.8 129.51 51.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.535 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 32.3 mm -128.03 124.42 62.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.418 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -85.15 124.76 32.19 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.669 -0.863 . . . . 10.0 108.669 178.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 82.6 p -128.55 171.5 12.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.792 0.805 . . . . 10.0 112.974 -177.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 7.9 t -154.06 121.12 5.67 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.659 -1.155 . . . . 10.0 108.043 178.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.97 -17.79 62.64 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.864 0.364 . . . . 10.0 111.01 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 29.8 ttmt -81.55 -48.28 12.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.16 -0.473 . . . . 10.0 111.526 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 24.4 p -90.42 -12.8 36.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.802 0.334 . . . . 10.0 111.532 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 149' ' ' ARG . . . . . 0.576 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 40.2 ttt-85 70.04 20.22 6.56 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.694 -0.684 . . . . 10.0 111.531 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -75.7 131.93 40.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.604 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.9 -13.0 5.74 Favored Glycine 0 C--O 1.225 -0.436 0 N-CA-C 114.934 0.734 . . . . 10.0 114.934 177.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 59.7 t -53.55 -56.88 6.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -178.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -45.69 93.03 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.926 -179.425 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -66.62 -32.67 74.15 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.918 0.71 . . . . 10.0 112.918 -178.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.8 -46.52 84.52 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.074 0.464 . . . . 10.0 110.481 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -68.53 -37.41 79.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.713 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 21.4 m-30 -61.86 -45.3 94.36 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.315 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.519 ' HA ' ' HE ' ' B' ' 161' ' ' ARG . 12.2 m -61.71 -38.17 86.89 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.901 -0.591 . . . . 10.0 111.004 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.754 HD22 ' HG ' ' B' ' 79' ' ' LEU . 21.5 tp -61.53 -43.58 98.61 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 160' ' ' VAL . . . . . 0.41 HG21 HD13 ' B' ' 46' ' ' ILE . 67.0 t -65.7 -39.06 83.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.115 -0.493 . . . . 10.0 109.809 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 161' ' ' ARG . . . . . 0.519 ' HE ' ' HA ' ' B' ' 158' ' ' THR . 41.5 mtm-85 -61.6 -41.38 97.36 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.938 -0.574 . . . . 10.0 109.987 178.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -63.0 -40.5 97.97 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.202 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 163' ' ' ILE . . . . . 0.414 HG13 ' O ' ' B' ' 159' ' ' LEU . 93.1 mt -62.78 -42.07 94.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.444 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 164' ' ' ARG . . . . . 0.431 HH11 ' HD2' ' B' ' 164' ' ' ARG . 59.1 mtt180 -57.17 -52.23 66.16 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.783 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt -61.07 -39.38 89.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.666 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 -65.07 -36.92 85.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.009 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 7.8 mttt -73.63 -35.1 65.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.933 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 67.2 tt0 -69.15 -33.84 74.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.306 0.574 . . . . 10.0 109.574 179.16 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 16.2 tttp -64.59 -33.35 75.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.506 -0.77 . . . . 10.0 110.49 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 23.2 ttp -62.48 -25.42 67.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.704 -0.68 . . . . 10.0 112.067 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 171' ' ' SER . . . . . 0.411 ' OG ' ' H61' ' A' ' 7' ' ' PCW . 39.0 m -79.95 -12.63 59.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.018 0.437 . . . . 10.0 111.299 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 172' ' ' LYS . . . . . 0.436 ' HB3' ' O4 ' ' A' ' 38' ' ' 17F . 29.5 mtpp -110.26 -53.36 2.69 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.281 0.562 . . . . 10.0 109.98 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -99.76 76.4 1.97 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.635 -0.711 . . . . 10.0 109.662 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . -63.13 -72.04 0.73 Allowed Glycine 0 N--CA 1.447 -0.602 0 CA-C-N 115.295 -0.866 . . . . 10.0 112.196 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -172.37 117.67 0.36 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.915 0.388 . . . . 10.0 110.775 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -111.5 112.03 23.48 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.674 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 177' ' ' LYS . . . . . 0.46 ' NZ ' ' N1 ' ' A' ' 40' ' ' 17F . 9.8 ptmm? -111.4 -179.67 3.78 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.925 -0.579 . . . . 10.0 109.915 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -63.54 128.18 34.67 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.643 -0.503 . . . . 10.0 109.643 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 15.0 ptpt -153.53 174.16 14.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.679 -0.237 . . . . 10.0 111.195 -179.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? 74.67 -49.0 0.66 Allowed 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.927 0.767 . . . . 10.0 112.805 179.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 62.9 m -118.62 126.53 52.15 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 110.029 -0.36 . . . . 10.0 110.029 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 182' ' ' LYS . . . . . 0.763 ' NZ ' HN1A ' A' ' 36' ' ' 17F . 28.8 mmtm -91.11 -29.48 17.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.416 -179.508 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 1.3 m 61.35 60.0 1.8 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.034 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 10.7 mmtp 57.8 72.69 0.5 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.484 -0.78 . . . . 10.0 111.472 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 185' ' ' CYS . . . . . 0.442 ' O ' ' H72' ' A' ' 12' ' ' PCW . 2.1 p . . . . . 0 C--N 1.324 -0.526 0 CA-C-N 115.541 -0.754 . . . . 10.0 111.729 -179.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.595 0 N-CA-C 112.084 -0.406 . . . . 10.0 112.084 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' D' D ' 809' ' ' THR . . . . . 0.902 HG21 HD11 ' B' ' 36' ' ' ILE . 0.2 OUTLIER -137.2 134.2 36.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.686 0.279 . . . . 10.0 111.024 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' D' D ' 810' ' ' VAL . . . . . 0.601 HG23 HG22 ' D' ' 824' ' ' VAL . 75.3 t -106.14 133.4 50.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.122 -179.122 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 26.0 ttmt -87.27 110.31 20.11 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.419 -0.586 . . . . 10.0 109.419 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 57.5 t -99.2 125.4 52.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 120.894 0.378 . . . . 10.0 110.418 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -96.24 142.4 28.44 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.808 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 56.1 mt -107.96 150.09 39.91 Favored Pre-proline 0 C--N 1.318 -0.8 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.07 -179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -61.78 -16.87 51.72 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 123.178 2.585 . . . . 10.0 112.273 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 816' ' ' ASN . . . . . 0.635 ' ND2' ' HB3' ' B' ' 41' ' ' ARG . 4.0 t30 -85.84 34.94 0.61 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.984 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 817' ' ' LYS . . . . . 0.605 ' HB2' ' NH1' ' B' ' 41' ' ' ARG . 5.0 mtpm? 52.43 38.25 24.83 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.124 -0.944 . . . . 10.0 112.161 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 818' ' ' GLN . . . . . 0.465 HE22 ' C ' ' B' ' 40' ' ' TYR . 72.0 mt-30 -135.73 -170.5 2.63 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 112.838 0.681 . . . . 10.0 112.838 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.36 168.4 26.75 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.336 0.589 . . . . 10.0 112.148 -178.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 14.1 t -152.38 139.15 18.87 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 107.301 -1.37 . . . . 10.0 107.301 178.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 821' ' ' VAL . . . . . 0.595 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 2.9 t -108.05 114.53 46.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 C-N-CA 120.147 -0.621 . . . . 10.0 112.02 -178.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 3.7 t -110.29 148.33 13.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.939 -178.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.89 146.94 37.33 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.78 0.324 . . . . 10.0 111.564 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 824' ' ' VAL . . . . . 0.601 HG22 HG23 ' D' ' 810' ' ' VAL . 47.7 t -84.68 96.39 4.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.069 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 825' ' ' ARG . . . . . 0.444 ' HB2' ' SD ' ' D' ' 828' ' ' MET . 15.3 mtp85 -99.65 103.46 15.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.52 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -59.3 123.62 17.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.952 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 128.03 -41.67 1.55 Allowed Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 115.665 -0.698 . . . . 10.0 112.041 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 828' ' ' MET . . . . . 0.444 ' SD ' ' HB2' ' D' ' 825' ' ' ARG . 12.7 ptm -81.86 154.89 25.63 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.916 0.389 . . . . 10.0 110.854 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 829' ' ' SER . . . . . 0.474 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 2.1 m -96.72 168.9 10.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.203 -0.453 . . . . 10.0 111.334 -179.039 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 830' ' ' VAL . . . . . 0.477 ' O ' ' HB2' ' D' ' 834' ' ' LEU . 69.7 t -54.86 -42.53 63.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.714 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 831' ' ' TYR . . . . . 0.515 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 36.6 t80 -55.89 -33.07 64.29 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.365 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -73.73 -59.35 2.76 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.367 0.506 . . . . 10.0 112.367 -178.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.99 -39.17 93.51 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 -179.101 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 834' ' ' LEU . . . . . 0.665 ' HG ' HG21 ' D' ' 850' ' ' VAL . 4.0 mm? -75.47 -14.9 60.46 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.429 0.529 . . . . 10.0 112.429 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 835' ' ' ASP . . . . . 0.523 ' O ' ' HG2' ' D' ' 839' ' ' LYS . 12.8 t70 -60.15 -49.52 77.31 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 7.6 mmmm -63.65 -32.5 74.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.449 -0.796 . . . . 10.0 111.046 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 837' ' ' ALA . . . . . 0.582 ' O ' HG12 ' D' ' 840' ' ' VAL . . . -70.02 -28.49 65.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.139 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 838' ' ' LEU . . . . . 0.513 HD12 ' HG3' ' D' ' 845' ' ' GLN . 91.6 mt -87.83 -39.33 14.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.549 179.125 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 839' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' D' ' 835' ' ' ASP . 30.9 mmtp -64.99 -31.88 73.33 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.404 179.046 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 840' ' ' VAL . . . . . 0.661 HG22 ' CE2' ' B' ' 40' ' ' TYR . 2.0 p -58.33 -24.95 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-O 121.426 0.632 . . . . 10.0 111.441 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 841' ' ' ARG . . . . . 0.484 ' O ' ' H82' ' A' ' 15' ' ' PCW . 3.7 mmp_? -100.78 -37.89 8.51 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.314 -0.857 . . . . 10.0 110.154 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 117.01 20.29 4.92 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 111.085 -0.806 . . . . 10.0 111.085 -178.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 59.1 mt -105.32 179.74 4.18 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.775 0.322 . . . . 10.0 110.346 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -140.7 164.47 30.11 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.651 -0.5 . . . . 10.0 109.651 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 845' ' ' GLN . . . . . 0.513 ' HG3' HD12 ' D' ' 838' ' ' LEU . 22.4 mp0 -72.86 64.87 0.7 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.087 0.47 . . . . 10.0 111.2 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -123.0 -78.13 0.6 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.614 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -92.47 14.27 17.2 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.324 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 14.8 m -111.13 143.74 41.37 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.29 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 7.1 p -138.14 143.56 32.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.383 -0.371 . . . . 10.0 110.489 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 850' ' ' VAL . . . . . 0.665 HG21 ' HG ' ' D' ' 834' ' ' LEU . 18.8 t -97.13 124.31 49.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.967 0.413 . . . . 10.0 111.618 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 851' ' ' TYR . . . . . 0.673 ' HD2' ' HB3' ' D' ' 858' ' ' LYS . 4.4 m-30 -101.96 130.61 48.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.111 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 852' ' ' ARG . . . . . 0.515 ' HG3' ' HB ' ' D' ' 861' ' ' THR . 20.0 mtm180 -96.79 146.54 24.81 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.719 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 853' ' ' LEU . . . . . 0.479 HD12 ' HB2' ' D' ' 874' ' ' GLU . 13.4 mt -90.26 89.33 7.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.103 -0.499 . . . . 10.0 111.876 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 73.5 mt -105.47 106.25 20.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 178.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt 63.35 21.56 12.86 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.161 0.505 . . . . 10.0 110.706 -178.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 93.61 -22.03 37.78 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.571 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 44.2 ttt-85 -81.25 122.45 27.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.718 0.294 . . . . 10.0 111.057 -179.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 858' ' ' LYS . . . . . 0.673 ' HB3' ' HD2' ' D' ' 851' ' ' TYR . 87.9 mttt -65.22 118.65 9.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.07 179.253 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 7.2 m -119.76 134.78 55.11 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.433 -0.349 . . . . 10.0 111.26 -179.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 17.4 t -71.03 137.17 24.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.833 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 861' ' ' THR . . . . . 0.515 ' HB ' ' HG3' ' D' ' 852' ' ' ARG . 3.0 t -127.1 164.71 20.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.091 179.517 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -90.84 159.13 16.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.756 0.312 . . . . 10.0 110.913 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 863' ' ' TRP . . . . . 0.515 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 96.5 m95 -79.53 -23.31 42.98 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.053 0.454 . . . . 10.0 110.801 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -79.75 -13.72 59.24 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.61 -179.182 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 865' ' ' THR . . . . . 0.408 ' O ' HG23 ' D' ' 830' ' ' VAL . 3.8 m -63.49 139.92 58.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.488 -0.324 . . . . 10.0 110.851 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 866' ' ' ALA . . . . . 0.474 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -74.94 147.42 40.91 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.293 -0.262 . . . . 10.0 110.293 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 867' ' ' ILE . . . . . 0.447 HD12 ' HG ' ' D' ' 870' ' ' LEU . 5.2 tp -83.75 4.87 2.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.912 0.387 . . . . 10.0 111.599 -179.402 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 868' ' ' ALA . . . . . 0.555 ' HB3' ' HD3' ' D' ' 869' ' ' PRO . . . -56.0 -58.01 18.7 Favored Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 113.595 0.961 . . . . 10.0 113.595 -179.112 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 869' ' ' PRO . . . . . 0.555 ' HD3' ' HB3' ' D' ' 868' ' ' ALA . 67.9 Cg_endo -86.56 33.95 0.45 Allowed 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.115 1.877 . . . . 10.0 112.597 -179.508 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 870' ' ' LEU . . . . . 0.447 ' HG ' HD12 ' D' ' 867' ' ' ILE . 3.1 mm? -105.07 -5.4 20.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.943 0.401 . . . . 10.0 111.724 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -70.48 131.97 44.84 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.762 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 103.51 -0.5 46.26 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.527 -0.844 . . . . 10.0 113.542 179.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -136.83 173.75 11.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.449 0.625 . . . . 10.0 111.733 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 874' ' ' GLU . . . . . 0.479 ' HB2' HD12 ' D' ' 853' ' ' LEU . 69.6 mt-10 -109.9 162.18 14.75 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.066 -0.516 . . . . 10.0 109.973 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 96.7 mt -131.13 119.5 22.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.43 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 876' ' ' ILE . . . . . 0.635 HD13 ' HE2' ' D' ' 858' ' ' LYS . 3.0 mp -106.65 124.61 62.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 877' ' ' VAL . . . . . 0.434 HG11 HD21 ' D' ' 838' ' ' LEU . 39.0 t -93.02 120.04 41.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 120.895 0.378 . . . . 10.0 110.828 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -106.48 153.73 21.87 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 94.7 t -118.37 118.68 58.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.834 -0.432 . . . . 10.0 109.834 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 37.9 mt . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.406 -0.806 . . . . 10.0 110.246 -179.488 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PCW . . . . . 0.871 ' H41' ' H1 ' ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PCW . . . . . 0.796 H341 H152 ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PCW . . . . . 0.839 ' H11' ' H11' ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PCW . . . . . 0.776 H332 ' H31' ' A' ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PCW . . . . . 0.796 H152 H341 ' A' ' 2' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PCW . . . . . 0.562 H142 H421 ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PCW . . . . . 0.776 ' H31' H332 ' A' ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PCW . . . . . 0.55 ' H72' ' O2P' ' A' ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PCW . . . . . 0.559 ' H73' ' O2P' ' A' ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PCW . . . . . 0.915 H131 H351 ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PCW . . . . . 0.639 ' O31' ' H71' ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PCW . . . . . 0.908 ' H73' HN1A ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PCW . . . . . 0.668 H283 H352 ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PCW . . . . . 0.5 H341 ' H72' ' A' ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PCW . . . . . 0.484 ' H82' ' O ' ' D' ' 841' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PCW . . . . . 0.708 ' H63' ' HB2' ' B' ' 3' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PCW . . . . . 0.599 H321 ' H12' ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PCW . . . . . 0.839 ' H11' ' H11' ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PCW . . . . . 0.435 ' H2 ' ' H61' ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PCW . . . . . 0.534 ' P ' HG12 ' D' ' 876' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PCW . . . . . 0.638 H341 H352 ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PCW . . . . . 0.915 H351 H131 ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PCW . . . . . 0.427 H332 ' H52' ' A' ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PCW . . . . . 0.55 H221 H212 ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PCW . . . . . 0.488 H342 H172 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PCW . . . . . 0.783 H321 ' H19' ' A' ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PCW . . . . . 0.724 ' H41' ' O2 ' ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PCW . . . . . 0.587 ' O2P' ' H61' ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PCW . . . . . 0.905 H152 H362 ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PCW . . . . . 0.43 H232 ' H20' ' A' ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PCW . . . . . 0.581 H342 H12A ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' 17F . . . . . 0.662 ' H9 ' H321 ' A' ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' 17F . . . . . 0.688 HN1A ' H2 ' ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' 17F . . . . . 0.871 ' H1 ' ' H41' ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' 17F . . . . . 0.763 HN1A ' NZ ' ' B' ' 182' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' 17F . . . . . 0.908 HN1A ' H73' ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' 17F . . . . . 0.79 H18A H122 ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' 17F . . . . . 0.56 HN1A ' HE2' ' B' ' 5' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' 17F . . . . . 0.783 ' H19' H321 ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PCW . . . . . 0.617 H231 H232 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PCW . . . . . 0.564 H252 H131 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PCW . . . . . 0.51 ' O2P' ' H51' ' A' ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PCW . . . . . 0.605 H432 ' H40' ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PCW . . . . . 0.51 ' H51' ' O2P' ' A' ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PCW . . . . . 0.508 H352 H371 ' A' ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PCW . . . . . 0.661 H241 H11A ' A' ' 76' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PCW . . . . . 0.665 H421 ' H58' ' A' ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PCW . . . . . 0.616 H441 ' H59' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PCW . . . . . 0.755 H432 ' H46' ' A' ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PCW . . . . . 0.551 ' O2P' ' H71' ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PCW . . . . . 0.468 ' O1P' ' H32' ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PCW . . . . . 0.716 H352 H122 ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PCW . . . . . 0.75 ' H63' ' H11' ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PCW . . . . . 0.522 H382 H431 ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PCW . . . . . 0.567 H412 H241 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PCW . . . . . 0.522 H331 H171 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PCW . . . . . 0.572 H372 H181 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' PCW . . . . . 0.601 H411 H162 ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PCW . . . . . 0.617 H232 H231 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PCW . . . . . 0.538 H272 H341 ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PCW . . . . . 0.532 H172 H152 ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PCW . . . . . 0.75 ' H11' ' H63' ' A' ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PCW . . . . . 0.499 H251 H483 ' A' ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PCW . . . . . 0.631 ' H20' ' H62' ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PCW . . . . . 0.831 ' H83' ' H37' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PCW . . . . . 0.404 ' H32' H142 ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PCW . . . . . 0.592 H411 H351 ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PCW . . . . . 0.501 H231 H172 ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PCW . . . . . 0.786 H132 H181 ' A' ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PCW . . . . . 0.716 H122 H352 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' 17F . . . . . 0.528 ' H39' ' HZ ' ' C' ' 459' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' 17F . . . . . 1.026 ' H4 ' ' HN1' ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' 17F . . . . . 0.452 ' H64' ' H42' ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' 17F . . . . . 0.661 H11A H241 ' A' ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' 17F . . . . . 0.591 HN1A ' C5 ' ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' 17F . . . . . 0.831 ' H37' ' H83' ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' 17F . . . . . 0.531 ' H54' ' H10' ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' 17F . . . . . 0.665 ' H58' H421 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 201' ' ' GNP . . . . . 0.496 H5'2 ' O ' ' B' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 73.7 mt . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.994 0.426 . . . . 10.0 110.566 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 55.2 mmtt -59.64 -42.12 92.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.67 -0.695 . . . . 10.0 110.984 -179.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 96.9 mt -64.35 -33.38 75.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.625 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 39.8 mt -66.6 -46.26 76.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.1 0.476 . . . . 10.0 110.033 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -67.93 -39.61 83.45 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.414 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -65.46 -39.21 91.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.729 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 15.7 m95 -73.92 -21.49 60.03 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.357 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -60.85 -44.02 97.56 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -66.54 -38.06 86.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.297 -0.865 . . . . 10.0 110.179 179.477 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 60.2 t -67.68 -46.72 82.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.291 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 24.4 m -59.29 -48.14 82.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.702 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.4 p -60.09 -40.78 90.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.841 0.353 . . . . 10.0 110.725 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 213' ' ' THR . . . . . 0.417 ' O ' ' HG ' ' A' ' 217' ' ' LEU . 22.9 m -66.32 -41.43 89.7 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 178.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.4 -40.96 98.19 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 65.0 m -63.18 -41.04 99.15 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.804 -0.635 . . . . 10.0 109.825 178.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 216' ' ' LYS . . . . . 0.478 ' HA ' ' HD3' ' A' ' 216' ' ' LYS . 62.4 mmtt -67.27 -35.0 78.6 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.32 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 217' ' ' LEU . . . . . 0.425 ' O ' ' HG ' ' A' ' 221' ' ' LEU . 80.6 mt -63.19 -44.36 95.58 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -68.0 -36.99 80.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.608 179.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -61.86 -38.45 88.32 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.863 178.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -80.46 -28.86 37.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.347 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 221' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 16.7 mt -58.55 -34.14 70.69 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 116.565 -0.288 . . . . 10.0 111.106 179.537 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -54.93 -69.49 1.25 Allowed Glycine 0 C--N 1.332 0.308 0 N-CA-C 110.992 -0.843 . . . . 10.0 110.992 178.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -57.68 -42.08 63.86 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.52 2.147 . . . . 10.0 111.275 177.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 14.0 t -53.31 -52.12 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 O-C-N 123.015 0.197 . . . . 10.0 111.296 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 18.8 p -64.71 -39.86 94.37 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.812 -0.355 . . . . 10.0 110.719 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -62.11 -50.05 73.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.724 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -64.42 -35.95 82.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.022 -0.536 . . . . 10.0 109.955 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 2.5 m-30 -66.73 -46.43 75.48 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.44 -0.578 . . . . 10.0 109.44 178.01 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 6.5 m95 -63.74 -40.67 97.3 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -55.12 -50.41 69.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.109 0.481 . . . . 10.0 109.705 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 231' ' ' ASN . . . . . 0.799 ' HA ' ' HE2' ' A' ' 234' ' ' LYS . 58.5 m-80 -68.71 -40.59 79.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.668 -0.697 . . . . 10.0 110.891 179.34 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 49.5 mt -63.92 -36.57 84.37 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.298 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -65.74 -43.62 88.45 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 109.977 -0.379 . . . . 10.0 109.977 178.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 234' ' ' LYS . . . . . 0.799 ' HE2' ' HA ' ' A' ' 231' ' ' ASN . 38.8 mtmt -66.97 -33.09 74.81 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.546 -0.909 . . . . 10.0 108.546 178.453 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.61 -52.7 50.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.091 -0.959 . . . . 10.0 109.64 178.54 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 3.1 p -65.67 -34.01 77.21 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.637 -0.256 . . . . 10.0 110.784 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -61.85 -49.64 75.46 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.775 -0.824 . . . . 10.0 108.775 178.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -66.69 -45.81 81.09 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 110.679 -0.968 . . . . 10.0 110.679 178.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 26.0 mt -56.94 -44.51 82.59 Favored 'General case' 0 C--O 1.22 -0.491 0 C-N-CA 122.411 0.284 . . . . 10.0 111.723 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 240' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 240' ' ' ARG . 45.4 mtt85 -72.43 -38.45 68.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.545 0.212 . . . . 10.0 111.364 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -65.12 -24.05 67.31 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.151 -0.685 . . . . 10.0 109.151 178.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 242' ' ' GLU . . . . . 0.541 ' OE1' ' HA ' ' C' ' 528' ' ' ARG . 8.3 mt-10 -89.83 -43.49 10.6 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.043 -0.98 . . . . 10.0 110.053 178.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 243' ' ' MET . . . . . 0.612 ' HA ' ' HB2' ' A' ' 246' ' ' ASP . 75.4 mmm -59.38 -30.58 68.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.834 0.35 . . . . 10.0 111.114 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 244' ' ' SER . . . . . 0.635 ' O ' ' HB2' ' A' ' 248' ' ' GLU . 1.4 p -66.05 -32.83 74.53 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 178.217 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 245' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 249' ' ' GLU . 42.1 mmtt -81.82 -43.69 17.94 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 108.695 -0.854 . . . . 10.0 108.695 178.257 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 246' ' ' ASP . . . . . 0.612 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.3 OUTLIER -52.47 -59.09 4.85 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.464 178.868 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 71.8 mt -65.19 -33.23 75.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.617 -0.719 . . . . 10.0 111.42 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 248' ' ' GLU . . . . . 0.635 ' HB2' ' O ' ' A' ' 244' ' ' SER . 28.3 tt0 -60.57 -54.78 41.27 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.924 -0.399 . . . . 10.0 109.924 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 249' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 245' ' ' LYS . 44.3 mt-10 -67.46 -37.82 83.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.511 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 250' ' ' VAL . . . . . 0.611 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 25.2 t -65.2 -46.41 90.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.618 -0.265 . . . . 10.0 111.246 179.335 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.428 ' O ' HG12 ' A' ' 254' ' ' VAL . 97.7 mttt -71.67 -42.25 67.71 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.708 0.262 . . . . 10.0 111.708 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -65.19 -35.25 80.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.845 0.355 . . . . 10.0 110.658 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -88.33 -21.95 24.11 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.678 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.611 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -60.33 -27.83 40.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.743 0.306 . . . . 10.0 110.765 179.72 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -64.62 -63.9 3.25 Favored Pre-proline 0 N--CA 1.452 -0.337 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.587 178.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.29 -32.38 72.98 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 121.821 1.681 . . . . 10.0 111.841 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 5.8 m-30 -63.87 -51.12 66.05 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.769 0.319 . . . . 10.0 110.445 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 59.2 mt -73.87 -34.66 64.55 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.032 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -64.06 -48.07 77.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.805 0.336 . . . . 10.0 110.737 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 260' ' ' ASP . . . . . 0.488 ' O ' ' HE2' ' A' ' 264' ' ' LYS . 38.3 t70 -60.72 -44.45 96.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.069 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -69.09 -34.8 75.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.649 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -63.57 -45.74 89.07 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 263' ' ' LYS . . . . . 0.519 ' O ' ' HG3' ' A' ' 267' ' ' GLU . 21.6 mttt -63.87 -42.66 97.45 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.044 -0.725 . . . . 10.0 109.044 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.526 ' HD2' ' HB1' ' C' ' 509' ' ' ALA . 0.1 OUTLIER -60.28 -48.7 80.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.438 178.565 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 1.6 m95 -60.75 -37.72 82.78 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.434 179.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -63.19 -50.41 70.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.86 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 267' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 13.0 mt-10 -62.25 -43.22 99.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 179.048 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 268' ' ' GLU . . . . . 0.455 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 26.6 mt-10 -60.74 -48.81 80.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.111 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 67.1 mmm -68.12 -40.48 82.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.499 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -62.69 -49.44 75.09 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.175 -0.305 . . . . 10.0 110.175 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 71.4 mt -64.73 -34.51 78.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.393 -0.595 . . . . 10.0 109.393 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 272' ' ' TYR . . . . . 0.427 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 11.9 t80 -64.5 -50.86 65.75 Favored 'General case' 0 C--O 1.217 -0.649 0 CA-C-N 115.495 -0.775 . . . . 10.0 109.753 178.564 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 273' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 273' ' ' ARG . 58.0 mtt180 -62.57 -42.35 99.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.926 0.393 . . . . 10.0 110.492 179.349 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -59.76 -25.44 64.89 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.956 -179.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.728 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 73.0 mttt -100.83 -36.45 9.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.435 179.165 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 276' ' ' VAL . . . . . 0.421 HG22 H231 ' A' ' 3' ' ' PCW . 3.0 t -51.92 -44.86 38.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 122.394 0.278 . . . . 10.0 111.17 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -60.37 -61.97 6.88 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 112.519 0.563 . . . . 10.0 112.519 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 278' ' ' PRO . . . . . 0.467 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 14.0 Cg_endo -59.53 -38.63 81.66 Favored 'Trans proline' 0 C--N 1.356 0.973 0 C-N-CA 121.886 1.724 . . . . 10.0 111.954 178.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.869 HD22 ' HG2' ' C' ' 495' ' ' LYS . 44.0 mt -65.66 -32.15 73.56 Favored 'General case' 0 N--CA 1.46 0.07 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 280' ' ' ARG . . . . . 0.474 HH21 ' C19' ' A' ' 3' ' ' PCW . 54.6 mtt180 -72.07 -33.92 68.3 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 177.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.22 -39.51 89.64 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 178.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 282' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 83.4 mt-10 -65.0 -45.88 83.75 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 108.78 -0.822 . . . . 10.0 108.78 178.046 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 47.8 mt -63.5 -37.82 88.76 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 115.364 -0.835 . . . . 10.0 109.946 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -66.41 -56.46 10.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.48 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -59.03 -46.21 88.79 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.737 -0.468 . . . . 10.0 109.737 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -59.72 -49.94 73.12 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 111.336 -0.706 . . . . 10.0 111.336 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.12 -40.51 94.05 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 110.596 -0.15 . . . . 10.0 110.596 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 288' ' ' ARG . . . . . 0.431 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 90.0 mtt180 -61.36 -42.18 98.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.57 -0.286 . . . . 10.0 110.233 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -64.9 -51.14 63.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.31 0.576 . . . . 10.0 109.656 178.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 50.9 mttt -60.2 -46.41 89.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.195 -0.912 . . . . 10.0 110.957 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 19.9 mt -67.05 -39.81 86.99 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.954 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 292' ' ' HIS . . . . . 0.431 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 20.2 t-160 -58.12 -46.55 85.4 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 293' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 297' ' ' LYS . 0.2 OUTLIER -65.3 -45.67 83.44 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.86 179.367 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 294' ' ' LEU . . . . . 0.435 ' O ' ' HG ' ' A' ' 298' ' ' LEU . 88.8 mt -64.5 -42.64 95.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.43 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -63.47 -42.5 98.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.7 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -77.8 -6.72 55.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.025 0.44 . . . . 10.0 110.932 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 297' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 293' ' ' GLU . 14.1 tptt -94.28 -37.04 11.71 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.19 -1.041 . . . . 10.0 108.19 177.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 298' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 294' ' ' LEU . 79.8 mt -62.93 -24.49 67.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.381 -0.827 . . . . 10.0 111.48 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 299' ' ' SER . . . . . 0.522 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 0.7 OUTLIER -68.79 -65.12 1.4 Allowed Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 121.193 -0.203 . . . . 10.0 111.444 179.232 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 300' ' ' PRO . . . . . 0.522 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 30.8 Cg_endo -64.56 -42.86 14.95 Favored 'Trans proline' 0 C--N 1.358 1.047 0 C-N-CA 122.13 1.887 . . . . 10.0 111.894 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.813 HD22 ' HE2' ' C' ' 473' ' ' LYS . 45.0 mt -66.5 -29.98 70.21 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 179.027 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -72.73 -39.58 55.11 Favored Glycine 0 N--CA 1.445 -0.73 0 N-CA-C 110.265 -1.134 . . . . 10.0 110.265 178.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -61.27 -41.57 97.15 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.525 -0.917 . . . . 10.0 108.525 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 304' ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' ' 308' ' ' ARG . 96.9 mt-10 -62.15 -49.38 76.06 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.27 -0.877 . . . . 10.0 108.905 178.105 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -59.22 -41.12 87.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.052 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 -62.62 -48.75 78.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.768 0.318 . . . . 10.0 110.332 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.35 -39.82 89.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.003 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 308' ' ' ARG . . . . . 1.25 ' HG3' ' CD1' ' C' ' 469' ' ' LEU . 2.4 mmt85 -66.9 -37.91 85.27 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.773 -0.455 . . . . 10.0 109.773 178.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -67.89 -36.78 80.84 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.376 -0.972 . . . . 10.0 108.376 177.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 310' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' A' ' 310' ' ' ARG . 36.0 ttm180 -61.67 -50.49 72.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.352 -0.84 . . . . 10.0 108.896 178.185 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.08 -41.12 95.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.146 0.498 . . . . 10.0 109.684 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 312' ' ' HIS . . . . . 0.416 ' HA ' ' HD3' ' C' ' 462' ' ' LYS . 0.8 OUTLIER -57.65 -56.21 24.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.487 179.314 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 83.6 t -69.68 -42.24 80.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.475 -0.784 . . . . 10.0 112.306 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 314' ' ' ASP . . . . . 0.563 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 0.5 OUTLIER -64.26 -43.2 95.58 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.518 -0.473 . . . . 10.0 111.493 -179.655 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 315' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 319' ' ' HIS . . . -65.06 -32.37 74.05 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.491 -0.929 . . . . 10.0 108.491 178.224 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 12.8 mt -70.5 -32.52 70.05 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.3 -0.864 . . . . 10.0 109.566 178.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.563 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 95.3 mtt180 -64.69 -52.07 59.14 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 178.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.74 -11.31 58.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.829 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 319' ' ' HIS . . . . . 0.424 ' HB2' ' O ' ' A' ' 315' ' ' ALA . 0.1 OUTLIER -96.69 -47.47 5.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.975 178.97 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 320' ' ' LEU . . . . . 0.465 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 81.4 mt -67.71 -31.57 71.6 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.242 -0.436 . . . . 10.0 112.055 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 321' ' ' ALA . . . . . 0.409 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -55.86 -60.16 9.51 Favored Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 121.29 -0.164 . . . . 10.0 111.293 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.409 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 42.5 Cg_endo -70.06 -30.86 20.23 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 121.492 1.461 . . . . 10.0 110.69 178.286 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 323' ' ' TYR . . . . . 0.465 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 3.7 m-30 -63.19 -43.03 99.37 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 116.544 -0.298 . . . . 10.0 111.379 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 324' ' ' SER . . . . . 0.505 ' HA ' HD12 ' A' ' 327' ' ' LEU . 13.6 p -69.88 -30.83 68.38 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.087 -0.708 . . . . 10.0 109.087 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -68.5 -39.27 81.34 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.642 -0.873 . . . . 10.0 108.642 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 74.4 mt-10 -67.17 -36.29 81.48 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 107.859 -1.163 . . . . 10.0 107.859 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 327' ' ' LEU . . . . . 0.522 ' HA ' ' HG2' ' A' ' 330' ' ' ARG . 70.0 mt -61.82 -38.08 86.82 Favored 'General case' 0 C--O 1.222 -0.361 0 N-CA-C 108.681 -0.859 . . . . 10.0 108.681 178.02 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 328' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 328' ' ' ARG . 48.6 mtt180 -67.63 -33.28 74.65 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -67.17 -53.67 28.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.763 -0.653 . . . . 10.0 109.455 178.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 330' ' ' ARG . . . . . 0.539 ' O ' ' HG2' ' A' ' 334' ' ' ARG . 7.7 ptp180 -63.98 -39.46 94.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.915 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 19.0 mt -61.6 -43.55 98.65 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 178.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.82 -47.47 84.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.674 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.58 -47.37 85.84 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.348 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 334' ' ' ARG . . . . . 0.566 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 8.1 mmt180 -61.69 -44.67 96.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.336 179.273 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 63.5 mt -65.57 -44.05 87.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.775 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -61.5 -37.04 82.22 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.044 0.45 . . . . 10.0 110.354 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -74.53 -43.31 56.41 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.445 -0.576 . . . . 10.0 109.445 178.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 7.9 mt -63.8 -27.61 69.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.637 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -76.24 -40.35 52.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.893 0.378 . . . . 10.0 110.139 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -71.47 -53.96 12.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.064 -0.516 . . . . 10.0 109.633 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 341' ' ' ASN . . . . . 0.432 HD21 ' HA3' ' C' ' 436' ' ' GLY . 98.0 m-20 -65.89 -31.21 72.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.629 -0.714 . . . . 10.0 109.724 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -70.6 -42.61 62.71 Favored Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.141 -0.783 . . . . 10.0 111.141 178.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.18 -40.96 99.66 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 109.637 -1.385 . . . . 10.0 109.637 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -67.84 -43.01 80.5 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.157 -0.683 . . . . 10.0 109.157 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 20.9 mtt180 -54.55 -50.7 67.31 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.406 178.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 87.7 mt -58.98 -42.89 91.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.498 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -64.15 -45.79 86.9 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -60.36 -50.61 72.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.128 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -59.05 -43.72 91.72 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.062 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -68.74 -44.64 73.34 Favored 'General case' 0 C--N 1.33 -0.252 0 O-C-N 123.11 0.257 . . . . 10.0 111.434 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.57 -33.3 73.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.234 0.54 . . . . 10.0 110.688 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 352' ' ' LYS . . . . . 0.649 ' HG2' HG22 ' C' ' 422' ' ' VAL . 4.9 mtmm -86.75 -20.71 27.25 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.246 178.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -72.49 -38.74 68.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.086 -0.506 . . . . 10.0 109.764 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -40.63 94.79 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 178.436 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -69.16 -27.56 65.64 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.671 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -71.33 -47.77 54.52 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 108.159 -1.052 . . . . 10.0 108.159 177.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 84.9 mt -62.26 -43.2 99.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.124 -0.944 . . . . 10.0 111.984 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 10.0 p -60.43 -50.41 73.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.731 0.3 . . . . 10.0 111.095 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 7.5 p -66.38 -35.96 81.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.942 179.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 34.1 mt -67.27 -31.6 72.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.429 -0.35 . . . . 10.0 110.185 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 50.7 m -67.81 -29.34 68.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.147 0.499 . . . . 10.0 109.929 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 362' ' ' GLU . . . . . 0.45 ' C ' ' HD2' ' A' ' 366' ' ' PRO . 11.4 mt-10 -76.3 -5.18 45.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.526 0.679 . . . . 10.0 109.73 178.516 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.552 ' O ' ' HB3' ' A' ' 367' ' ' ALA . 39.6 mttm -109.13 -38.92 5.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.83 -0.804 . . . . 10.0 108.83 178.163 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -71.07 -21.12 62.28 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.502 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.817 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 99.5 mttt -105.62 -74.48 0.02 OUTLIER Pre-proline 0 CA--C 1.537 0.448 0 N-CA-C 112.457 0.54 . . . . 10.0 112.457 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.817 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 32.2 Cg_exo -59.63 -47.74 15.27 Favored 'Trans proline' 0 C--N 1.357 1.005 0 C-N-CA 122.27 1.98 . . . . 10.0 113.278 -179.273 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 367' ' ' ALA . . . . . 0.552 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -66.93 -43.19 83.9 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.912 -0.315 . . . . 10.0 111.327 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 1.1 mt -65.92 -39.05 90.18 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 121.03 -0.268 . . . . 10.0 110.901 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 369' ' ' GLU . . . . . 0.639 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 5.6 mm-40 -64.43 -38.55 91.42 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.036 -0.728 . . . . 10.0 109.036 178.252 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -63.37 -41.44 98.82 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 79.3 mt -62.82 -45.0 94.66 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.362 -0.836 . . . . 10.0 110.006 178.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 72.0 mtt180 -64.95 -40.11 94.52 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.583 -0.525 . . . . 10.0 109.583 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.639 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.5 mt-30 -63.54 -30.97 72.01 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.56 -0.745 . . . . 20.0 112.051 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -85.75 -34.85 12.43 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 109.481 -1.448 . . . . 10.0 109.481 178.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 13.9 mt -57.11 -41.88 79.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.652 -0.274 . . . . 10.0 111.51 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 72.8 mt -54.34 -62.98 3.14 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 112.491 0.552 . . . . 10.0 112.491 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -63.39 -37.52 48.87 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 121.836 1.691 . . . . 10.0 111.657 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 18.3 t -61.66 -49.39 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 O-C-N 122.986 0.179 . . . . 10.0 110.677 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 59.4 mt -61.38 -39.45 90.72 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.503 -0.554 . . . . 10.0 109.503 178.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 380' ' ' GLU . . . . . 0.499 ' O ' HG23 ' A' ' 384' ' ' VAL . 19.1 mt-10 -63.24 -49.28 74.75 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.678 178.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 5.1 p -63.02 -38.92 93.11 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 120.928 0.394 . . . . 10.0 110.541 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -65.42 -43.43 90.52 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.737 178.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 383' ' ' LYS . . . . . 0.441 ' O ' ' HG ' ' A' ' 387' ' ' LEU . 83.5 mttt -61.81 -40.25 94.59 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.357 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 384' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 380' ' ' GLU . 73.2 t -60.43 -44.99 97.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 13.5 m -63.73 -42.66 97.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.706 178.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -64.38 -41.13 96.84 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.941 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 383' ' ' LYS . 83.6 mt -60.1 -37.95 81.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.37 0.605 . . . . 10.0 110.372 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 388' ' ' SER . . . . . 0.736 ' HB3' ' HE2' ' C' ' 594' ' ' LYS . 13.1 m -77.27 -41.11 42.22 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.681 -0.69 . . . . 10.0 110.002 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -62.83 -43.52 98.58 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.692 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 77.6 mt -65.54 -32.46 74.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.852 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -66.14 -49.04 68.84 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 179.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.49 -29.05 70.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.742 -0.663 . . . . 10.0 109.891 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -67.86 -20.87 65.18 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.48 0.712 . . . . 10.0 111.078 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.89 12.07 31.08 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 121.091 0.472 . . . . 10.0 110.705 -179.187 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 395' ' ' LYS . . . . . 0.793 ' O ' ' HB2' ' A' ' 396' ' ' LYS . 46.3 mtmt -129.48 154.03 47.39 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.09 0.471 . . . . 10.0 111.265 179.101 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 396' ' ' LYS . . . . . 0.793 ' HB2' ' O ' ' A' ' 395' ' ' LYS . 99.4 mttt 90.08 -54.63 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.891 0 N-CA-C 112.914 0.709 . . . . 10.0 112.914 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 96.0 mt -59.91 -44.23 94.41 Favored 'General case' 0 C--N 1.353 0.734 0 N-CA-C 112.673 0.62 . . . . 10.0 112.673 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 . . . . . 0 CA--C 1.512 -0.506 0 N-CA-C 108.199 -1.037 . . . . 10.0 108.199 178.382 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 89.8 mt . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 108.574 -0.898 . . . . 10.0 108.574 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt 79.19 -56.02 0.43 Allowed 'General case' 0 C--O 1.236 0.391 0 CA-C-N 113.64 -1.618 . . . . 10.0 110.99 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.89 -32.41 71.86 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 120.783 0.325 . . . . 10.0 111.518 179.068 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 12.9 mt -78.08 -31.61 50.27 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.874 -0.417 . . . . 10.0 109.874 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -71.81 -47.87 50.29 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.009 -0.996 . . . . 10.0 111.51 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -62.91 -42.58 99.84 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 114.956 -1.02 . . . . 10.0 110.567 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -37.43 75.98 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 123.337 0.398 . . . . 10.0 110.563 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -62.18 -44.15 97.24 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.326 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 3.1 m -64.89 -36.11 83.3 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.331 0.586 . . . . 10.0 109.582 178.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 62.4 t -67.47 -46.95 82.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.06 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 52.6 m -60.83 -43.58 98.07 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.441 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 28.7 m -62.71 -40.41 97.05 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 120.846 0.355 . . . . 10.0 110.633 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 10.9 p -76.65 -11.23 59.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 10.0 111.057 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 412' ' ' PHE . . . . . 0.511 ' O ' ' HB2' ' C' ' 415' ' ' LEU . 45.8 t80 -85.6 -38.59 18.27 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 108.667 -0.864 . . . . 10.0 108.667 177.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 24.9 m -62.25 -39.91 94.42 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.616 -0.883 . . . . 10.0 108.616 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -66.49 -19.81 65.88 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.284 -0.871 . . . . 10.0 110.451 178.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 415' ' ' LEU . . . . . 0.511 ' HB2' ' O ' ' C' ' 412' ' ' PHE . 30.1 mt -76.37 -32.97 58.91 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 108.529 -0.915 . . . . 10.0 108.529 177.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 -74.16 -42.59 59.68 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 178.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -68.17 -14.09 62.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.624 -0.717 . . . . 10.0 109.852 178.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -94.67 -53.72 3.77 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.171 -0.922 . . . . 10.0 108.989 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 419' ' ' LEU . . . . . 0.419 ' HA ' ' HB ' ' C' ' 422' ' ' VAL . 43.5 mt -60.32 -28.92 68.52 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.711 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -54.19 -73.03 0.45 Allowed Glycine 0 CA--C 1.518 0.256 0 N-CA-C 111.37 -0.692 . . . . 10.0 111.37 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.32 -34.9 98.67 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.391 2.061 . . . . 10.0 111.177 178.432 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 422' ' ' VAL . . . . . 0.649 HG22 ' HG2' ' A' ' 352' ' ' LYS . 12.6 t -58.87 -50.0 81.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.273 -0.422 . . . . 10.0 111.08 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 18.4 p -70.22 -38.2 75.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.66 0.267 . . . . 10.0 110.805 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -60.52 -48.32 82.27 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.816 -0.439 . . . . 10.0 109.816 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -67.39 -37.75 83.61 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.077 -0.511 . . . . 10.0 109.624 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -63.19 -36.91 85.2 Favored 'General case' 0 C--O 1.225 -0.188 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 28.4 m95 -66.27 -42.9 87.79 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 178.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 428' ' ' ASP . . . . . 0.554 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 37.7 t70 -65.17 -37.31 86.98 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.972 -0.751 . . . . 10.0 108.972 178.341 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -65.28 -44.79 86.9 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.702 -0.851 . . . . 10.0 108.702 177.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 46.9 mt -62.38 -32.43 73.24 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.469 -0.787 . . . . 10.0 109.371 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -66.37 -41.6 89.23 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 178.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 432' ' ' LYS . . . . . 0.554 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 53.0 mttp -64.72 -45.27 87.22 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 108.423 -0.954 . . . . 10.0 108.423 178.238 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -61.2 -48.42 81.63 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.051 -0.977 . . . . 10.0 110.734 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 10.7 p -66.17 -38.6 88.44 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.826 -0.17 . . . . 10.0 111.195 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -61.59 -47.59 84.76 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.843 -0.799 . . . . 10.0 108.843 178.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 436' ' ' GLY . . . . . 0.432 ' HA3' HD21 ' A' ' 341' ' ' ASN . . . -63.87 -46.5 91.49 Favored Glycine 0 N--CA 1.443 -0.889 0 N-CA-C 110.048 -1.221 . . . . 10.0 110.048 177.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 34.6 mt -58.61 -33.26 69.81 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-O 120.517 0.199 . . . . 10.0 110.925 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -70.32 -38.29 74.9 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 178.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -71.39 -30.54 66.24 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.017 -0.735 . . . . 10.0 109.017 178.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 440' ' ' GLU . . . . . 0.566 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 37.4 mt-10 -75.29 -57.56 3.82 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.253 -0.885 . . . . 10.0 109.782 178.506 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 95.7 mmm -61.71 -29.21 69.95 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 113.743 1.016 . . . . 10.0 113.743 -178.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 5.5 p -63.15 -51.87 64.72 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -71.62 -36.23 70.71 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.587 -0.733 . . . . 10.0 109.531 178.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 444' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 5.7 t0 -57.29 -57.72 11.39 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.503 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 24.9 mt -64.18 -37.13 86.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.568 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -62.67 -49.94 73.16 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 178.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 447' ' ' GLU . . . . . 0.474 ' HB3' HH21 ' A' ' 330' ' ' ARG . 7.5 tt0 -66.14 -34.02 77.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.661 -0.7 . . . . 10.0 109.662 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 448' ' ' VAL . . . . . 0.534 HG23 HH22 ' A' ' 330' ' ' ARG . 2.6 t -60.96 -46.93 95.63 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.232 0 N-CA-C 109.367 -0.605 . . . . 10.0 109.367 178.493 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 83.9 mttt -67.21 -38.38 85.21 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 178.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -70.35 -11.69 61.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.318 178.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 451' ' ' LYS . . . . . 0.637 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 43.3 mttm -98.76 -50.1 4.35 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.541 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 63.0 t -58.22 -41.71 81.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.688 -0.687 . . . . 10.0 111.998 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -53.95 -63.52 2.57 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 112.213 0.449 . . . . 10.0 112.213 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 454' ' ' PRO . . . . . 0.418 ' HG2' ' OH ' ' A' ' 323' ' ' TYR . 43.1 Cg_endo -70.98 -20.9 28.5 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 121.643 1.562 . . . . 10.0 111.789 179.025 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 455' ' ' TYR . . . . . 0.637 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.4 OUTLIER -70.0 -50.85 37.4 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 179.1 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 456' ' ' LEU . . . . . 0.457 ' O ' ' HB2' ' C' ' 460' ' ' GLN . 17.5 mt -69.47 -36.31 76.45 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.061 -0.518 . . . . 10.0 109.915 179.154 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 457' ' ' ASP . . . . . 0.426 ' O ' ' HG3' ' C' ' 461' ' ' LYS . 7.7 t70 -62.13 -40.45 95.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.286 0.565 . . . . 10.0 110.558 179.011 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -79.33 -42.67 25.16 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.621 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 459' ' ' PHE . . . . . 0.444 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 1.0 OUTLIER -63.31 -40.89 98.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.662 179.377 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 460' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' C' ' 456' ' ' LEU . 14.3 mt-30 -62.44 -36.61 82.97 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.446 179.02 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 461' ' ' LYS . . . . . 0.426 ' HG3' ' O ' ' C' ' 457' ' ' ASP . 17.9 mttp -67.35 -40.6 85.84 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.054 -0.721 . . . . 10.0 109.054 178.379 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 462' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' C' ' 466' ' ' GLU . 15.5 mtmm -65.7 -43.74 88.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.324 178.434 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 463' ' ' TRP . . . . . 0.499 ' O ' ' HB2' ' C' ' 467' ' ' MET . 23.6 m0 -66.39 -34.4 77.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.15 178.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 464' ' ' GLN . . . . . 0.553 ' O ' ' HG3' ' C' ' 468' ' ' GLU . 37.6 mt-30 -67.0 -53.03 35.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.281 179.234 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 0.979 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 4.1 pt-20 -63.3 -31.61 72.8 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.076 0.465 . . . . 10.0 110.295 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 466' ' ' GLU . . . . . 0.506 ' HA ' HD12 ' C' ' 469' ' ' LEU . 6.9 tt0 -73.83 -37.82 64.72 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.188 -0.671 . . . . 10.0 109.188 178.615 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 467' ' ' MET . . . . . 0.499 ' HB2' ' O ' ' C' ' 463' ' ' TRP . 0.0 OUTLIER -63.64 -45.73 88.9 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.743 -0.836 . . . . 10.0 108.743 178.609 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 468' ' ' GLU . . . . . 0.553 ' HG3' ' O ' ' C' ' 464' ' ' GLN . 46.4 mt-10 -62.42 -40.45 96.58 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.498 -0.927 . . . . 10.0 108.498 178.008 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 1.25 ' CD1' ' HG3' ' A' ' 308' ' ' ARG . 96.4 mt -61.92 -40.16 94.53 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 115.169 -0.923 . . . . 20.0 110.0 178.416 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 470' ' ' TYR . . . . . 0.65 ' HB3' ' H70' ' A' ' 76' ' ' 17F . 13.8 m-30 -67.23 -41.26 86.0 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.501 178.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -60.82 -48.57 81.21 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 472' ' ' GLN . . . . . 0.453 HE21 ' HB3' ' C' ' 472' ' ' GLN . 0.0 OUTLIER -82.34 28.12 0.47 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.595 179.596 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 473' ' ' LYS . . . . . 0.813 ' HE2' HD22 ' A' ' 301' ' ' LEU . 0.0 OUTLIER -134.99 -62.78 0.71 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.383 -0.826 . . . . 10.0 109.028 178.675 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 61.8 t -65.66 -39.11 83.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.26 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -62.42 -58.62 16.18 Favored Pre-proline 0 CA--C 1.535 0.394 0 N-CA-C 112.061 0.393 . . . . 10.0 112.061 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -63.52 -37.88 45.39 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 121.649 1.566 . . . . 10.0 111.389 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 477' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' C' ' 477' ' ' LEU . 29.2 mt -66.98 -31.38 71.91 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.49 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -63.56 -36.19 82.98 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -70.89 -43.31 68.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.492 178.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.95 -43.61 95.29 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 59.1 mt -68.95 -30.48 68.94 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.551 -0.75 . . . . 10.0 110.195 178.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -66.97 -47.54 71.27 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -69.26 -34.27 74.51 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -68.21 -40.94 87.56 Favored Glycine 0 N--CA 1.445 -0.724 0 N-CA-C 109.873 -1.291 . . . . 10.0 109.873 177.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.41 76.72 Favored 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 44.8 mtt180 -61.73 -41.56 97.8 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 487' ' ' GLN . . . . . 0.542 ' O ' ' HG3' ' C' ' 491' ' ' GLU . 0.4 OUTLIER -63.69 -44.22 94.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.363 178.007 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 488' ' ' LYS . . . . . 0.402 ' O ' ' HG ' ' C' ' 492' ' ' LEU . 83.0 tttt -67.14 -40.4 86.74 Favored 'General case' 0 C--N 1.33 -0.249 0 O-C-N 123.276 0.36 . . . . 10.0 110.355 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 45.6 mt -64.76 -44.51 89.83 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.349 -0.611 . . . . 10.0 109.349 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.04 -39.19 91.48 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 108.795 -0.817 . . . . 10.0 108.795 178.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 491' ' ' GLU . . . . . 0.726 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 36.7 mt-10 -61.71 -49.97 74.31 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 108.133 -1.062 . . . . 10.0 108.133 177.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 492' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' C' ' 488' ' ' LYS . 90.3 mt -58.89 -37.34 76.36 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.872 -0.603 . . . . 10.0 110.674 179.427 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -63.69 -37.05 85.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.91 0.386 . . . . 10.0 110.151 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -88.93 -0.88 57.78 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.626 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.869 ' HG2' HD22 ' A' ' 279' ' ' LEU . 12.3 mttm -113.37 -55.75 2.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.817 0.341 . . . . 10.0 110.998 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 90.8 mt -64.96 -31.52 72.8 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.913 0.709 . . . . 10.0 112.913 -178.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 12.8 m -68.14 -59.09 6.69 Favored Pre-proline 0 CA--C 1.537 0.459 0 C-N-CA 120.722 -0.391 . . . . 10.0 112.005 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -62.63 -36.63 62.8 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.745 1.63 . . . . 10.0 110.866 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 34.5 mt -71.04 -34.96 71.77 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.095 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -65.7 -49.56 58.96 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 110.725 -0.95 . . . . 10.0 110.725 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.11 -41.63 97.03 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 178.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 502' ' ' GLU . . . . . 0.474 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 25.0 tt0 -64.84 -47.61 77.34 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.493 -0.776 . . . . 10.0 109.819 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 503' ' ' MET . . . . . 0.786 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 62.9 mmm -59.44 -38.05 79.7 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.752 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 20.5 mtt85 -64.98 -40.47 95.03 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 178.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 505' ' ' ASP . . . . . 0.519 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 0.4 OUTLIER -70.63 -36.1 73.27 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 178.599 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.786 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 44.3 mtt180 -62.87 -45.86 90.57 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 107.442 -1.318 . . . . 10.0 107.442 177.23 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -62.21 -38.73 90.29 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 114.857 -1.065 . . . . 10.0 109.361 178.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 508' ' ' ARG . . . . . 0.519 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 78.7 mtt180 -58.3 -53.57 56.81 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.111 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 509' ' ' ALA . . . . . 0.526 ' HB1' ' HD2' ' A' ' 264' ' ' LYS . . . -60.08 -36.14 76.73 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.485 -0.78 . . . . 10.0 111.144 179.446 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 510' ' ' HIS . . . . . 0.5 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 16.2 m-70 -74.47 -49.64 21.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.577 0.227 . . . . 10.0 111.549 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 79.2 t -65.74 -41.67 90.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 120.715 0.293 . . . . 10.0 110.509 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.403 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 3.3 t70 -63.97 -37.41 87.32 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.48 -44.78 86.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.344 -0.984 . . . . 10.0 108.344 177.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 514' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 89.2 mt -58.99 -32.67 69.89 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.372 178.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 515' ' ' ARG . . . . . 0.403 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 66.4 mtt180 -65.04 -34.7 79.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.326 178.802 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.3 5.19 46.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.684 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -117.22 -43.97 2.81 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.848 0.314 . . . . 10.0 111.848 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 92.1 mt -90.07 -47.83 7.57 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.409 0.522 . . . . 10.0 112.409 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 519' ' ' ALA . . . . . 0.411 ' N ' ' HD2' ' C' ' 520' ' ' PRO . . . -50.54 -55.37 26.68 Favored Pre-proline 0 N--CA 1.468 0.472 0 N-CA-C 112.904 0.705 . . . . 10.0 112.904 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 520' ' ' PRO . . . . . 0.411 ' HD2' ' N ' ' C' ' 519' ' ' ALA . 29.7 Cg_endo -64.91 -31.8 56.0 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 121.692 1.595 . . . . 10.0 110.701 178.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -64.11 -43.85 94.06 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.725 -0.67 . . . . 10.0 109.786 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.85 -31.24 71.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.001 0.429 . . . . 10.0 109.968 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 523' ' ' ASP . . . . . 0.688 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 30.3 t70 -70.02 -39.14 75.97 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.425 -0.583 . . . . 10.0 109.425 178.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -72.38 -33.23 67.05 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 177.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 525' ' ' LEU . . . . . 0.741 HD23 ' HD2' ' C' ' 528' ' ' ARG . 25.3 mt -66.89 -29.13 68.94 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.541 -0.754 . . . . 10.0 109.23 177.663 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 526' ' ' ARG . . . . . 0.688 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 63.5 mtt180 -60.91 -38.62 86.37 Favored 'General case' 0 C--O 1.224 -0.249 0 N-CA-C 109.681 -0.489 . . . . 10.0 109.681 178.537 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -66.95 -44.47 80.5 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.831 -0.803 . . . . 10.0 108.831 178.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 528' ' ' ARG . . . . . 0.741 ' HD2' HD23 ' C' ' 525' ' ' LEU . 77.6 mtt180 -63.85 -41.77 97.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 114.849 -1.069 . . . . 10.0 110.662 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 62.1 mt -68.09 -43.18 79.08 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.256 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.87 -43.51 98.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.922 179.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.3 -45.1 77.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.361 -0.381 . . . . 10.0 110.153 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 532' ' ' ARG . . . . . 0.569 ' NH2' ' HB3' ' C' ' 528' ' ' ARG . 1.1 ttm180 -61.9 -40.58 95.96 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 533' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' C' ' 537' ' ' LYS . 18.9 mt -64.29 -36.6 84.64 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.021 178.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -66.37 -40.92 90.02 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.839 -0.43 . . . . 10.0 109.839 178.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.26 -45.8 86.49 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 178.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 91.6 mt -69.94 -19.05 63.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.539 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 537' ' ' LYS . . . . . 0.501 ' HB2' ' O ' ' C' ' 533' ' ' LEU . 64.7 tttt -82.23 -44.37 16.42 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.662 -0.496 . . . . 10.0 109.662 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -68.6 -50.23 53.17 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 539' ' ' ASN . . . . . 0.576 ' OD1' ' HE3' ' A' ' 234' ' ' LYS . 69.8 m-20 -67.97 -37.58 81.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.727 -0.669 . . . . 10.0 109.388 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 540' ' ' GLY . . . . . 0.517 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -65.75 -43.04 94.84 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.251 -0.74 . . . . 10.0 111.251 179.228 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -63.18 -42.54 99.39 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 110.399 -1.08 . . . . 10.0 110.399 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -64.3 -42.69 96.24 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 543' ' ' ARG . . . . . 0.401 ' HD2' HH11 ' C' ' 543' ' ' ARG . 44.4 mtt85 -60.14 -39.54 86.71 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.367 179.084 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 544' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 79.8 mt -58.62 -42.23 87.76 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 178.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.92 -45.33 74.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.754 -0.657 . . . . 10.0 109.437 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -60.0 -48.49 81.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.318 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -59.72 -39.84 86.03 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.261 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 40.5 m170 -65.98 -43.26 88.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.449 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.48 -44.8 85.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.091 -0.504 . . . . 10.0 109.876 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 550' ' ' LYS . . . . . 0.473 ' HA ' ' OE1' ' C' ' 553' ' ' GLU . 0.2 OUTLIER -67.85 -27.33 66.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.256 179.345 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.62 -44.7 73.66 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.163 -0.68 . . . . 10.0 109.163 178.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.94 -38.19 85.71 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.702 -0.481 . . . . 10.0 109.702 178.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 553' ' ' GLU . . . . . 0.473 ' OE1' ' HA ' ' C' ' 550' ' ' LYS . 85.2 mt-10 -63.86 -36.71 84.83 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -72.05 -45.65 59.97 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.105 178.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 63.1 mt -61.68 -38.74 88.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.099 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 33.9 m -64.4 -46.35 83.68 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.5 -0.318 . . . . 10.0 110.38 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 1.1 p -69.47 -26.94 64.81 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.103 0.477 . . . . 10.0 110.694 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 54.2 mt -77.91 -25.84 48.68 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.391 178.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 56.7 m -64.59 -41.24 96.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.042 0.449 . . . . 10.0 111.112 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -72.96 -11.47 60.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.176 0.512 . . . . 10.0 111.005 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 561' ' ' LYS . . . . . 0.51 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 11.3 mptt -104.51 -28.13 11.48 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.792 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -83.96 -18.49 37.09 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.433 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 563' ' ' LYS . . . . . 0.853 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 50.0 mtmt -112.29 -74.9 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.348 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 564' ' ' PRO . . . . . 0.853 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 74.7 Cg_exo -52.92 -49.19 18.45 Favored 'Trans proline' 0 C--N 1.359 1.081 0 C-N-CA 122.171 1.914 . . . . 10.0 112.517 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 565' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -64.07 -40.18 95.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.698 0.285 . . . . 10.0 110.923 179.515 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 49.5 tp -66.78 -38.87 87.41 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.579 -0.282 . . . . 10.0 110.46 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 567' ' ' GLU . . . . . 0.928 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 4.0 mm-40 -59.06 -45.56 90.46 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.671 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -68.91 -41.59 77.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.449 178.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 43.6 mt -58.98 -44.93 91.66 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.837 0.351 . . . . 10.0 110.123 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 570' ' ' ARG . . . . . 0.454 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 60.1 mtt180 -68.85 -35.54 77.07 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.576 -0.528 . . . . 10.0 109.576 178.51 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 571' ' ' GLN . . . . . 0.928 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.6 mt-30 -66.28 -30.68 71.16 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.447 -0.797 . . . . 20.0 111.346 179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -84.02 -35.76 14.73 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 109.429 -1.468 . . . . 10.0 109.429 178.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 17.8 mt -62.28 -34.47 76.63 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 122.044 0.138 . . . . 10.0 111.302 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 574' ' ' LEU . . . . . 0.6 ' O ' ' HG3' ' C' ' 578' ' ' GLU . 91.4 mt -55.63 -63.25 3.34 Favored Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 112.003 0.372 . . . . 10.0 112.003 179.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 575' ' ' PRO . . . . . 0.428 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 36.5 Cg_endo -67.38 -29.25 38.34 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.877 1.718 . . . . 10.0 111.708 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 4.7 t -64.9 -45.21 95.49 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 N-CA-C 109.343 -0.614 . . . . 10.0 109.343 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 577' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' C' ' 581' ' ' LYS . 26.7 mt -64.5 -39.51 93.93 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.614 -0.513 . . . . 10.0 109.614 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 578' ' ' GLU . . . . . 0.6 ' HG3' ' O ' ' C' ' 574' ' ' LEU . 48.2 mt-10 -63.17 -51.19 67.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.056 179.234 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 4.7 p -62.19 -41.33 98.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.779 0.323 . . . . 10.0 110.343 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -61.7 -48.27 81.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.072 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 581' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' C' ' 577' ' ' LEU . 41.8 mtmt -58.75 -46.77 86.7 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.406 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.95 -48.49 83.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.887 0.375 . . . . 10.0 110.286 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 16.2 m -61.62 -44.06 97.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.109 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -66.97 -41.18 87.3 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.521 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 585' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' C' ' 581' ' ' LYS . 73.2 mt -59.28 -51.28 70.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.875 0.369 . . . . 10.0 110.483 179.528 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 13.1 m -63.87 -35.23 79.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.652 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 587' ' ' ALA . . . . . 0.5 ' HB2' ' HD3' ' A' ' 396' ' ' LYS . . . -67.8 -45.35 75.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.574 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 86.2 mt -65.11 -37.03 86.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.011 0.434 . . . . 10.0 110.311 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -66.6 -29.77 69.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.461 179.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -79.5 -44.66 20.81 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.046 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -63.59 -41.89 98.32 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.805 0.669 . . . . 10.0 112.805 -179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 592' ' ' THR . . . . . 0.457 ' O ' ' HB2' ' C' ' 596' ' ' ASN . 2.1 p -60.69 -28.59 68.74 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.836 0.31 . . . . 10.0 111.836 -179.802 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -69.19 -40.21 78.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.043 0.449 . . . . 10.0 110.499 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 594' ' ' LYS . . . . . 0.736 ' HE2' ' HB3' ' A' ' 388' ' ' SER . 5.1 mptt -76.68 -37.61 55.9 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.96 -0.564 . . . . 10.0 111.105 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 90.1 mt -85.36 34.53 0.57 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.649 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 596' ' ' ASN . . . . . 0.457 ' HB2' ' O ' ' C' ' 592' ' ' THR . 9.2 t-20 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.515 -0.755 . . . . 10.0 110.007 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 19.5 ttt . . . . . 0 C--O 1.23 0.07 0 CA-C-O 121.392 0.615 . . . . 10.0 110.0 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 14.6 t -98.61 168.26 10.28 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.106 -0.952 . . . . 10.0 110.601 -179.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.441 ' HA ' ' O ' ' B' ' 52' ' ' LEU . 24.9 tt0 -116.29 101.37 8.62 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.884 -0.413 . . . . 10.0 109.884 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -73.7 144.49 45.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.676 -178.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.419 ' HB3' ' HA2' ' B' ' 75' ' ' GLY . 4.0 mptt -100.37 113.91 27.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.493 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.62 HD22 HD23 ' B' ' 159' ' ' LEU . 34.3 mt -110.01 108.9 19.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.49 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 58.8 t -101.89 115.09 43.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-O 120.961 0.41 . . . . 10.0 110.918 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 21.3 t -91.73 117.74 35.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.537 ' HB ' ' CE1' ' B' ' 96' ' ' TYR . 26.8 m -112.88 165.45 7.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 120.995 0.426 . . . . 10.0 111.327 -179.477 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 151.07 174.23 21.8 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.21 -0.756 . . . . 10.0 111.21 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.16 177.29 6.01 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.922 0.391 . . . . 10.0 111.271 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.84 125.64 8.48 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.873 -0.679 . . . . 10.0 111.775 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 115.24 -12.98 19.19 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.775 -0.726 . . . . 10.0 112.514 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 20.9 m -72.54 -31.73 38.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 112.003 0.371 . . . . 10.0 112.003 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 93.65 43.4 3.94 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.54 -0.838 . . . . 10.0 113.204 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 42.0 mtmt -62.13 -46.88 87.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.854 0.359 . . . . 10.0 111.64 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.5 p -63.26 -36.52 83.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.465 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.48 -47.15 82.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.653 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 45.1 mt -62.69 -44.27 96.67 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.918 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 12.7 m -64.88 -50.15 67.67 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.672 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 97.4 mt -65.43 -28.26 43.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-O 120.782 0.325 . . . . 10.0 110.999 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.644 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 6.5 tp-100 -68.29 -22.62 64.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.153 0.501 . . . . 10.0 110.8 179.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.7 tp -96.93 -41.48 8.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.306 0.574 . . . . 10.0 110.481 179.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' ILE . . . . . 0.644 ' HA ' ' HD2' ' B' ' 42' ' ' LYS . 51.1 mm -73.88 -49.16 35.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.691 -0.686 . . . . 10.0 112.506 -178.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -107.83 -18.92 13.69 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.092 0.404 . . . . 10.0 112.092 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.552 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 33.1 m-80 66.61 35.22 5.45 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.468 -0.938 . . . . 10.0 108.468 -177.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -124.53 130.99 53.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 114.183 -1.371 . . . . 10.0 109.628 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -93.51 134.76 35.45 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.456 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 16.7 m -100.43 138.41 24.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.996 0.427 . . . . 10.0 111.031 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -103.46 -26.57 12.82 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.508 0.671 . . . . 10.0 109.838 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -78.38 148.31 33.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.384 -0.826 . . . . 10.0 110.726 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.43 ' HA ' H5'2 ' B' ' 201' ' ' GNP . 54.3 t80 -91.47 77.64 5.74 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.651 -0.5 . . . . 10.0 109.651 178.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.85 134.91 68.06 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.094 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.49 177.17 3.48 Favored 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 123.081 2.521 . . . . 10.0 112.849 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -166.72 135.37 2.82 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.199 0.523 . . . . 10.0 112.163 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.823 HD11 HG21 ' D' ' 809' ' ' THR . 4.3 mt -119.98 -67.01 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 108.551 -0.907 . . . . 10.0 108.551 179.081 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.453 ' O ' HG23 ' D' ' 821' ' ' VAL . 4.0 tt0 -146.08 92.39 2.19 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.372 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 38' ' ' ASP . . . . . 0.711 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 57.7 m-20 -111.79 160.84 16.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.379 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 39' ' ' SER . . . . . 0.415 ' HA ' ' O ' ' B' ' 55' ' ' ILE . 1.7 p -148.1 139.89 23.88 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.643 -0.253 . . . . 10.0 111.594 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 40' ' ' TYR . . . . . 0.659 ' CE2' HG22 ' D' ' 840' ' ' VAL . 24.3 m-85 -125.53 145.28 50.18 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -178.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 41' ' ' ARG . . . . . 0.459 ' NH1' ' HD3' ' D' ' 817' ' ' LYS . 1.2 ttp180 -126.81 127.98 45.85 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.754 0.311 . . . . 10.0 111.561 -178.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 42' ' ' LYS . . . . . 0.644 ' HD2' ' HA ' ' B' ' 24' ' ' ILE . 37.9 tttp -151.24 150.69 30.87 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.589 178.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 43' ' ' GLN . . . . . 0.522 ' OE1' ' H1A' ' A' ' 38' ' ' 17F . 14.6 tt0 -114.07 125.2 53.71 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 110.326 -0.249 . . . . 10.0 110.326 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 10.3 m -136.19 158.83 38.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.965 0.412 . . . . 10.0 110.848 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 47.2 t -99.77 107.11 20.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.414 -0.587 . . . . 10.0 109.414 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 72.7 mt -106.19 120.01 56.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.82 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.88 16.1 7.71 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.808 0.67 . . . . 10.0 112.808 178.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.21 -9.03 45.64 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.755 -0.736 . . . . 10.0 112.666 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -106.97 124.33 49.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.037 0.446 . . . . 10.0 110.665 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.438 HG21 ' H62' ' A' ' 5' ' ' PCW . 9.5 t -85.75 128.1 34.71 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.101 -0.499 . . . . 10.0 109.742 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 1.6 p -144.71 163.05 35.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.866 0.365 . . . . 10.0 111.42 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' B' ' 3' ' ' GLU . 15.1 tp -97.5 135.75 38.91 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.09 -0.708 . . . . 10.0 109.09 179.621 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 90.6 mt -113.6 122.72 48.06 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 111.986 0.365 . . . . 10.0 111.986 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -103.53 102.33 12.23 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.103 -1.073 . . . . 10.0 108.103 177.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.566 HD12 HD11 ' B' ' 24' ' ' ILE . 44.8 mt -93.58 129.52 43.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.447 -178.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.406 HD21 ' CD1' ' B' ' 71' ' ' TYR . 53.4 tp -105.94 116.0 31.2 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.943 -0.572 . . . . 10.0 111.206 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.711 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 7.3 t0 -92.97 93.2 8.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.236 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 48.7 p -72.61 162.71 29.13 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.203 -0.908 . . . . 10.0 112.155 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.6 159.07 32.68 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.232 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -80.05 -32.07 37.03 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.747 -0.739 . . . . 10.0 111.918 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -139.24 128.45 23.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.618 0.247 . . . . 20.0 110.541 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -169.92 142.88 2.46 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.591 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -100.98 -141.33 0.34 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.252 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -68.22 122.43 18.3 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 65' ' ' SER . . . . . 0.4 ' HB3' ' HB3' ' B' ' 68' ' ' ARG . 13.5 t -144.99 125.08 13.61 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.172 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 66' ' ' ALA . . . . . 0.467 ' O ' ' H61' ' A' ' 6' ' ' PCW . . . -62.27 -31.79 72.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.111 0.482 . . . . 10.0 109.909 179.253 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 40.7 mmm -70.86 -44.52 66.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.691 -0.686 . . . . 10.0 109.599 179.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.554 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 47.9 ttt85 -63.27 -44.86 93.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.71 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.446 ' O ' ' HB2' ' B' ' 73' ' ' ARG . 0.1 OUTLIER -59.25 -20.84 57.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.677 -0.692 . . . . 10.0 111.593 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.93 -47.92 6.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.114 179.267 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 71' ' ' TYR . . . . . 0.554 ' CE2' ' HA ' ' B' ' 68' ' ' ARG 0.253 0.5 OUTLIER -66.01 -28.52 68.94 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 113.121 0.786 . . . . 10.0 113.121 -178.968 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 2.7 mtp -91.82 4.07 53.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.185 0.517 . . . . 10.0 110.609 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 73' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' B' ' 69' ' ' ASP . 11.7 ttm180 -98.33 -28.35 13.7 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.135 0.493 . . . . 10.0 110.402 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.6 -5.7 53.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.615 -0.72 . . . . 10.0 112.119 -179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 75' ' ' GLY . . . . . 0.419 ' HA2' ' HB3' ' B' ' 5' ' ' LYS . . . -83.15 144.16 22.46 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.552 -0.832 . . . . 10.0 112.701 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -96.68 -49.28 5.16 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.033 0.444 . . . . 10.0 110.005 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -112.19 139.61 15.73 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 111.203 -0.759 . . . . 10.0 111.203 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.403 ' O ' ' HA ' ' B' ' 111' ' ' MET . 62.2 m-85 -121.25 123.58 42.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.166 0.507 . . . . 10.0 111.999 -179.079 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.921 ' HG ' HD22 ' B' ' 159' ' ' LEU . 45.0 mt -95.4 108.72 20.94 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.107 179.325 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 11.4 m -84.58 88.93 7.36 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.991 -0.374 . . . . 10.0 109.991 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.497 HG22 ' HB ' ' B' ' 114' ' ' VAL . 43.7 t -90.52 127.72 42.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.78 -178.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.7 ' HB3' HD11 ' B' ' 93' ' ' ILE . 29.2 p90 -132.78 159.38 39.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.108 178.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.409 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -96.04 119.86 35.29 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.993 -0.373 . . . . 10.0 109.993 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 84' ' ' ILE . . . . . 0.737 HD11 ' HA ' ' B' ' 118' ' ' CYS . 13.1 pt -69.6 -5.45 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 112.231 0.456 . . . . 10.0 112.231 -179.292 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 85' ' ' ASN . . . . . 0.409 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 4.4 p-10 -94.33 -1.8 53.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.984 0.421 . . . . 10.0 110.949 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -138.86 112.34 8.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.244 -0.434 . . . . 10.0 110.693 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 87' ' ' THR . . . . . 0.456 ' O ' ' HG3' ' B' ' 91' ' ' GLU . 0.2 OUTLIER -60.18 -33.73 72.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.024 -0.535 . . . . 10.0 111.939 -179.519 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 38.6 tptt -62.07 -34.56 76.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.108 0.48 . . . . 10.0 110.368 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 31.8 t -67.27 -30.21 70.03 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.091 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 90' ' ' PHE . . . . . 0.418 ' CE1' ' HA ' ' B' ' 130' ' ' ALA . 68.6 t80 -80.72 -38.6 28.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.372 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 91' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' B' ' 87' ' ' THR . 40.5 mt-10 -72.02 -23.26 61.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.833 -179.544 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 92' ' ' ASP . . . . . 0.456 ' O ' ' HB3' ' B' ' 95' ' ' HIS . 0.4 OUTLIER -81.43 -3.57 53.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.525 -0.307 . . . . 10.0 111.549 -179.749 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 93' ' ' ILE . . . . . 0.7 HD11 ' HB3' ' B' ' 82' ' ' PHE . 22.4 mm -61.48 -39.73 83.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.278 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 28.9 t60 -64.16 -33.57 76.1 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 95' ' ' HIS . . . . . 0.456 ' HB3' ' O ' ' B' ' 92' ' ' ASP . 5.1 t-160 -60.95 -39.91 91.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.443 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 96' ' ' TYR . . . . . 0.537 ' CE1' ' HB ' ' B' ' 9' ' ' VAL . 1.9 m-85 -74.66 -39.84 61.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.654 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -56.2 -44.57 79.58 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.185 -0.462 . . . . 10.0 110.359 179.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -66.34 -40.27 89.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.883 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -64.81 -47.9 76.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.482 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 58.6 mt -62.89 -44.71 99.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.883 0.373 . . . . 10.0 110.25 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 101' ' ' LYS . . . . . 0.815 ' HD2' ' HG3' ' B' ' 107' ' ' GLU . 13.1 tttp -59.37 -37.84 78.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.302 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 65.4 ttp85 -67.5 -47.21 70.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.779 -0.646 . . . . 10.0 112.109 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 34.1 m -71.35 -25.85 25.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 112.672 0.619 . . . . 10.0 112.672 -178.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -95.14 -10.28 31.07 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 25.8 t0 58.79 22.88 10.59 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.486 0.66 . . . . 10.0 111.309 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 4.6 m -144.47 151.88 39.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.85 -0.613 . . . . 10.0 110.647 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 107' ' ' GLU . . . . . 0.815 ' HG3' ' HD2' ' B' ' 101' ' ' LYS . 3.7 mp0 -92.76 -38.49 11.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.147 0.498 . . . . 10.0 110.895 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -81.43 62.54 5.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.459 0.647 . . . . 10.0 112.382 -178.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.413 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 49.1 t -101.46 132.92 21.22 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.74 -0.664 . . . . 10.0 109.243 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 110' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 49.4 Cg_exo -57.11 104.7 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.94 2.426 . . . . 10.0 112.382 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 111' ' ' MET . . . . . 0.403 ' HA ' ' O ' ' B' ' 78' ' ' PHE . 43.2 mtt -130.88 143.63 50.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.881 -0.599 . . . . 10.0 109.695 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 112' ' ' VAL . . . . . 0.561 ' HB ' HD23 ' B' ' 79' ' ' LEU . 92.4 t -128.29 127.67 67.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.612 -0.514 . . . . 10.0 109.612 179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 18.9 tp -81.0 120.91 25.38 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 114' ' ' VAL . . . . . 0.497 ' HB ' HG22 ' B' ' 81' ' ' VAL . 40.3 t -118.52 117.66 55.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.904 0.383 . . . . 10.0 111.426 -178.671 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.71 99.59 2.1 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 110.237 -1.145 . . . . 10.0 110.237 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -88.9 163.71 15.49 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.889 0.329 . . . . 10.0 111.889 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 30.4 mtpt 70.83 38.87 1.12 Allowed 'General case' 0 C--O 1.231 0.096 0 CA-C-N 115.257 -0.883 . . . . 10.0 112.258 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 118' ' ' CYS . . . . . 0.737 ' HA ' HD11 ' B' ' 84' ' ' ILE . 28.2 p -76.21 2.0 14.37 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.077 -0.511 . . . . 10.0 111.441 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -95.18 -4.58 45.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.458 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 46.7 mt -80.89 139.21 49.87 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.846 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -68.72 -27.81 31.39 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.757 2.305 . . . . 10.0 112.583 -179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 2.1 m -85.07 59.01 5.36 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.388 0.514 . . . . 10.0 112.388 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 123' ' ' ARG . . . . . 0.664 ' HG3' HD12 ' B' ' 84' ' ' ILE . 36.7 ttm-85 -72.11 100.62 2.57 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.217 -0.66 . . . . 10.0 109.217 178.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.7 m -88.75 -31.54 18.36 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.618 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 25.0 t -102.08 117.59 47.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.051 179.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -79.35 151.34 31.06 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.366 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 127' ' ' THR . . . . . 0.493 HG23 ' HE2' ' B' ' 141' ' ' PHE . 6.7 m -56.84 -37.12 70.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.416 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -64.29 -42.24 96.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.86 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -62.04 -47.75 83.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.202 0.525 . . . . 10.0 110.305 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 130' ' ' ALA . . . . . 0.418 ' HA ' ' CE1' ' B' ' 90' ' ' PHE . . . -62.98 -44.49 95.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.653 -0.703 . . . . 10.0 111.269 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.531 ' HG3' ' HD2' ' B' ' 141' ' ' PHE . 31.5 mt-30 -68.15 -33.1 73.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.539 -0.3 . . . . 10.0 111.427 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.94 -43.0 99.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.392 0.615 . . . . 10.0 109.852 178.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 14.5 tp -67.21 -46.76 72.89 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.476 -0.784 . . . . 10.0 110.014 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.51 -43.06 99.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.833 -0.621 . . . . 10.0 110.844 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -60.59 -34.14 73.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.947 -0.569 . . . . 10.0 110.8 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 20.7 m -73.14 -27.13 61.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.47 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -90.41 -14.52 32.76 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.131 0.491 . . . . 10.0 110.957 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 79.97 32.33 36.49 Favored Glycine 0 N--CA 1.446 -0.661 0 N-CA-C 111.351 -0.699 . . . . 10.0 111.351 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 45.8 pt -127.38 153.98 77.2 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 110.164 -0.31 . . . . 10.0 110.164 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -79.49 157.26 25.33 Favored 'Trans proline' 0 CA--C 1.531 0.351 0 C-N-CA 122.593 2.195 . . . . 10.0 112.408 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.531 ' HD2' ' HG3' ' B' ' 131' ' ' GLN . 36.4 t80 -127.27 126.72 43.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.373 179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 34.4 mm -121.19 124.69 72.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.317 -0.402 . . . . 10.0 110.164 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -86.63 125.44 33.84 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 107.525 -1.287 . . . . 10.0 107.525 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 144' ' ' THR . . . . . 0.449 HG22 ' HA3' ' B' ' 151' ' ' GLY . 71.5 p -134.96 173.82 11.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.51 0.93 . . . . 10.0 113.51 -176.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 13.3 t -155.97 108.39 2.62 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.347 -1.297 . . . . 10.0 108.054 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -61.85 -27.07 68.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.275 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -68.69 -41.69 78.82 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.457 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 27.3 p -98.57 -4.83 33.24 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.869 0.322 . . . . 10.0 111.869 -178.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 149' ' ' ARG . . . . . 0.644 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 26.5 ttt-85 66.33 14.37 9.65 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.904 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -75.11 116.72 16.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.563 -178.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 151' ' ' GLY . . . . . 0.449 ' HA3' HG22 ' B' ' 144' ' ' THR . . . 82.53 5.29 89.64 Favored Glycine 0 N--CA 1.452 -0.299 0 N-CA-C 114.517 0.567 . . . . 10.0 114.517 177.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 67.8 t -58.83 -50.71 78.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 117.187 0.494 . . . . 10.0 111.713 -179.451 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -69.71 -42.33 74.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.789 0.328 . . . . 10.0 110.362 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.52 -45.48 69.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.726 -0.67 . . . . 10.0 112.235 -178.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.84 -50.58 73.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.833 0.349 . . . . 10.0 111.652 -179.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -67.48 -42.49 82.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.264 -0.426 . . . . 10.0 111.609 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -61.99 -40.25 94.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.845 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 46.9 m -66.61 -36.39 82.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.615 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.921 HD22 ' HG ' ' B' ' 79' ' ' LEU . 32.8 tp -60.46 -48.56 81.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.353 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 160' ' ' VAL . . . . . 0.426 ' HA ' HD12 ' B' ' 163' ' ' ILE . 46.6 t -62.55 -35.83 72.03 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.153 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 22.7 ttm-85 -63.77 -45.32 90.33 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.609 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -63.09 -39.33 94.4 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.997 0.427 . . . . 10.0 110.343 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 163' ' ' ILE . . . . . 0.452 HG13 ' O ' ' B' ' 159' ' ' LEU . 85.9 mt -61.21 -49.32 85.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.172 179.295 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -62.51 -46.67 87.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.895 -0.593 . . . . 10.0 111.957 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -59.12 -43.58 91.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.976 0.417 . . . . 10.0 110.937 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 48.5 t-80 -63.92 -40.92 97.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.704 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -66.14 -43.36 87.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.372 -0.376 . . . . 10.0 111.031 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -62.48 -37.3 85.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.034 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 41.4 tttp -65.73 -35.11 79.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.055 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 80.1 mtp -64.81 -23.82 67.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.183 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 1.9 m -75.53 -15.1 60.42 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.376 0.608 . . . . 10.0 109.88 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 172' ' ' LYS . . . . . 0.434 ' HA ' ' H82' ' A' ' 12' ' ' PCW . 29.1 ttpp -106.92 -54.74 2.42 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.02 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -115.17 109.72 18.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.914 -0.584 . . . . 10.0 109.431 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . -126.84 -112.32 1.77 Allowed Glycine 0 N--CA 1.446 -0.68 0 N-CA-C 111.401 -0.68 . . . . 10.0 111.401 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 175' ' ' LYS . . . . . 0.535 ' HB3' ' O2 ' ' A' ' 34' ' ' 17F . 27.0 tptt -78.14 111.46 14.09 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -140.37 132.6 28.16 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.458 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -144.49 -176.98 5.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.062 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -60.58 133.08 55.75 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.586 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 179' ' ' LYS . . . . . 0.71 ' NZ ' HN1A ' A' ' 34' ' ' 17F . 18.2 ptpt -158.1 177.28 11.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.669 -0.696 . . . . 10.0 109.816 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 51.0 tttm 70.78 -73.29 0.1 Allowed 'General case' 0 N--CA 1.467 0.408 0 O-C-N 123.738 0.649 . . . . 10.0 112.232 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 1.5 m -79.39 92.77 5.24 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.966 0.412 . . . . 10.0 110.399 -179.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 182' ' ' LYS . . . . . 0.537 ' HD2' ' H41' ' A' ' 18' ' ' PCW . 19.7 mttm -66.57 -52.17 48.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.516 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 57.29 39.34 28.61 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.186 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 28.7 mmtp 55.94 80.5 0.14 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.293 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 45.2 m . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.948 -179.465 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.506 0 N-CA-C 112.291 -0.323 . . . . 10.0 112.291 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 809' ' ' THR . . . . . 0.823 HG21 HD11 ' B' ' 36' ' ' ILE . 1.5 p -132.91 164.82 26.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.461 0.172 . . . . 10.0 110.593 -179.707 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 810' ' ' VAL . . . . . 0.606 HG23 HG22 ' D' ' 824' ' ' VAL . 91.5 t -118.64 123.23 71.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 120.756 0.312 . . . . 10.0 110.488 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 811' ' ' LYS . . . . . 0.737 ' HE3' ' HG3' ' D' ' 819' ' ' ARG . 72.5 tttt -87.95 107.88 18.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.278 -0.419 . . . . 10.0 109.883 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 43.5 t -94.9 129.33 45.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.477 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 813' ' ' TYR . . . . . 0.498 ' CZ ' ' H63' ' A' ' 4' ' ' PCW . 81.0 m-85 -96.3 136.24 37.04 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.61 179.537 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 58.4 mt -107.32 153.23 41.3 Favored Pre-proline 0 C--N 1.319 -0.73 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.155 -178.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 815' ' ' PRO . . . . . 0.747 ' HD3' ' HB ' ' D' ' 877' ' ' VAL . 72.4 Cg_endo -74.82 56.64 4.2 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.929 2.419 . . . . 10.0 111.111 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 816' ' ' ASN . . . . . 0.411 HD22 ' HA ' ' D' ' 816' ' ' ASN . 0.2 OUTLIER -157.2 32.6 0.29 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.227 -0.897 . . . . 10.0 109.998 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D ' 817' ' ' LYS . . . . . 0.639 ' HA ' ' O2 ' ' A' ' 33' ' ' 17F . 9.8 ttpt 58.29 28.31 16.49 Favored 'General case' 0 CA--C 1.529 0.163 0 O-C-N 123.788 0.68 . . . . 10.0 110.311 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 818' ' ' GLN . . . . . 0.408 ' NE2' ' HB2' ' B' ' 39' ' ' SER . 79.3 mt-30 -138.44 -177.58 4.91 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 114.421 1.267 . . . . 10.0 114.421 -177.531 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 819' ' ' ARG . . . . . 0.737 ' HG3' ' HE3' ' D' ' 811' ' ' LYS . 0.0 OUTLIER -151.88 171.11 18.28 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.01 -0.996 . . . . 10.0 112.01 -177.634 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 14.6 t -152.22 138.81 18.69 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 107.449 -1.315 . . . . 10.0 107.449 178.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 821' ' ' VAL . . . . . 0.555 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 4.0 t -104.53 114.2 43.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 120.059 -0.656 . . . . 10.0 111.553 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 35.2 m -103.31 162.38 4.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.761 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 5.2 m -96.23 140.4 30.97 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.532 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 824' ' ' VAL . . . . . 0.606 HG22 HG23 ' D' ' 810' ' ' VAL . 6.4 t -68.17 121.65 17.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 110.132 -0.322 . . . . 10.0 110.132 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -126.34 113.01 16.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.451 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -67.27 145.55 55.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.285 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 90.29 -38.99 3.14 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.827 -0.701 . . . . 10.0 112.08 -179.467 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 57.6 ttm -68.39 144.82 54.6 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.651 0.262 . . . . 10.0 110.702 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 829' ' ' SER . . . . . 0.667 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.0 OUTLIER -99.77 162.8 12.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.556 -0.293 . . . . 10.0 111.279 -179.838 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D ' 830' ' ' VAL . . . . . 0.509 ' O ' ' HB2' ' D' ' 834' ' ' LEU . 86.0 t -55.17 -41.51 60.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.186 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 831' ' ' TYR . . . . . 0.488 ' O ' ' HB2' ' D' ' 835' ' ' ASP . 67.5 t80 -56.35 -32.99 65.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.941 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -75.87 -57.49 3.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.502 -0.317 . . . . 10.0 111.634 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.44 -42.72 99.66 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.688 -179.106 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 834' ' ' LEU . . . . . 0.548 ' HG ' HG21 ' D' ' 850' ' ' VAL . 2.2 mm? -74.24 -17.78 60.83 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 113.089 0.774 . . . . 10.0 113.089 -179.113 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 835' ' ' ASP . . . . . 0.488 ' HB2' ' O ' ' D' ' 831' ' ' TYR . 28.0 t70 -61.71 -50.12 73.73 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.641 -0.424 . . . . 10.0 109.973 179.45 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 35.4 tttt -68.46 -26.96 65.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.648 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 837' ' ' ALA . . . . . 0.435 ' HB3' HD13 ' D' ' 834' ' ' LEU . . . -77.22 -22.27 52.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.07 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 838' ' ' LEU . . . . . 0.65 HD21 HG11 ' D' ' 877' ' ' VAL . 37.3 mt -94.52 -43.85 8.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.044 0.449 . . . . 10.0 110.452 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -63.91 -18.39 64.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.857 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 840' ' ' VAL . . . . . 0.659 HG22 ' CE2' ' B' ' 40' ' ' TYR . 3.2 p -52.69 -22.96 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 O-C-N 123.801 0.688 . . . . 10.0 112.321 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 15.9 ptp180 -139.15 17.09 2.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.01 0.433 . . . . 10.0 111.809 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 82.05 35.89 19.95 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.955 -0.641 . . . . 10.0 114.592 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 98.7 mt -99.78 149.64 23.15 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 117.427 0.614 . . . . 10.0 110.326 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -119.53 148.55 43.16 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.04 0.448 . . . . 10.0 111.661 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -67.29 -9.1 37.43 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.454 -0.794 . . . . 10.0 112.835 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -94.87 -2.55 50.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.026 0.441 . . . . 10.0 111.901 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 91.3 m -129.17 5.16 5.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.237 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 67.5 m -142.84 147.83 36.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.697 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 12.8 p -130.01 151.05 35.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 850' ' ' VAL . . . . . 0.548 HG21 ' HG ' ' D' ' 834' ' ' LEU . 17.4 t -108.07 134.06 51.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.059 0.456 . . . . 10.0 111.764 -179.213 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 851' ' ' TYR . . . . . 0.777 ' HE1' ' HB3' ' D' ' 878' ' ' GLU . 91.8 m-85 -109.22 141.97 40.72 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.816 -0.629 . . . . 10.0 109.721 178.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 852' ' ' ARG . . . . . 0.719 ' HD2' HD11 ' D' ' 870' ' ' LEU . 31.7 mtm-85 -98.67 135.12 40.63 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.968 -0.752 . . . . 10.0 108.968 178.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 853' ' ' LEU . . . . . 0.428 ' HG ' HD11 ' D' ' 876' ' ' ILE . 1.7 mt -82.25 81.39 8.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.92 0.39 . . . . 10.0 111.702 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 37.7 mt -88.08 87.78 2.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.549 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 855' ' ' LYS . . . . . 0.464 ' HA ' ' HD3' ' D' ' 855' ' ' LYS . 23.0 mmtt 50.83 55.89 8.84 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.438 0.903 . . . . 10.0 113.438 179.288 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 86.53 -0.77 87.05 Favored Glycine 0 CA--C 1.518 0.255 0 C-N-CA 120.84 -0.695 . . . . 10.0 114.116 178.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 857' ' ' ARG . . . . . 1.006 HH12 ' H20' ' A' ' 7' ' ' PCW . 29.6 mmt180 -115.11 135.76 53.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 117.406 0.603 . . . . 10.0 111.011 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 858' ' ' LYS . . . . . 0.735 ' HE2' HD13 ' D' ' 876' ' ' ILE . 94.5 mttt -92.92 99.69 12.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.528 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 4.5 m -98.34 134.0 41.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.702 -0.226 . . . . 10.0 110.744 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 43.0 t -66.19 130.5 31.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.643 0.258 . . . . 10.0 110.845 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 861' ' ' THR . . . . . 0.41 ' HB ' ' HG3' ' D' ' 852' ' ' ARG . 1.8 t -108.12 153.05 23.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.857 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 862' ' ' ALA . . . . . 0.463 ' HB3' ' OG1' ' D' ' 865' ' ' THR . . . -88.53 149.84 23.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.155 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 863' ' ' TRP . . . . . 0.505 ' HZ3' ' HB3' ' D' ' 834' ' ' LEU . 99.8 m95 -73.5 -30.06 62.89 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.655 0.613 . . . . 10.0 112.655 -179.091 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -80.3 -10.65 59.76 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.821 0.675 . . . . 10.0 112.821 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 865' ' ' THR . . . . . 0.463 ' OG1' ' HB3' ' D' ' 862' ' ' ALA . 5.3 m -67.89 143.79 55.55 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.15 -0.315 . . . . 10.0 110.15 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 866' ' ' ALA . . . . . 0.667 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -74.93 149.56 39.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.74 0.305 . . . . 10.0 110.684 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 867' ' ' ILE . . . . . 0.441 ' HA ' HD23 ' D' ' 870' ' ' LEU . 7.9 tp -88.16 2.62 5.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.615 0.721 . . . . 10.0 110.498 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -63.53 -51.54 66.18 Favored Pre-proline 0 CA--C 1.539 0.543 0 N-CA-C 113.162 0.801 . . . . 10.0 113.162 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -76.53 14.44 1.21 Allowed 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.162 1.908 . . . . 10.0 112.961 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 870' ' ' LEU . . . . . 0.719 HD11 ' HD2' ' D' ' 852' ' ' ARG . 3.9 mm? -98.18 33.0 2.28 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.368 0.604 . . . . 10.0 110.761 179.922 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -72.41 116.55 13.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.809 -0.632 . . . . 10.0 111.2 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 73.52 32.0 60.18 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 121.039 -0.6 . . . . 10.0 112.5 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -119.89 152.85 36.72 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.19 -0.3 . . . . 10.0 110.19 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -108.69 135.18 50.36 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.007 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 77.3 mt -113.55 127.47 56.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.55 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 876' ' ' ILE . . . . . 0.735 HD13 ' HE2' ' D' ' 858' ' ' LYS . 6.3 mt -118.4 117.63 55.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.107 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 877' ' ' VAL . . . . . 0.747 ' HB ' ' HD3' ' D' ' 815' ' ' PRO . 12.9 t -87.89 137.69 20.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 109.96 -0.385 . . . . 10.0 109.96 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 878' ' ' GLU . . . . . 0.777 ' HB3' ' HE1' ' D' ' 851' ' ' TYR . 37.5 tt0 -135.0 154.98 51.54 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.371 -0.603 . . . . 10.0 109.371 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 10.3 m -80.56 153.58 4.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 116.537 -0.302 . . . . 10.0 110.291 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 50.8 mt . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.365 -0.826 . . . . 10.0 110.863 -179.85 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PCW . . . . . 0.67 ' H2 ' H18A ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PCW . . . . . 0.713 H331 H421 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PCW . . . . . 0.776 H321 H322 ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PCW . . . . . 0.566 H162 H222 ' A' ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PCW . . . . . 0.633 H211 H152 ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PCW . . . . . 0.616 H351 H341 ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PCW . . . . . 1.006 ' H20' HH12 ' D' ' 857' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PCW . . . . . 0.66 H411 H251 ' A' ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PCW . . . . . 0.659 ' H81' ' O2P' ' A' ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PCW . . . . . 0.501 ' H31' H411 ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PCW . . . . . 0.706 H442 H241 ' A' ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PCW . . . . . 0.589 H151 H372 ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PCW . . . . . 0.574 ' H31' ' H8A' ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PCW . . . . . 0.496 H412 ' H12' ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PCW . . . . . 0.616 H341 H351 ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PCW . . . . . 0.713 H421 H331 ' A' ' 2' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PCW . . . . . 0.776 H322 H321 ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PCW . . . . . 0.594 ' H2 ' ' H81' ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PCW . . . . . 0.539 H361 H122 ' A' ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PCW . . . . . 0.666 H442 H251 ' A' ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PCW . . . . . 0.589 H372 H151 ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PCW . . . . . 0.867 ' H32' ' H63' ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PCW . . . . . 0.523 H271 H261 ' A' ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PCW . . . . . 0.54 H162 H331 ' A' ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PCW . . . . . 0.546 H162 H442 ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PCW . . . . . 0.66 H251 H411 ' A' ' 8' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PCW . . . . . 0.549 ' H2 ' ' H41' ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PCW . . . . . 0.473 ' H2 ' ' H41' ' A' ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PCW . . . . . 0.659 ' O2P' ' H81' ' A' ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PCW . . . . . 0.54 H331 H162 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PCW . . . . . 0.566 H222 H162 ' A' ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' 17F . . . . . 0.639 ' O2 ' ' HA ' ' D' ' 817' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' 17F . . . . . 0.867 ' H63' ' H32' ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' 17F . . . . . 0.67 H18A ' H2 ' ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' 17F . . . . . 0.582 ' H61' H472 ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' 17F . . . . . 0.574 ' H8A' ' H31' ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' 17F . . . . . 0.53 H20A H161 ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' 17F . . . . . 0.545 ' H2 ' ' H82' ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' 17F . . . . . 0.665 ' H71' ' H37' ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PCW . . . . . 0.508 H482 H261 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PCW . . . . . 0.799 ' H39' H451 ' A' ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PCW . . . . . 0.577 H451 H152 ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PCW . . . . . 0.741 H121 ' H6 ' ' A' ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PCW . . . . . 0.637 H371 ' H32' ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PCW . . . . . 0.518 ' O3P' H372 ' A' ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PCW . . . . . 0.492 ' H71' ' O1P' ' A' ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PCW . . . . . 0.745 H321 H131 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PCW . . . . . 0.829 H122 H361 ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PCW . . . . . 0.482 ' H31' ' H4 ' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PCW . . . . . 0.666 H251 H442 ' A' ' 21' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PCW . . . . . 0.623 H181 H122 ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PCW . . . . . 0.692 H421 H481 ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PCW . . . . . 0.745 H131 H321 ' A' ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PCW . . . . . 0.566 ' H63' ' H32' ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PCW . . . . . 0.614 H332 H131 ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PCW . . . . . 0.829 H361 H122 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PCW . . . . . 0.699 H151 H472 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PCW . . . . . 0.684 H231 ' H44' ' A' ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' PCW . . . . . 0.79 H381 H152 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PCW . . . . . 0.699 H472 H151 ' A' ' 58' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PCW . . . . . 0.831 H431 ' H47' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PCW . . . . . 0.706 H241 H442 ' A' ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PCW . . . . . 0.692 H481 H421 ' A' ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PCW . . . . . 0.687 H142 H18A ' A' ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PCW . . . . . 0.635 ' H20' ' H82' ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PCW . . . . . 0.635 ' H82' ' H20' ' A' ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PCW . . . . . 0.584 H371 H242 ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PCW . . . . . 0.799 H451 ' H39' ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PCW . . . . . 0.702 ' H19' ' H63' ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PCW . . . . . 0.518 H372 ' O3P' ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PCW . . . . . 0.674 H322 H361 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' 17F . . . . . 0.602 ' H8A' ' H32' ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' 17F . . . . . 0.577 ' H45' ' H39' ' A' ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' 17F . . . . . 0.577 ' H39' ' H45' ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' 17F . . . . . 0.65 ' H70' ' HB3' ' C' ' 470' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' 17F . . . . . 0.741 ' H6 ' H121 ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' 17F . . . . . 0.831 ' H47' H431 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' 17F . . . . . 0.437 H18A ' H2 ' ' A' ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' 17F . . . . . 0.687 H18A H142 ' A' ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 201' ' ' GNP . . . . . 0.43 H5'2 ' HA ' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 96.2 mt . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.823 0.344 . . . . 10.0 110.649 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 202' ' ' LYS . . . . . 0.472 ' HB2' ' HZ3' ' A' ' 202' ' ' LYS . 0.0 OUTLIER -66.03 -29.55 69.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.461 0.648 . . . . 10.0 110.13 179.761 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 96.6 mt -75.97 -30.45 58.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.47 -0.786 . . . . 10.0 110.115 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 86.1 mt -66.59 -47.66 72.01 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.078 -0.51 . . . . 10.0 109.835 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.98 -44.55 92.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.068 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 206' ' ' ASN . . . . . 0.803 HD21 HD21 ' C' ' 569' ' ' LEU . 3.6 m120 -63.0 -40.2 97.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.66 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 1.6 m95 -67.01 -29.12 68.86 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.846 -0.342 . . . . 10.0 110.716 179.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.78 -44.61 85.27 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 108.787 -0.819 . . . . 10.0 108.787 178.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.67 -35.39 77.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.835 178.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 210' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 206' ' ' ASN . 82.5 t -69.13 -39.87 79.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 109.341 -0.615 . . . . 10.0 109.341 178.532 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 45.5 m -62.64 -46.8 86.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.082 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 2.0 p -64.73 -29.81 70.81 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.301 0.572 . . . . 10.0 109.909 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 92.1 m -69.8 -45.16 68.54 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.072 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -62.21 -42.17 99.05 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 109.61 -0.515 . . . . 10.0 109.61 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 58.2 m -59.97 -47.8 84.32 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.735 -0.666 . . . . 10.0 109.872 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 216' ' ' LYS . . . . . 0.415 ' HG2' ' HB ' ' C' ' 557' ' ' THR . 5.5 tptt -64.71 -36.67 85.03 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.43 179.415 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 40.7 mt -62.84 -46.47 87.75 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 109.485 -0.561 . . . . 10.0 109.485 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -62.9 -42.49 99.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.086 0.469 . . . . 10.0 110.209 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.429 ' O ' ' HD2' ' A' ' 223' ' ' PRO . 42.6 mt-10 -63.78 -38.05 89.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.492 -0.776 . . . . 10.0 111.23 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.22 -35.49 48.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.724 178.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 221' ' ' LEU . . . . . 0.48 ' HA ' ' HB ' ' A' ' 224' ' ' VAL . 25.6 mt -64.09 -27.48 69.12 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.175 -0.466 . . . . 10.0 111.086 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -54.71 -69.04 1.37 Allowed Glycine 0 C--N 1.33 0.238 0 N-CA-C 110.997 -0.841 . . . . 10.0 110.997 178.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 223' ' ' PRO . . . . . 0.429 ' HD2' ' O ' ' A' ' 219' ' ' GLU . 11.1 Cg_endo -58.27 -33.6 97.79 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.587 2.191 . . . . 10.0 110.91 177.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 224' ' ' VAL . . . . . 0.512 ' O ' ' HB2' ' A' ' 228' ' ' PHE . 6.0 t -59.37 -45.37 93.46 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.257 0 CA-C-O 120.656 0.265 . . . . 10.0 110.293 179.05 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 24.0 m -64.54 -37.95 89.34 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.626 -0.509 . . . . 10.0 109.626 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -66.84 -48.53 68.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.019 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 79.7 mt-10 -65.33 -42.14 93.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.232 179.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 228' ' ' PHE . . . . . 0.512 ' HB2' ' O ' ' A' ' 224' ' ' VAL . 0.1 OUTLIER -61.54 -49.28 77.32 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.763 -0.458 . . . . 10.0 109.763 178.665 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 229' ' ' TRP . . . . . 0.561 ' CE3' ' HA ' ' A' ' 229' ' ' TRP . 0.5 OUTLIER -64.47 -38.78 92.2 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.569 179.263 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -59.78 -50.64 73.02 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.598 -0.519 . . . . 10.0 109.598 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 231' ' ' ASN . . . . . 0.675 ' HA ' ' HE2' ' A' ' 234' ' ' LYS . 58.6 m-80 -66.01 -40.36 91.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.795 179.011 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 65.4 mt -66.91 -36.62 82.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.513 -0.312 . . . . 10.0 111.235 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -67.14 -43.6 81.93 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 234' ' ' LYS . . . . . 0.675 ' HE2' ' HA ' ' A' ' 231' ' ' ASN . 31.7 mtmt -65.92 -37.51 86.26 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.046 -0.724 . . . . 10.0 109.046 178.393 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 235' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 231' ' ' ASN . 2.0 tt0 -63.51 -53.43 52.08 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.404 -0.816 . . . . 10.0 109.33 178.628 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 236' ' ' THR . . . . . 0.48 ' HA ' ' HB2' ' A' ' 239' ' ' LEU . 14.6 p -66.04 -25.83 67.23 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.521 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -64.92 -49.28 71.02 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 107.996 -1.113 . . . . 10.0 107.996 177.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -65.41 -46.84 84.14 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 109.319 -1.513 . . . . 10.0 109.319 177.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 239' ' ' LEU . . . . . 0.593 ' O ' ' HB2' ' A' ' 243' ' ' MET . 85.5 mt -56.53 -36.03 68.76 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.648 -0.276 . . . . 10.0 111.172 178.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 29.8 mtm180 -70.65 -42.0 71.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.995 0.426 . . . . 10.0 110.818 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -71.04 -32.93 69.8 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.459 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 242' ' ' GLU . . . . . 0.811 ' HB3' HH21 ' C' ' 532' ' ' ARG . 20.2 mt-10 -80.64 -41.98 22.93 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.712 -0.677 . . . . 10.0 111.011 179.182 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 243' ' ' MET . . . . . 0.593 ' HB2' ' O ' ' A' ' 239' ' ' LEU . 1.6 mmm -63.24 -33.49 75.61 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.62 0.248 . . . . 10.0 111.176 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.8 p -65.36 -41.53 93.75 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.106 -0.701 . . . . 10.0 109.106 178.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -71.44 -43.96 65.72 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.7 -0.852 . . . . 10.0 108.7 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 246' ' ' ASP . . . . . 0.483 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.2 OUTLIER -53.77 -57.69 9.95 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.419 -0.81 . . . . 10.0 109.564 178.926 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 47.1 mt -60.33 -44.74 95.21 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.738 -0.665 . . . . 10.0 111.459 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -59.78 -52.32 65.97 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.475 0.178 . . . . 10.0 111.319 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -63.1 -45.66 91.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.365 -0.38 . . . . 10.0 110.389 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 250' ' ' VAL . . . . . 0.705 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 36.1 t -61.92 -44.33 98.73 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.399 0 CA-C-N 116.447 -0.342 . . . . 10.0 111.455 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.451 ' O ' HG12 ' A' ' 254' ' ' VAL . 95.7 mttt -70.54 -48.02 57.52 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.811 0.3 . . . . 10.0 111.811 -179.522 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -60.52 -40.61 92.06 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.913 0.387 . . . . 10.0 110.829 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt -82.55 -22.33 34.99 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.156 -0.474 . . . . 10.0 111.719 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.705 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -64.91 -26.08 39.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 C-N-CA 121.152 -0.219 . . . . 10.0 110.842 179.904 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 255' ' ' GLN . . . . . 0.506 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 71.2 mt-30 -63.08 -61.62 7.06 Favored Pre-proline 0 CA--C 1.531 0.225 0 CA-C-N 116.257 -0.429 . . . . 10.0 109.865 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 256' ' ' PRO . . . . . 0.506 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 18.7 Cg_endo -62.32 -30.56 81.15 Favored 'Trans proline' 0 C--N 1.359 1.092 0 C-N-CA 121.778 1.652 . . . . 10.0 110.96 177.517 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 257' ' ' TYR . . . . . 0.422 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 6.8 m-30 -61.74 -54.21 45.62 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.225 0.536 . . . . 10.0 109.7 178.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 79.6 mt -67.95 -46.32 71.75 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 115.397 -0.82 . . . . 10.0 111.207 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -60.18 -39.77 87.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.822 0.344 . . . . 10.0 111.766 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -62.07 -50.63 71.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.112 0.482 . . . . 10.0 110.021 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 261' ' ' PHE . . . . . 0.405 ' O ' ' HB2' ' A' ' 265' ' ' TRP . 14.3 m-85 -69.71 -30.38 68.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.819 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -66.15 -48.08 71.95 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.582 179.061 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 11.4 mtmt -59.21 -43.08 92.28 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.206 -0.665 . . . . 10.0 109.206 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.436 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 16.6 mttt -65.64 -46.39 79.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.234 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 265' ' ' TRP . . . . . 0.405 ' HB2' ' O ' ' A' ' 261' ' ' PHE . 0.0 OUTLIER -60.73 -34.61 74.66 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.535 -0.302 . . . . 10.0 110.404 179.386 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -65.17 -49.3 70.35 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.058 -0.719 . . . . 10.0 109.058 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -61.7 -41.77 98.03 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 268' ' ' GLU . . . . . 0.518 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 41.3 mt-10 -61.68 -46.63 88.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.767 179.405 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 5.6 mmt -65.05 -43.87 90.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.652 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 270' ' ' GLU . . . . . 0.521 ' O ' ' HB2' ' A' ' 274' ' ' GLN . 79.8 mt-10 -62.01 -48.6 79.59 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.738 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 66.3 mt -66.61 -35.1 79.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.667 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 272' ' ' TYR . . . . . 0.518 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 2.2 t80 -63.43 -52.34 61.9 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 273' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 273' ' ' ARG . 46.6 mtt180 -63.12 -39.52 94.94 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 274' ' ' GLN . . . . . 0.521 ' HB2' ' O ' ' A' ' 270' ' ' GLU . 3.1 tt0 -56.55 -32.93 65.64 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.472 -0.786 . . . . 10.0 110.096 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.615 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 59.0 mttp -90.0 -35.23 15.64 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.478 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 276' ' ' VAL . . . . . 0.423 ' HB ' ' HA ' ' A' ' 273' ' ' ARG . 7.6 t -54.45 -40.5 49.49 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.168 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 277' ' ' GLU . . . . . 0.494 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 35.5 mt-10 -57.58 -63.29 3.95 Favored Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 111.966 0.358 . . . . 10.0 111.966 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 278' ' ' PRO . . . . . 0.554 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 23.6 Cg_endo -63.42 -37.23 50.46 Favored 'Trans proline' 0 C--N 1.357 1.018 0 C-N-CA 121.956 1.77 . . . . 10.0 111.798 178.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.689 HD22 ' HG2' ' C' ' 495' ' ' LYS . 29.4 mt -65.69 -36.55 83.97 Favored 'General case' 0 C--N 1.334 -0.088 0 C-N-CA 121.052 -0.259 . . . . 10.0 110.676 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -71.53 -34.67 70.26 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.124 -1.065 . . . . 10.0 108.124 178.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -63.83 -41.91 97.75 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.38 -0.97 . . . . 10.0 108.38 177.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 282' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 35.5 mt-10 -61.22 -46.19 91.45 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.064 -0.717 . . . . 10.0 109.064 177.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 97.0 mt -60.9 -43.62 98.26 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.163 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -63.03 -53.49 52.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.172 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -57.95 -51.12 70.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.287 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -60.53 -46.4 94.47 Favored Glycine 0 N--CA 1.443 -0.837 0 CA-C-N 115.604 -0.726 . . . . 10.0 112.248 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.96 -38.76 89.73 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.644 0.222 . . . . 10.0 110.573 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 288' ' ' ARG . . . . . 0.685 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 88.0 mtt180 -59.25 -42.97 92.35 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 178.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 289' ' ' GLN . . . . . 0.448 ' O ' ' HG2' ' A' ' 293' ' ' GLU . 38.9 mt-30 -71.87 -55.6 7.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.614 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 290' ' ' LYS . . . . . 0.511 ' HE3' ' OE1' ' C' ' 487' ' ' GLN . 34.4 mttt -54.87 -46.6 74.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.922 -0.581 . . . . 10.0 111.957 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 291' ' ' LEU . . . . . 0.671 HD23 HD12 ' A' ' 294' ' ' LEU . 78.4 mt -70.8 -32.37 69.43 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 121.259 -0.176 . . . . 10.0 111.023 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 292' ' ' HIS . . . . . 0.685 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 0.3 OUTLIER -65.25 -41.51 94.23 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.82 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 293' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 289' ' ' GLN . 21.5 mm-40 -64.44 -35.15 79.99 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.852 -0.796 . . . . 10.0 108.852 178.38 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 294' ' ' LEU . . . . . 0.671 HD12 HD23 ' A' ' 291' ' ' LEU . 79.2 mt -68.43 -38.54 81.3 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.585 -0.734 . . . . 10.0 109.923 178.572 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -63.18 -37.75 88.47 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.217 -0.661 . . . . 10.0 109.217 178.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -72.23 5.65 2.7 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.094 -0.957 . . . . 10.0 111.117 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 297' ' ' LYS . . . . . 0.52 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 39.9 mttp -125.02 -36.55 2.53 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.254 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 298' ' ' LEU . . . . . 0.441 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 76.8 mt -60.53 -41.81 95.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.399 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 299' ' ' SER . . . . . 0.824 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 19.5 m -81.38 -64.38 0.28 Allowed Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 300' ' ' PRO . . . . . 0.824 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 53.5 Cg_exo -55.7 -58.35 1.15 Allowed 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 122.306 2.004 . . . . 10.0 112.853 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.52 ' HB2' ' O ' ' A' ' 297' ' ' LYS . 81.3 mt -67.36 -31.16 71.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.699 0.285 . . . . 10.0 110.673 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 302' ' ' GLY . . . . . 0.441 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -65.95 -44.7 91.21 Favored Glycine 0 N--CA 1.449 -0.479 0 N-CA-C 111.334 -0.706 . . . . 10.0 111.334 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -60.63 -37.79 82.63 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 304' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 300' ' ' PRO . 93.7 mt-10 -64.25 -44.9 90.35 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 178.281 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 5.6 tpt -62.96 -42.97 99.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.222 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 306' ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 94.6 mtt180 -64.56 -38.13 89.94 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 109.122 -0.696 . . . . 10.0 109.122 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 307' ' ' ASP . . . . . 0.57 ' HA ' ' CD ' ' A' ' 310' ' ' ARG . 33.2 t70 -66.56 -43.66 84.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.196 179.285 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 308' ' ' ARG . . . . . 0.802 ' HG3' HD11 ' C' ' 469' ' ' LEU . 11.3 mmt180 -68.76 -26.75 65.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.736 -0.665 . . . . 10.0 109.361 178.529 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 309' ' ' ALA . . . . . 0.551 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -69.97 -32.0 70.0 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 177.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 310' ' ' ARG . . . . . 0.57 ' CD ' ' HA ' ' A' ' 307' ' ' ASP . 15.6 mtp180 -62.89 -46.4 88.0 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 107.906 -1.146 . . . . 10.0 107.906 178.043 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -66.85 -41.11 87.91 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.434 -0.803 . . . . 10.0 109.633 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 312' ' ' HIS . . . . . 0.558 ' HA ' ' HD3' ' C' ' 462' ' ' LYS . 0.7 OUTLIER -56.14 -49.1 74.9 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.123 178.984 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 97.2 t -73.91 -39.76 52.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 115.762 -0.653 . . . . 10.0 111.419 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 314' ' ' ASP . . . . . 0.428 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 0.7 OUTLIER -60.87 -42.88 98.76 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.249 0.547 . . . . 10.0 110.232 179.717 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 315' ' ' ALA . . . . . 0.57 ' O ' ' HB2' ' A' ' 319' ' ' HIS . . . -65.1 -33.39 75.91 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.212 178.299 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 316' ' ' LEU . . . . . 0.432 HD11 H281 ' A' ' 27' ' ' PCW . 40.5 mt -71.15 -37.66 72.23 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.712 178.702 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 81.1 mtt180 -61.02 -53.41 57.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.138 0.494 . . . . 10.0 110.207 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.98 2.69 6.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.337 -0.847 . . . . 10.0 112.245 -179.037 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 319' ' ' HIS . . . . . 0.57 ' HB2' ' O ' ' A' ' 315' ' ' ALA . 0.1 OUTLIER -117.42 -51.64 2.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.65 0.262 . . . . 10.0 110.771 179.793 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 91.5 mt -65.04 -35.82 82.4 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.374 -0.375 . . . . 10.0 111.547 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -57.19 -60.4 9.78 Favored Pre-proline 0 CA--C 1.536 0.432 0 C-N-CA 121.138 -0.225 . . . . 10.0 111.316 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -65.0 -33.36 51.51 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 121.603 1.535 . . . . 10.0 111.214 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -62.25 -50.58 71.17 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-N 116.594 -0.276 . . . . 10.0 110.866 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 324' ' ' SER . . . . . 0.441 ' HA ' HD12 ' A' ' 327' ' ' LEU . 21.1 p -68.8 -34.25 75.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.356 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -66.03 -41.01 91.5 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 326' ' ' GLU . . . . . 0.401 ' CD ' ' HZ1' ' C' ' 451' ' ' LYS . 27.4 mt-10 -68.87 -36.0 77.58 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.315 -0.995 . . . . 10.0 108.315 177.339 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 327' ' ' LEU . . . . . 0.441 HD12 ' HA ' ' A' ' 324' ' ' SER . 29.3 mt -60.72 -35.05 75.36 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 109.302 -0.629 . . . . 10.0 109.302 178.203 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 -63.56 -40.81 97.95 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.941 -0.763 . . . . 10.0 108.941 178.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -70.22 -41.98 72.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.027 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 330' ' ' ARG . . . . . 0.469 ' HA ' ' HE3' ' C' ' 443' ' ' LYS . 13.6 mtp180 -63.89 -45.75 87.95 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.8 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 64.6 mt -65.85 -37.56 86.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.1 179.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.9 -46.73 88.09 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -60.83 -44.98 96.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.956 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 20.5 mtt180 -62.86 -47.73 82.1 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.144 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 335' ' ' LEU . . . . . 0.491 ' O ' ' HB2' ' A' ' 339' ' ' LYS . 68.1 mt -64.39 -33.82 76.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 10.0 111.432 -179.576 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -69.81 -44.05 70.81 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.913 -0.403 . . . . 10.0 109.913 178.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.73 -44.33 77.86 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 71.0 mt -66.09 -20.89 66.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.765 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 339' ' ' LYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 335' ' ' LEU . 31.0 tttt -75.58 -49.06 19.71 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 178.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -67.59 -39.06 84.83 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 341' ' ' ASN . . . . . 0.515 ' OD1' ' HA ' ' C' ' 433' ' ' GLU . 0.2 OUTLIER -67.22 -42.61 83.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.285 -0.87 . . . . 10.0 108.921 178.41 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -62.16 -42.94 99.73 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.564 -0.744 . . . . 10.0 111.566 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.93 -40.75 97.28 Favored Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 110.445 -1.062 . . . . 10.0 110.445 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -67.78 -42.85 81.02 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 178.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 345' ' ' ARG . . . . . 0.453 ' HE ' ' ND2' ' A' ' 341' ' ' ASN . 23.5 mtt180 -62.86 -43.54 98.54 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.736 179.265 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 13.5 mt -65.02 -46.64 80.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.504 -0.317 . . . . 10.0 110.861 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.02 -43.99 97.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.036 0.446 . . . . 10.0 110.105 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 348' ' ' GLU . . . . . 0.409 ' HB3' ' HE2' ' A' ' 352' ' ' LYS . 17.6 mt-10 -67.09 -47.48 71.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.142 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -62.05 -33.48 74.46 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 121.115 -0.234 . . . . 10.0 110.445 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.22 -40.84 86.46 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.818 -0.808 . . . . 10.0 108.818 178.004 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 351' ' ' ALA . . . . . 0.572 ' O ' ' HG2' ' A' ' 355' ' ' GLU . . . -66.13 -46.16 78.49 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.426 178.492 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 352' ' ' LYS . . . . . 0.409 ' HE2' ' HB3' ' A' ' 348' ' ' GLU . 19.4 mttm -63.3 -29.51 70.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.761 -0.654 . . . . 10.0 109.946 178.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.95 -46.37 74.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.988 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.8 -37.17 85.65 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 121.015 0.436 . . . . 10.0 109.891 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 355' ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' ' 351' ' ' ALA . 20.3 mm-40 -67.74 -41.54 83.25 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -60.63 -48.29 82.45 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 108.841 -0.8 . . . . 10.0 108.841 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 84.3 mt -59.62 -37.81 79.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.986 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 53.9 m -61.87 -56.78 15.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.231 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 17.8 m -63.17 -35.35 79.99 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.41 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 19.7 mt -65.89 -36.4 83.31 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.453 -0.34 . . . . 10.0 110.24 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 70.2 m -65.76 -31.53 72.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.095 0.474 . . . . 10.0 110.524 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -73.93 -8.16 55.05 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 121.377 0.608 . . . . 10.0 109.928 179.173 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' A' ' 367' ' ' ALA . 44.7 mttm -107.93 -38.31 5.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.104 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.74 -26.01 63.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.564 -0.743 . . . . 10.0 111.897 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.793 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 58.1 mttp -106.46 -74.29 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 112.794 0.664 . . . . 10.0 112.794 179.422 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.793 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 52.2 Cg_exo -56.91 -53.17 5.36 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 122.115 1.876 . . . . 10.0 113.175 -178.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 367' ' ' ALA . . . . . 0.459 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -61.56 -43.77 98.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.674 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 368' ' ' LEU . . . . . 0.485 HD23 ' HA ' ' A' ' 368' ' ' LEU . 6.5 mt -65.57 -36.26 83.26 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.979 -0.288 . . . . 10.0 110.791 179.287 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 369' ' ' GLU . . . . . 0.551 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 19.6 mt-10 -63.36 -41.4 98.84 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.188 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.88 -39.84 94.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.352 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 371' ' ' LEU . . . . . 0.405 HD12 HD23 ' A' ' 368' ' ' LEU . 84.9 mt -65.63 -40.73 92.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.406 178.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -67.28 -40.78 86.17 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.551 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.7 mt-30 -66.2 -26.73 67.53 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.22 -0.9 . . . . 20.0 111.222 178.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -81.67 -40.3 11.03 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 109.261 -1.536 . . . . 10.0 109.261 178.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 14.2 mt -61.55 -31.65 71.69 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.963 0.357 . . . . 10.0 111.963 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 376' ' ' LEU . . . . . 0.478 ' HB2' ' HD3' ' A' ' 377' ' ' PRO . 38.3 mt -54.55 -64.62 1.81 Allowed Pre-proline 0 CA--C 1.537 0.479 0 O-C-N 122.969 0.168 . . . . 10.0 111.027 179.261 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' A' ' 376' ' ' LEU . 40.9 Cg_endo -69.26 -32.45 20.64 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.866 1.711 . . . . 10.0 111.364 178.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 3.9 t -59.38 -49.11 84.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.721 -0.218 . . . . 10.0 110.453 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 37.1 mt -63.92 -31.82 73.13 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.179 -0.464 . . . . 10.0 109.92 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 380' ' ' GLU . . . . . 0.439 ' O ' HG23 ' A' ' 384' ' ' VAL . 11.8 mt-10 -67.41 -50.91 57.46 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 1.2 p -59.99 -34.86 73.9 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 120.952 0.406 . . . . 10.0 110.06 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 5.9 m-30 -69.71 -44.7 69.84 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 115.892 -0.594 . . . . 10.0 110.043 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -61.81 -42.46 99.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.491 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 384' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 380' ' ' GLU . 74.7 t -59.58 -43.31 90.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.745 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.4 p -75.04 -37.87 61.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.582 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 14.3 m-30 -66.42 -44.21 83.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.691 0.282 . . . . 10.0 110.489 179.264 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.485 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 51.5 mt -59.17 -43.07 92.12 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.549 179.732 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 1.8 p -71.33 -46.63 60.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.229 -0.442 . . . . 10.0 110.769 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -56.66 -41.15 76.74 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.143 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 58.4 mt -59.33 -41.53 89.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.016 0.436 . . . . 10.0 110.378 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 391' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 17.8 mt-10 -71.78 -37.91 70.38 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 392' ' ' GLU . . . . . 0.558 ' HG3' ' HZ3' ' A' ' 396' ' ' LYS . 0.4 OUTLIER -55.78 -46.16 78.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.442 178.831 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -65.59 -44.37 86.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.112 0.482 . . . . 10.0 110.432 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 55.8 m -60.17 -45.14 94.11 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.641 -0.709 . . . . 10.0 111.81 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 30.1 mtmt -69.06 -7.12 32.74 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.678 0.622 . . . . 10.0 112.678 -178.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 396' ' ' LYS . . . . . 0.558 ' HZ3' ' HG3' ' A' ' 392' ' ' GLU . 42.7 mttp -106.03 -38.74 6.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.793 0.33 . . . . 10.0 111.441 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 83.5 mt -76.6 -22.48 54.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.439 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 45.5 t30 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.688 -179.839 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 96.5 mt . . . . . 0 C--O 1.233 0.227 0 CA-C-O 121.57 0.7 . . . . 10.0 109.325 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -87.88 -16.98 32.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.303 -0.862 . . . . 10.0 109.984 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 401' ' ' LEU . . . . . 0.427 ' HG ' ' CD1' ' C' ' 405' ' ' TRP . 15.6 tp -55.8 -29.85 60.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.479 -0.782 . . . . 10.0 111.802 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 92.2 mt -61.32 -44.18 97.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.995 0.426 . . . . 10.0 110.078 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -74.87 -38.51 61.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.748 179.36 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -58.01 -47.0 84.35 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.959 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 405' ' ' TRP . . . . . 0.427 ' CD1' ' HG ' ' C' ' 401' ' ' LEU . 13.0 m95 -59.59 -36.26 75.92 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.478 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -64.42 -46.9 81.21 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 109.483 -0.562 . . . . 10.0 109.483 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.16 -40.65 90.65 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.862 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.05 -37.93 81.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.74 178.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 63.0 m -64.44 -49.5 71.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.238 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 7.3 m -63.74 -25.39 68.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.911 0.386 . . . . 10.0 111.799 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 18.0 p -92.74 -5.36 51.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.829 0.347 . . . . 10.0 111.029 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -98.37 -37.72 9.51 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.92 -0.77 . . . . 10.0 108.92 178.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 2.5 p -62.58 -47.32 84.35 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 109.151 -0.685 . . . . 10.0 109.151 178.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 23.3 mttm -63.18 -29.25 70.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.551 -0.749 . . . . 10.0 110.33 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 9.0 mt -66.5 -43.3 85.71 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -69.14 -40.67 78.1 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.628 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 417' ' ' GLU . . . . . 0.587 ' O ' ' HD2' ' C' ' 421' ' ' PRO . 36.9 mt-10 -58.81 -42.8 90.0 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.312 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -43.23 74.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.459 -0.791 . . . . 10.0 109.953 178.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 37.7 mt -57.5 -33.14 67.73 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.893 -0.594 . . . . 10.0 112.062 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -53.09 -78.52 0.11 Allowed Glycine 0 CA--C 1.521 0.455 0 C-N-CA 121.34 -0.457 . . . . 10.0 112.079 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 421' ' ' PRO . . . . . 0.61 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 9.9 Cg_endo -53.42 -38.14 82.5 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 122.941 2.427 . . . . 10.0 111.829 178.662 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 16.0 t -58.96 -46.86 91.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-N 116.548 -0.297 . . . . 10.0 111.342 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 27.9 p -72.49 -33.5 66.99 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 120.84 -0.344 . . . . 10.0 110.459 179.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -56.51 -54.38 46.5 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.033 0.444 . . . . 10.0 109.825 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 425' ' ' GLU . . . . . 0.61 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 7.2 pt-20 -71.47 -31.31 67.0 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.43 179.194 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -62.6 -39.1 92.66 Favored 'General case' 0 N--CA 1.461 0.114 0 N-CA-C 109.433 -0.58 . . . . 10.0 109.433 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 23.2 m95 -67.95 -35.48 78.46 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.021 -0.733 . . . . 10.0 109.021 178.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -67.85 -35.4 78.5 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.454 -0.943 . . . . 10.0 108.454 177.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 429' ' ' ASN . . . . . 0.687 ' HA ' ' HD2' ' C' ' 432' ' ' LYS . 12.5 t-20 -66.5 -39.96 88.97 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.312 -0.996 . . . . 10.0 108.312 177.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.68 -33.47 75.71 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.689 -0.856 . . . . 10.0 108.689 177.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 431' ' ' GLU . . . . . 0.414 ' HA ' ' OG1' ' C' ' 434' ' ' THR . 12.7 mt-10 -70.01 -41.01 74.89 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.193 -0.669 . . . . 10.0 109.193 177.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 432' ' ' LYS . . . . . 0.687 ' HD2' ' HA ' ' C' ' 429' ' ' ASN . 18.0 mttt -61.68 -40.25 94.31 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.325 -0.991 . . . . 10.0 108.325 177.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 433' ' ' GLU . . . . . 0.515 ' HA ' ' OD1' ' A' ' 341' ' ' ASN . 31.1 tt0 -68.51 -48.8 63.45 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.94 -1.027 . . . . 10.0 111.022 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 434' ' ' THR . . . . . 0.51 ' HB ' ' CZ ' ' C' ' 438' ' ' ARG . 3.3 p -64.01 -47.5 80.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.787 -0.188 . . . . 10.0 111.118 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 435' ' ' GLU . . . . . 0.408 ' OE1' ' HD2' ' C' ' 438' ' ' ARG . 6.2 mm-40 -61.23 -41.26 96.57 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 110.448 -0.204 . . . . 10.0 110.448 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -66.3 -47.88 68.13 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.481 -1.048 . . . . 10.0 110.481 178.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 20.2 mt -63.89 -28.66 69.99 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 115.734 -0.233 . . . . 10.0 110.603 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 438' ' ' ARG . . . . . 0.51 ' CZ ' ' HB ' ' C' ' 434' ' ' THR . 37.4 mtt180 -67.98 -33.42 74.6 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 178.672 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -72.9 -42.79 63.19 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 108.382 -0.97 . . . . 10.0 108.382 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.48 -55.35 16.02 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.159 -0.928 . . . . 10.0 110.957 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 69.5 mmm -58.18 -41.5 84.04 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 113.57 0.952 . . . . 10.0 113.57 -178.132 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 10.9 p -61.14 -52.54 64.45 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.513 -0.475 . . . . 10.0 109.934 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 443' ' ' LYS . . . . . 0.469 ' HE3' ' HA ' ' A' ' 330' ' ' ARG . 0.6 OUTLIER -62.99 -41.44 99.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.594 -0.73 . . . . 10.0 109.869 179.069 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 444' ' ' ASP . . . . . 0.507 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 5.0 t70 -60.08 -50.81 72.23 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.393 -0.821 . . . . 10.0 110.29 179.649 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 445' ' ' LEU . . . . . 0.503 ' HA ' HG12 ' C' ' 448' ' ' VAL . 43.5 mt -64.55 -46.29 83.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.941 -0.572 . . . . 10.0 112.153 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -59.5 -47.97 83.44 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.94 -0.304 . . . . 10.0 111.004 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 447' ' ' GLU . . . . . 0.619 ' O ' ' HB2' ' C' ' 451' ' ' LYS . 73.1 mt-10 -74.9 -17.33 60.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.921 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 448' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.5 OUTLIER -86.06 -37.6 11.88 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 C-N-CA 120.899 -0.321 . . . . 10.0 110.715 178.899 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -68.65 -38.35 80.37 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.079 -0.711 . . . . 10.0 109.079 178.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -77.1 -0.87 26.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.526 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 451' ' ' LYS . . . . . 0.621 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 0.0 OUTLIER -107.0 -35.15 6.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.372 -0.831 . . . . 10.0 109.451 179.451 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 452' ' ' VAL . . . . . 0.448 HG23 ' O ' ' C' ' 448' ' ' VAL . 41.8 t -67.31 -37.08 78.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.069 179.165 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 453' ' ' GLN . . . . . 0.411 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 67.0 mt-30 -56.09 -60.19 9.59 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.788 178.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 454' ' ' PRO . . . . . 0.411 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 36.6 Cg_endo -68.52 -20.6 41.16 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.572 1.514 . . . . 10.0 111.323 178.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 455' ' ' TYR . . . . . 0.621 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.1 OUTLIER -70.06 -50.75 38.02 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.983 -0.747 . . . . 10.0 108.983 178.749 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 456' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' C' ' 460' ' ' GLN . 57.1 mt -66.45 -39.13 88.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.415 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -62.28 -49.13 76.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.247 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -67.06 -41.41 86.49 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.681 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 459' ' ' PHE . . . . . 0.504 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 0.1 OUTLIER -62.89 -47.64 82.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 10.0 109.939 179.271 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 460' ' ' GLN . . . . . 0.573 ' HA ' ' HB2' ' C' ' 463' ' ' TRP . 0.7 OUTLIER -68.36 -26.04 65.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.326 -0.397 . . . . 10.0 111.177 179.747 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 461' ' ' LYS . . . . . 0.456 ' HB2' ' HE3' ' C' ' 461' ' ' LYS . 20.1 ttmt -67.92 -46.32 71.89 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.121 -1.066 . . . . 10.0 108.121 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 462' ' ' LYS . . . . . 0.558 ' HD3' ' HA ' ' A' ' 312' ' ' HIS . 20.8 mtmm -71.59 -36.64 70.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.108 -0.951 . . . . 10.0 109.781 178.511 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 463' ' ' TRP . . . . . 0.573 ' HB2' ' HA ' ' C' ' 460' ' ' GLN . 1.1 m0 -63.48 -44.0 95.65 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.575 -0.738 . . . . 10.0 109.927 179.05 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -65.7 -40.28 92.13 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 178.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 1.188 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 31.9 tt0 -58.19 -48.37 80.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.489 -0.778 . . . . 10.0 109.697 178.441 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 466' ' ' GLU . . . . . 0.637 ' HA ' HD12 ' C' ' 469' ' ' LEU . 16.4 mt-10 -72.51 -36.49 68.37 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.388 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 3.8 mmt -61.66 -51.77 67.08 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 110.285 -0.265 . . . . 10.0 110.285 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.76 -39.08 93.39 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.618 -0.882 . . . . 10.0 108.618 178.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 1.188 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 96.5 mt -57.7 -50.09 74.34 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.369 -0.832 . . . . 20.0 109.602 178.251 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 18.3 m-30 -60.71 -40.04 90.79 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.132 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -64.51 -31.95 73.38 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.541 -0.299 . . . . 10.0 111.211 179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -92.93 -2.03 56.18 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.988 0.366 . . . . 10.0 111.988 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 53.8 mttm -114.28 -45.66 3.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.898 0.38 . . . . 10.0 111.213 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 88.0 t -69.23 -32.44 53.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.519 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 475' ' ' GLU . . . . . 0.436 ' HB3' ' CD ' ' C' ' 476' ' ' PRO . 35.2 tt0 -59.44 -59.98 12.05 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 121.066 -0.254 . . . . 10.0 110.723 179.089 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 476' ' ' PRO . . . . . 0.436 ' CD ' ' HB3' ' C' ' 475' ' ' GLU . 18.6 Cg_endo -62.0 -31.95 84.18 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 121.589 1.526 . . . . 10.0 110.458 177.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 8.0 mt -65.7 -37.89 87.71 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -64.81 -41.57 95.67 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 108.577 -0.897 . . . . 10.0 108.577 178.381 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.57 89.87 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.846 -0.616 . . . . 10.0 109.616 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.18 -41.58 98.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.67 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 481' ' ' LEU . . . . . 0.488 ' HB3' H281 ' A' ' 65' ' ' PCW . 22.9 mt -69.26 -30.32 68.42 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.993 -0.548 . . . . 10.0 109.837 178.595 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -69.64 -60.07 2.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.09 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -62.95 -35.24 79.49 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -66.61 -43.21 92.63 Favored Glycine 0 N--CA 1.446 -0.666 0 N-CA-C 110.949 -0.86 . . . . 10.0 110.949 178.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -70.82 -35.76 72.62 Favored 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 109.308 -0.627 . . . . 10.0 109.308 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 66.1 mtt180 -62.45 -41.48 98.77 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 109.453 -0.573 . . . . 10.0 109.453 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 487' ' ' GLN . . . . . 0.511 ' OE1' ' HE3' ' A' ' 290' ' ' LYS . 1.3 tt0 -66.44 -46.67 75.66 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.809 -0.812 . . . . 10.0 108.809 178.055 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -63.47 -37.63 88.02 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.654 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 489' ' ' LEU . . . . . 0.6 ' O ' ' HG3' ' C' ' 493' ' ' GLN . 37.2 mt -68.46 -43.96 75.9 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 178.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -62.93 -37.6 87.69 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.408 -0.96 . . . . 10.0 108.408 178.154 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 491' ' ' GLU . . . . . 0.61 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 28.9 mt-10 -62.04 -50.24 72.8 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 107.711 -1.218 . . . . 10.0 107.711 176.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 48.2 mt -58.01 -33.14 68.62 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 115.424 -0.807 . . . . 10.0 111.152 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 493' ' ' GLN . . . . . 0.6 ' HG3' ' O ' ' C' ' 489' ' ' LEU . 29.6 mt-30 -65.06 -40.88 95.35 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.936 -0.764 . . . . 10.0 108.936 178.341 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.54 7.61 16.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.291 179.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.689 ' HG2' HD22 ' A' ' 279' ' ' LEU . 16.1 mttm -116.88 -48.74 2.65 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 178.349 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 95.4 mt -71.58 -37.26 71.03 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.65 0.611 . . . . 10.0 112.65 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 4.9 m -65.51 -58.86 10.7 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 112.17 0.433 . . . . 10.0 112.17 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -62.93 -45.65 12.52 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 122.113 1.875 . . . . 10.0 111.621 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 499' ' ' LEU . . . . . 0.579 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 18.7 mt -67.49 -35.01 78.32 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 121.1 -0.24 . . . . 10.0 110.656 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.67 -48.35 62.62 Favored Glycine 0 N--CA 1.451 -0.314 0 N-CA-C 110.317 -1.113 . . . . 10.0 110.317 178.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -61.26 -38.21 85.89 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 502' ' ' GLU . . . . . 0.688 ' HG2' ' HE ' ' C' ' 506' ' ' ARG . 25.7 tt0 -68.29 -45.57 72.71 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.387 -0.824 . . . . 10.0 109.674 178.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 503' ' ' MET . . . . . 0.631 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 78.3 mmm -60.17 -34.43 73.58 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.887 -0.412 . . . . 10.0 109.887 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -66.63 -39.9 88.5 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.56 -0.533 . . . . 10.0 109.56 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -69.01 -42.09 76.91 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.787 -0.82 . . . . 10.0 108.787 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.688 ' HE ' ' HG2' ' C' ' 502' ' ' GLU . 45.0 mtt180 -61.84 -44.7 96.31 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.341 -0.845 . . . . 10.0 108.858 178.504 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.9 -44.77 94.07 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.063 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 508' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' C' ' 508' ' ' ARG . 46.3 mtt85 -62.08 -44.41 96.72 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.537 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -69.15 -19.62 64.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.711 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 8.9 m170 -94.23 -57.81 2.4 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.94 0.4 . . . . 10.0 111.225 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 25.8 t -66.37 -43.36 91.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.985 -0.552 . . . . 10.0 112.375 -178.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.764 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 3.0 t70 -66.17 -33.0 74.77 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 120.194 -0.602 . . . . 10.0 109.919 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.65 -37.5 84.93 Favored 'General case' 0 C--O 1.222 -0.344 0 N-CA-C 107.606 -1.257 . . . . 10.0 107.606 177.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 84.6 mt -67.73 -27.93 67.22 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.566 178.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 515' ' ' ARG . . . . . 0.764 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 86.0 mtt180 -70.56 -33.53 71.22 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.564 -0.532 . . . . 10.0 109.564 178.702 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.32 3.78 54.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.817 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 62.7 m170 -119.61 -49.72 2.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.844 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 79.7 mt -77.48 -36.34 52.82 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.46 0.541 . . . . 10.0 112.46 -179.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -57.37 -57.17 26.89 Favored Pre-proline 0 C--N 1.331 -0.211 0 C-N-CA 120.747 -0.381 . . . . 10.0 110.973 179.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -62.96 -34.36 71.33 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.21 1.273 . . . . 10.0 110.166 177.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 521' ' ' TYR . . . . . 0.502 ' HA ' ' OE1' ' C' ' 524' ' ' GLU . 35.2 t80 -61.55 -45.81 92.59 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.767 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 522' ' ' SER . . . . . 0.49 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 12.1 p -63.86 -34.75 78.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.969 0.414 . . . . 10.0 110.392 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 523' ' ' ASP . . . . . 0.424 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 2.6 t0 -70.79 -40.22 72.68 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.455 -0.572 . . . . 10.0 109.455 178.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 524' ' ' GLU . . . . . 0.502 ' OE1' ' HA ' ' C' ' 521' ' ' TYR . 69.0 mt-10 -64.26 -40.3 95.7 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 108.451 -0.944 . . . . 10.0 108.451 178.075 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 35.6 mt -62.89 -38.53 91.27 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 115.3 -0.864 . . . . 10.0 109.655 178.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 526' ' ' ARG . . . . . 0.49 ' HG3' ' O ' ' C' ' 522' ' ' SER . 78.6 mtt180 -58.3 -40.2 81.38 Favored 'General case' 0 C--O 1.226 -0.174 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.322 178.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -64.94 -49.35 70.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.979 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 44.4 mtt180 -64.25 -39.95 95.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.109 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 60.0 mt -70.22 -30.34 67.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.055 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -61.89 -48.09 82.04 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.78 -40.69 92.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.422 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 532' ' ' ARG . . . . . 0.811 HH21 ' HB3' ' A' ' 242' ' ' GLU . 8.5 ttm180 -59.44 -46.76 87.84 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.669 -0.696 . . . . 10.0 109.94 178.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 65.1 mt -66.15 -39.77 90.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.813 -0.631 . . . . 10.0 110.125 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -62.57 -39.41 93.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 10.0 109.935 178.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.41 -42.72 92.26 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.669 -0.863 . . . . 10.0 108.669 177.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.5 -24.45 67.14 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.1 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -79.18 -45.63 19.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.843 178.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -63.22 -52.17 63.3 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 539' ' ' ASN . . . . . 0.523 ' OD1' ' HE3' ' A' ' 234' ' ' LYS . 54.2 m-20 -68.34 -30.71 69.73 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.569 -0.741 . . . . 10.0 109.519 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 540' ' ' GLY . . . . . 0.483 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -65.79 -51.91 42.61 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.21 -0.756 . . . . 10.0 111.21 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -60.48 -38.25 94.55 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 110.734 -0.947 . . . . 10.0 110.734 178.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -63.42 -54.28 39.04 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.845 -0.798 . . . . 10.0 108.845 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 543' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' C' ' 543' ' ' ARG . 50.0 mtt180 -55.14 -41.76 72.16 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.61 179.098 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 544' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 55.8 mt -56.57 -50.43 71.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.667 0.27 . . . . 10.0 110.808 179.591 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.85 -47.53 68.69 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.023 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -60.72 -44.52 96.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.879 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -69.85 -37.89 76.3 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.015 -0.365 . . . . 10.0 110.015 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.4 m170 -63.5 -46.64 85.15 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.864 -0.421 . . . . 10.0 109.864 179.07 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 549' ' ' ALA . . . . . 0.501 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -63.1 -45.6 91.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.978 -0.556 . . . . 10.0 109.527 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 550' ' ' LYS . . . . . 0.449 ' HA ' ' HD3' ' C' ' 550' ' ' LYS . 0.1 OUTLIER -63.12 -35.57 80.71 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.772 179.304 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -67.57 -36.8 81.63 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.28 -0.637 . . . . 10.0 109.28 178.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 18.1 m -63.06 -48.19 79.71 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 108.174 -1.047 . . . . 10.0 108.174 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 553' ' ' GLU . . . . . 0.501 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 39.8 mt-10 -59.47 -43.49 93.24 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.023 178.41 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 554' ' ' HIS . . . . . 0.504 ' O ' ' HB2' ' C' ' 558' ' ' LEU . 39.6 t-80 -63.87 -31.79 73.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.63 -0.714 . . . . 10.0 111.397 179.54 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 60.4 mt -73.72 -49.02 27.71 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.167 -0.308 . . . . 10.0 110.167 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 5.5 m -62.12 -33.73 75.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.033 0.444 . . . . 10.0 110.629 179.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 557' ' ' THR . . . . . 0.415 ' HB ' ' HG2' ' A' ' 216' ' ' LYS . 33.2 p -83.45 -9.7 58.83 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.107 0.479 . . . . 10.0 110.944 179.456 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 558' ' ' LEU . . . . . 0.504 ' HB2' ' O ' ' C' ' 554' ' ' HIS . 0.2 OUTLIER -86.51 -47.75 8.98 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.459 -1.311 . . . . 10.0 107.459 177.806 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 559' ' ' SER . . . . . 0.706 ' HB2' ' HE2' ' C' ' 563' ' ' LYS . 1.7 p -67.83 -23.22 65.14 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.442 -0.947 . . . . 10.0 108.442 177.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -57.92 -25.69 61.22 Favored 'General case' 0 CA--C 1.524 -0.045 0 CA-C-N 114.907 -1.042 . . . . 10.0 109.505 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 561' ' ' LYS . . . . . 0.443 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 47.4 mttp -112.4 -33.94 6.03 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.571 -0.741 . . . . 10.0 110.35 179.306 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 562' ' ' ALA . . . . . 0.612 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -61.16 -11.47 9.12 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.948 0.404 . . . . 10.0 111.896 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 563' ' ' LYS . . . . . 0.706 ' HE2' ' HB2' ' C' ' 559' ' ' SER . 62.9 mttm -98.09 -67.07 0.06 OUTLIER Pre-proline 0 C--N 1.325 -0.496 0 C-N-CA 120.913 -0.315 . . . . 10.0 111.316 178.549 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 564' ' ' PRO . . . . . 0.572 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 55.8 Cg_endo -69.92 -40.92 4.53 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 121.887 1.725 . . . . 10.0 113.467 -179.066 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 565' ' ' ALA . . . . . 0.443 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -68.07 -42.78 79.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.496 0.189 . . . . 10.0 110.702 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 566' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' C' ' 562' ' ' ALA . 8.0 mt -64.01 -39.44 94.11 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.723 -0.391 . . . . 10.0 109.958 178.405 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -68.96 -33.32 73.51 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.855 -0.424 . . . . 10.0 109.855 178.381 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.04 -44.93 91.0 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.341 -0.985 . . . . 10.0 108.341 178.076 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 569' ' ' LEU . . . . . 0.803 HD21 HD21 ' A' ' 206' ' ' ASN . 83.2 mt -67.19 -38.17 84.89 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.131 -0.94 . . . . 10.0 110.356 178.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -64.25 -38.18 90.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.452 0.644 . . . . 10.0 109.605 178.567 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -81.69 -10.31 59.42 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.408 -0.815 . . . . 20.0 111.285 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -92.23 -47.96 3.18 Favored Glycine 0 CA--C 1.521 0.432 0 N-CA-C 108.993 -1.643 . . . . 10.0 108.993 178.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 573' ' ' LEU . . . . . 0.434 ' HA ' ' HB ' ' C' ' 576' ' ' VAL . 75.0 mt -61.54 -25.03 67.03 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.572 -0.314 . . . . 10.0 111.45 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 4.7 mt -60.07 -66.34 1.55 Allowed Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 121.191 -0.204 . . . . 10.0 111.038 178.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.98 -28.73 57.76 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 121.711 1.607 . . . . 10.0 111.094 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 576' ' ' VAL . . . . . 0.434 ' HB ' ' HA ' ' C' ' 573' ' ' LEU . 5.7 t -64.39 -47.07 91.05 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 178.547 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 34.0 mt -67.38 -34.93 78.3 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.919 -0.4 . . . . 10.0 109.919 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -62.9 -47.85 81.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.315 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 4.2 p -71.21 -36.57 71.92 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.917 -0.401 . . . . 10.0 109.917 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.7 -43.65 98.44 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 178.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -62.06 -44.99 95.49 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 178.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 50.8 t -59.29 -44.24 91.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.204 0.526 . . . . 10.0 109.624 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 15.2 m -65.98 -45.18 82.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.706 -0.679 . . . . 10.0 111.05 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -69.68 -40.91 76.09 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.375 0.509 . . . . 10.0 112.375 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 52.7 mt -61.29 -40.27 93.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.865 0.364 . . . . 10.0 110.049 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 586' ' ' SER . . . . . 0.478 ' O ' ' HG3' ' C' ' 590' ' ' GLU . 19.1 m -73.47 -37.43 65.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.078 -0.712 . . . . 10.0 109.078 178.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 587' ' ' ALA . . . . . 0.547 ' HA ' ' HE3' ' A' ' 396' ' ' LYS . . . -58.89 -50.52 73.71 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.674 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.9 mt -62.82 -37.61 87.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.29 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 589' ' ' GLU . . . . . 0.409 ' HG2' ' HE3' ' C' ' 593' ' ' LYS . 3.5 tt0 -62.64 -46.5 87.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.337 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 590' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' C' ' 586' ' ' SER . 55.2 mt-10 -63.81 -40.99 97.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.78 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 591' ' ' TYR . . . . . 0.552 ' CZ ' ' HE2' ' A' ' 396' ' ' LYS . 11.7 m-85 -64.54 -42.99 95.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.879 -179.615 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 1.6 p -69.49 -21.93 63.65 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.562 0.579 . . . . 10.0 112.562 -179.134 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 593' ' ' LYS . . . . . 0.409 ' HE3' ' HG2' ' C' ' 589' ' ' GLU . 90.5 mttt -84.94 -14.86 46.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.306 0.574 . . . . 10.0 110.586 179.386 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.19 -48.98 4.22 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.76 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 89.2 mt -94.2 48.94 1.27 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.143 0.497 . . . . 10.0 110.478 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 . . . . . 0 C--O 1.251 1.146 0 CA-C-O 118.652 -0.69 . . . . 10.0 110.825 -179.067 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.521 ' SD ' ' H72' ' A' ' 30' ' ' PCW . 33.5 ttp . . . . . 0 C--O 1.233 0.221 0 CA-C-O 121.205 0.526 . . . . 10.0 110.586 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 22.2 m -153.74 -78.49 0.1 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.749 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.728 ' HG2' ' HB2' ' B' ' 52' ' ' LEU . 0.0 OUTLIER -145.63 138.84 26.21 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.878 -0.786 . . . . 10.0 108.878 -179.423 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -140.16 127.28 20.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.061 0.457 . . . . 10.0 111.91 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.72 ' NZ ' ' HN1' ' A' ' 40' ' ' 17F . 14.3 mptt -93.22 117.9 30.61 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.846 -0.798 . . . . 10.0 108.846 178.538 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 68.8 mt -110.69 118.24 35.64 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.206 0.527 . . . . 10.0 111.663 -178.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.402 HG13 HD23 ' B' ' 56' ' ' LEU . 39.6 t -95.71 112.05 27.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.437 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 38.6 t -94.32 116.0 34.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 109.596 -0.52 . . . . 10.0 109.596 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 21.2 m -105.33 167.54 2.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.425 -0.352 . . . . 10.0 111.336 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 150.56 165.69 12.92 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 111.458 -0.657 . . . . 10.0 111.458 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.26 169.06 14.15 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.726 0.298 . . . . 10.0 111.025 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -77.75 61.32 3.67 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.298 -0.477 . . . . 10.0 112.373 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -153.83 -32.06 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 111.027 -0.829 . . . . 10.0 111.027 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 21.4 m -77.2 166.68 2.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 110.205 -0.294 . . . . 10.0 110.205 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' GLY . . . . . 0.409 ' HA3' ' N7 ' ' B' ' 201' ' ' GNP . . . -83.77 54.96 5.0 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.756 -0.735 . . . . 10.0 113.498 -179.004 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 18.5 mtmt -60.62 -61.99 2.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.989 0.423 . . . . 10.0 111.204 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' SER . . . . . 0.415 ' O ' HG13 ' B' ' 21' ' ' ILE . 1.8 p -63.99 -36.27 83.41 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.82 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.58 -50.0 75.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.113 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 63.8 mt -61.31 -42.68 99.07 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.831 0.348 . . . . 10.0 110.767 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 13.7 m -61.24 -49.21 78.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.953 -0.567 . . . . 10.0 111.002 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' ILE . . . . . 0.415 HG13 ' O ' ' B' ' 17' ' ' SER . 67.4 mt -67.39 -32.49 57.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.79 0.328 . . . . 10.0 110.591 179.744 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.527 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 17.1 tp60 -67.68 -18.61 65.0 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.121 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.8 tp -99.11 -37.88 9.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.208 0.528 . . . . 10.0 110.656 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 45.8 mm -76.04 -68.92 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.408 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' GLN . . . . . 0.416 ' OE1' ' HA ' ' D' ' 840' ' ' VAL . 42.0 mt-30 -85.89 -21.55 27.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.061 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.527 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 27.9 m-80 66.97 34.53 5.17 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.971 -178.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -127.45 126.97 43.29 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.252 -0.886 . . . . 10.0 109.277 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -78.19 133.44 37.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.93 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 3.4 m -107.62 123.71 63.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.762 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -89.08 -29.32 19.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.589 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -68.31 135.01 51.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.463 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.579 ' CD2' H5'1 ' B' ' 201' ' ' GNP . 34.8 t80 -87.33 94.42 9.67 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.979 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 33' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 2.0 t70 -98.11 130.68 28.0 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 109.486 -0.561 . . . . 10.0 109.486 179.026 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 34' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 31.0 Cg_exo -64.14 178.08 1.69 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.97 2.447 . . . . 10.0 112.454 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.2 m -163.69 141.73 7.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.225 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.794 HD11 HG21 ' D' ' 809' ' ' THR . 5.3 mt -118.7 -65.19 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 108.654 -0.869 . . . . 10.0 108.654 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.48 ' O ' HG23 ' D' ' 821' ' ' VAL . 14.1 tt0 -148.77 93.45 2.12 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.093 -0.706 . . . . 10.0 109.093 179.019 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 38' ' ' ASP . . . . . 0.718 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 56.6 m-20 -114.13 160.95 18.38 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.654 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 39' ' ' SER . . . . . 0.406 ' HB2' ' HB3' ' D' ' 818' ' ' GLN . 4.5 m -146.53 140.41 26.14 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.971 0.415 . . . . 10.0 112.021 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 40' ' ' TYR . . . . . 0.592 ' CE2' HG22 ' D' ' 840' ' ' VAL . 2.8 m-85 -129.67 152.43 49.19 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 109.336 -0.616 . . . . 10.0 109.336 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 41' ' ' ARG . . . . . 0.602 HH12 ' HD3' ' D' ' 817' ' ' LYS . 11.7 ttp180 -141.47 137.25 31.99 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 122.076 -0.39 . . . . 10.0 110.826 -178.284 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -155.92 147.51 22.87 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -102.16 125.62 48.9 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.782 -0.451 . . . . 10.0 109.782 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 15.6 m -136.97 158.26 36.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.847 0.356 . . . . 10.0 111.074 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.613 ' HA ' ' HA ' ' B' ' 50' ' ' THR . 24.7 t -95.63 101.71 12.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 109.179 -0.674 . . . . 10.0 109.179 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' ILE . . . . . 0.528 HD11 HD11 ' B' ' 53' ' ' LEU . 54.5 mt -92.26 105.28 16.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.453 -178.671 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 57.25 36.63 27.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.5 -0.773 . . . . 10.0 111.728 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.1 -15.32 62.67 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.772 -0.728 . . . . 10.0 113.611 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -106.13 109.05 20.86 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.874 0.337 . . . . 10.0 111.07 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.613 ' HA ' ' HA ' ' B' ' 45' ' ' VAL . 11.1 t -76.04 143.52 41.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.561 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 1.4 p -165.0 162.41 20.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.378 -179.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.728 ' HB2' ' HG2' ' B' ' 3' ' ' GLU . 17.6 mt -95.06 129.49 42.13 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 179.053 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.528 HD11 HD11 ' B' ' 46' ' ' ILE . 89.6 mt -110.03 122.09 46.77 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.958 -0.297 . . . . 10.0 111.552 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.453 ' HB3' ' HG3' ' B' ' 5' ' ' LYS . 7.8 t70 -99.25 100.9 12.05 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.067 -1.086 . . . . 10.0 108.067 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 32.1 mt -88.86 126.02 41.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.346 -178.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.402 HD23 HG13 ' B' ' 7' ' ' VAL . 33.0 tp -101.1 116.31 32.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.778 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.718 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 9.1 t0 -92.48 98.94 11.78 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 40.1 p -77.92 164.92 24.7 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 113.004 0.742 . . . . 10.0 113.004 -178.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.63 163.59 23.41 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.219 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.63 -32.04 47.77 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.73 -0.747 . . . . 10.0 112.675 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -150.28 131.85 14.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.823 0.344 . . . . 20.0 111.218 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.429 ' OE2' ' HD2' ' B' ' 68' ' ' ARG . 36.6 mt-10 -133.46 158.35 43.32 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.527 -0.546 . . . . 10.0 109.527 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -92.68 -74.38 0.52 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.127 0.489 . . . . 10.0 109.722 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -162.99 61.01 0.19 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.364 -0.834 . . . . 10.0 109.096 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.49 126.82 31.58 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.415 -0.812 . . . . 10.0 111.486 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.07 -37.44 87.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.255 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 7.9 tmm? -63.11 -34.32 77.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.287 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.685 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 32.3 ttt85 -61.86 -46.7 88.31 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.396 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.61 -24.65 67.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.633 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -78.54 -44.4 24.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.767 -0.651 . . . . 10.0 111.115 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 71' ' ' TYR . . . . . 0.685 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 1.4 p90 -70.95 -29.27 65.24 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 120.363 -0.535 . . . . 10.0 112.183 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 76.5 mtp -79.42 -15.22 58.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 10.0 109.996 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 73' ' ' ARG . . . . . 0.789 ' HD3' ' HB ' ' B' ' 103' ' ' VAL . 2.9 tpp180 -74.01 -27.01 60.75 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.18 -179.262 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 m -82.8 -33.2 27.32 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.689 0.625 . . . . 10.0 112.689 -178.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -57.29 148.28 33.7 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 114.445 0.538 . . . . 10.0 114.445 -178.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 76' ' ' GLU . . . . . 0.491 ' O ' ' HD2' ' B' ' 110' ' ' PRO . 13.6 tt0 -111.21 -39.71 4.65 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-O 121.112 0.482 . . . . 10.0 109.8 178.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -118.51 138.11 13.47 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 110.998 -0.841 . . . . 10.0 110.998 179.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.403 ' O ' ' HA ' ' B' ' 111' ' ' MET . 85.5 m-85 -129.58 143.08 50.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.051 0.453 . . . . 10.0 111.949 -178.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.746 ' HG ' HD22 ' B' ' 159' ' ' LEU . 58.7 mt -99.85 122.21 42.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.144 179.375 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 80' ' ' CYS . . . . . 0.428 ' HB2' ' HA ' ' B' ' 113' ' ' LEU . 6.7 m -88.87 78.88 7.49 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.533 ' HA ' ' HB ' ' B' ' 114' ' ' VAL . 21.5 t -82.91 118.66 30.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.547 -178.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.824 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 18.8 p90 -134.75 158.93 42.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.855 -0.612 . . . . 10.0 109.712 178.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -97.29 130.69 44.45 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 84' ' ' ILE . . . . . 0.668 HD11 ' HA ' ' B' ' 118' ' ' CYS . 27.7 pt -73.31 -5.25 6.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.015 0.436 . . . . 10.0 111.372 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.08 3.5 28.19 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.027 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -126.62 116.81 21.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.915 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.41 -32.36 71.29 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.283 0.475 . . . . 10.0 112.283 -178.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -60.97 -46.19 91.73 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 111.654 0.242 . . . . 10.0 111.654 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 89' ' ' SER . . . . . 0.824 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.8 OUTLIER -59.73 -26.32 65.55 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.43 0.53 . . . . 10.0 112.43 -179.643 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -70.54 -34.01 71.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.041 0.448 . . . . 10.0 110.138 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -85.71 -26.99 25.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.738 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 92' ' ' ASP . . . . . 0.467 ' HB2' ' HA ' ' B' ' 89' ' ' SER . 0.3 OUTLIER -66.71 -17.07 64.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.439 179.752 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 93' ' ' ILE . . . . . 0.632 HD11 ' HB3' ' B' ' 82' ' ' PHE . 43.6 mm -60.69 -45.82 96.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -67.71 -37.13 81.83 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 8.7 t-160 -61.42 -39.32 90.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.396 -0.82 . . . . 10.0 110.195 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -74.83 -46.72 34.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.526 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.97 -40.76 85.75 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.673 0.273 . . . . 10.0 111.27 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -65.32 -34.41 78.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.758 0.313 . . . . 10.0 111.144 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -69.25 -46.23 67.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.224 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 100' ' ' ILE . . . . . 0.502 ' HA ' HG22 ' B' ' 103' ' ' VAL . 41.8 mt -68.29 -33.96 63.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.115 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 101' ' ' LYS . . . . . 0.419 ' HD2' ' HG3' ' B' ' 107' ' ' GLU . 29.2 ttpt -60.43 -31.41 70.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.984 0.421 . . . . 10.0 110.642 179.386 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 44.9 ttp85 -78.21 -34.05 49.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.009 -0.542 . . . . 10.0 111.852 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.789 ' HB ' ' HD3' ' B' ' 73' ' ' ARG . 19.9 m -77.39 -32.11 18.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 112.405 0.52 . . . . 10.0 112.405 -179.157 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -95.92 -14.66 22.93 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.682 -0.407 . . . . 10.0 111.379 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 105' ' ' ASP . . . . . 0.479 ' OD1' ' H62' ' A' ' 16' ' ' PCW . 26.2 t0 58.85 48.15 11.6 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.496 0.665 . . . . 10.0 110.995 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 32.5 t -178.23 153.59 0.78 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.445 -0.798 . . . . 10.0 110.336 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 107' ' ' GLU . . . . . 0.419 ' HG3' ' HD2' ' B' ' 101' ' ' LYS . 17.1 mp0 -91.82 -8.17 47.39 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 108.715 -0.846 . . . . 10.0 108.715 178.364 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -83.82 64.02 7.82 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 114.969 -1.014 . . . . 10.0 110.568 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 50.5 t -121.15 116.95 30.88 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.226 -0.897 . . . . 10.0 109.797 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 110' ' ' PRO . . . . . 0.491 ' HD2' ' O ' ' B' ' 76' ' ' GLU . 51.4 Cg_exo -55.77 113.14 1.29 Allowed 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.927 2.418 . . . . 10.0 111.555 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 111' ' ' MET . . . . . 0.403 ' HA ' ' O ' ' B' ' 78' ' ' PHE . 65.3 mtt -133.28 150.95 51.89 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.293 -179.726 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 112' ' ' VAL . . . . . 0.481 ' HB ' HD23 ' B' ' 79' ' ' LEU . 95.1 t -132.0 124.96 54.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 179.2 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 113' ' ' LEU . . . . . 0.428 ' HA ' ' HB2' ' B' ' 80' ' ' CYS . 15.0 tp -75.6 121.09 21.91 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.8 -0.815 . . . . 10.0 108.8 179.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 114' ' ' VAL . . . . . 0.533 ' HB ' ' HA ' ' B' ' 81' ' ' VAL . 60.8 t -114.8 111.5 36.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 112.026 0.38 . . . . 10.0 112.026 -178.238 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -89.38 100.12 2.63 Favored Glycine 0 N--CA 1.449 -0.486 0 N-CA-C 109.746 -1.341 . . . . 10.0 109.746 178.558 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -86.67 153.13 21.99 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 112.544 0.572 . . . . 10.0 112.544 -177.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 77.4 mttt 70.38 46.39 0.58 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 114.919 -1.037 . . . . 10.0 113.442 178.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 118' ' ' CYS . . . . . 0.668 ' HA ' HD11 ' B' ' 84' ' ' ILE . 15.5 p -78.78 -2.53 39.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.986 0.422 . . . . 10.0 111.404 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -92.67 0.56 57.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.967 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 17.7 mt -97.13 127.08 39.82 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.838 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.68 -26.59 68.7 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.999 2.466 . . . . 10.0 111.286 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.35 70.4 4.7 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.589 -0.732 . . . . 10.0 110.001 179.29 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 24.6 ttt180 -101.41 122.46 43.79 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.579 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.21 -49.43 4.48 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.361 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 62.1 t -78.67 116.51 22.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.665 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -73.3 153.48 40.54 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.028 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 2.3 m -60.15 -37.41 80.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.229 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 16.4 tttm -68.25 -36.93 80.21 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 121.174 -0.211 . . . . 10.0 111.092 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -60.26 -39.65 87.55 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.058 0.456 . . . . 10.0 110.188 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -71.93 -41.22 68.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.114 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -61.64 -37.09 82.71 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.895 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.89 -46.76 80.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.149 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 32.8 tp -64.36 -42.13 96.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.451 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.76 -44.56 95.89 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.967 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.59 -27.53 69.01 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.071 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.9 m -71.21 -25.73 62.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.074 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 137' ' ' TYR . . . . . 0.431 ' HB2' HG12 ' B' ' 139' ' ' ILE . 21.8 m-85 -99.8 -20.0 16.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.975 0.416 . . . . 10.0 110.376 179.386 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.89 21.49 52.82 Favored Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 111.018 -0.833 . . . . 10.0 111.018 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 139' ' ' ILE . . . . . 0.431 HG12 ' HB2' ' B' ' 137' ' ' TYR . 49.1 pt -109.58 155.78 40.76 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.732 -0.234 . . . . 10.0 110.654 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -79.9 158.01 24.16 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.341 2.027 . . . . 10.0 111.97 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -120.76 122.95 41.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.553 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 24.0 mm -122.0 116.52 49.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.715 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 143' ' ' GLU . . . . . 0.6 ' HG2' ' HB3' ' B' ' 118' ' ' CYS . 6.8 tt0 -83.19 128.13 34.22 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.74 -0.837 . . . . 10.0 108.74 178.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 81.4 p -135.66 167.82 20.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.884 0.85 . . . . 10.0 112.987 -177.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 145' ' ' SER . . . . . 0.409 ' HB3' ' OG1' ' B' ' 148' ' ' THR . 5.6 t -157.55 131.81 8.32 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.471 -1.24 . . . . 10.0 108.173 178.342 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -76.71 -14.56 59.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.842 0.353 . . . . 10.0 110.639 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -85.48 -44.43 12.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.954 -0.566 . . . . 10.0 111.111 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 148' ' ' THR . . . . . 0.409 ' OG1' ' HB3' ' B' ' 145' ' ' SER . 48.9 p -86.05 -25.83 25.68 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.992 0.425 . . . . 10.0 110.368 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 14.2 ttt-85 66.07 27.55 10.55 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.435 -0.802 . . . . 10.0 110.682 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -91.9 127.53 37.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.262 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.35 7.22 67.49 Favored Glycine 0 C--O 1.228 -0.268 0 CA-C-N 115.977 -0.556 . . . . 10.0 113.939 178.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 95.3 t -66.57 -55.36 18.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.72 0.295 . . . . 10.0 111.63 -179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.46 -42.46 98.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.672 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -65.05 -31.77 73.16 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.319 0.489 . . . . 10.0 112.319 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.91 -46.67 89.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.107 0.48 . . . . 10.0 109.868 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -70.94 -40.03 72.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.384 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -62.92 -44.36 96.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.228 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.767 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 70.7 m -63.91 -33.68 76.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.859 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.746 HD22 ' HG ' ' B' ' 79' ' ' LEU . 58.1 tp -60.9 -42.82 98.76 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.513 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 160' ' ' VAL . . . . . 0.419 HG21 HD13 ' B' ' 46' ' ' ILE . 47.8 t -69.76 -32.96 54.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.74 178.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 161' ' ' ARG . . . . . 0.767 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 72.8 mtt180 -63.4 -41.19 98.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.557 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -64.65 -38.17 90.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 163' ' ' ILE . . . . . 0.547 HG22 ' HE2' ' B' ' 167' ' ' LYS . 97.1 mt -67.02 -40.12 84.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.477 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 30.1 ttm180 -58.17 -46.52 85.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.584 -0.735 . . . . 10.0 109.701 179.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -70.39 -33.32 71.25 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.291 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -59.93 -41.79 92.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.756 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 167' ' ' LYS . . . . . 0.547 ' HE2' HG22 ' B' ' 163' ' ' ILE . 67.6 mttm -68.22 -43.66 77.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.691 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 168' ' ' GLU . . . . . 0.429 ' HG2' ' HE3' ' B' ' 172' ' ' LYS . 23.7 tt0 -67.83 -33.52 74.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.078 0.466 . . . . 10.0 110.201 179.375 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -67.78 -28.92 68.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.704 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 54.8 ttp -62.01 -38.01 87.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.95 0.405 . . . . 10.0 111.233 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 171' ' ' SER . . . . . 0.472 ' O ' ' H52' ' A' ' 14' ' ' PCW . 49.9 m -73.54 -15.53 61.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.191 0.519 . . . . 10.0 111.077 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 172' ' ' LYS . . . . . 0.429 ' HE3' ' HG2' ' B' ' 168' ' ' GLU . 85.8 mttt -105.53 2.48 28.46 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.332 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 173' ' ' ASP . . . . . 0.446 ' OD1' ' H83' ' A' ' 11' ' ' PCW . 28.0 t70 56.72 -92.27 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 114.773 -1.103 . . . . 10.0 113.426 179.568 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 115.11 89.62 1.64 Allowed Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 110.913 -0.875 . . . . 10.0 110.913 -178.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 55.5 mmtt -69.01 -50.8 45.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.747 0.308 . . . . 10.0 111.249 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 45.0 tptt -169.99 131.95 1.07 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 177' ' ' LYS . . . . . 0.402 ' HE3' ' HB2' ' B' ' 177' ' ' LYS . 15.6 ptmt -129.74 154.38 47.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.949 0.404 . . . . 10.0 111.348 179.324 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -130.85 -170.04 2.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.575 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 65.7 tttt -83.06 -42.95 16.85 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.897 0.38 . . . . 10.0 110.015 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -83.41 127.52 33.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.481 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 2.5 m -81.04 130.54 35.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.422 -0.354 . . . . 10.0 110.548 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 182' ' ' LYS . . . . . 0.427 ' H ' ' HG2' ' B' ' 182' ' ' LYS . 5.3 ptmm? -92.96 153.22 18.89 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.913 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.69 -12.88 58.47 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.587 0.588 . . . . 10.0 112.587 -178.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -118.7 148.55 42.65 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 6.8 t . . . . . 0 C--O 1.236 0.385 0 CA-C-N 115.895 -0.593 . . . . 10.0 111.185 179.929 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.134 -0.386 . . . . 10.0 112.134 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' D' D ' 809' ' ' THR . . . . . 0.794 HG21 HD11 ' B' ' 36' ' ' ILE . 11.8 p -122.7 145.83 48.04 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.667 0.27 . . . . 10.0 110.562 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 51.0 t -121.88 136.19 59.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.639 -0.255 . . . . 10.0 110.359 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 811' ' ' LYS . . . . . 0.533 ' HG2' HG22 ' D' ' 821' ' ' VAL . 80.2 mttt -86.55 120.79 28.24 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.19 0.519 . . . . 10.0 110.862 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 44.7 t -105.65 123.55 60.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.493 179.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 813' ' ' TYR . . . . . 0.809 ' HB2' HG12 ' D' ' 876' ' ' ILE . 80.1 m-85 -91.15 137.26 32.5 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.038 0.447 . . . . 10.0 110.785 -179.396 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 814' ' ' LEU . . . . . 0.772 HD13 ' HD2' ' D' ' 841' ' ' ARG . 13.3 mt -105.46 153.22 39.91 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.388 -178.454 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 815' ' ' PRO . . . . . 0.531 ' HA ' ' H61' ' A' ' 2' ' ' PCW . 34.3 Cg_endo -65.01 -13.71 41.29 Favored 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 123.263 2.642 . . . . 10.0 113.428 -179.159 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -90.27 37.92 0.92 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.967 -0.383 . . . . 10.0 109.967 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 817' ' ' LYS . . . . . 0.602 ' HD3' HH12 ' B' ' 41' ' ' ARG . 30.0 mtpp 51.94 39.43 26.03 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.207 -0.906 . . . . 10.0 111.646 -179.477 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 818' ' ' GLN . . . . . 0.496 HE22 ' C ' ' B' ' 40' ' ' TYR . 84.1 mt-30 -136.63 -169.51 2.48 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 114.515 1.302 . . . . 10.0 114.515 -177.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 819' ' ' ARG . . . . . 0.46 ' NH1' ' HA ' ' D' ' 818' ' ' GLN . 0.0 OUTLIER -151.85 167.73 27.36 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.123 -0.944 . . . . 10.0 111.539 -178.363 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 14.7 t -154.03 139.12 17.36 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.949 -1.13 . . . . 10.0 107.949 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 821' ' ' VAL . . . . . 0.553 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 3.2 t -107.87 112.79 41.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 C-N-CA 120.443 -0.503 . . . . 10.0 111.202 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 5.6 t -110.22 148.91 13.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.54 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 2.6 m -88.68 108.33 19.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.115 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 61.5 t -77.7 121.18 29.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.942 0.401 . . . . 10.0 110.636 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 21.6 mtp85 -122.41 156.14 34.63 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.186 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -73.54 139.4 45.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.811 0.338 . . . . 10.0 110.766 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 110.82 -36.91 3.98 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.781 -0.724 . . . . 10.0 112.252 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 12.0 ptm -81.42 149.74 28.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.741 0.305 . . . . 10.0 110.61 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 97.9 p -100.03 176.3 5.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.952 0.406 . . . . 10.0 110.657 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 16.1 t -63.2 -36.82 77.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.193 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -62.47 -44.87 95.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.484 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -65.21 -47.52 76.58 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.048 0.452 . . . . 10.0 111.072 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 3.1 m -64.89 -43.0 94.33 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.769 -0.651 . . . . 10.0 112.416 -178.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.87 -16.63 56.8 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.31 0.856 . . . . 10.0 113.31 -178.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -59.23 -50.78 72.68 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.031 0.443 . . . . 10.0 111.01 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 5.5 mmmm -66.3 -25.92 67.08 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.387 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -80.11 -18.02 51.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.533 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 838' ' ' LEU . . . . . 0.563 HD21 HG11 ' D' ' 877' ' ' VAL . 78.2 mt -100.68 -48.66 4.43 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.236 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -58.26 -33.16 69.08 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.983 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 840' ' ' VAL . . . . . 0.755 HG13 ' HG3' ' D' ' 841' ' ' ARG . 9.6 p -56.03 -22.63 13.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 115.805 -0.634 . . . . 10.0 112.096 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 841' ' ' ARG . . . . . 0.772 ' HD2' HD13 ' D' ' 814' ' ' LEU . 0.9 OUTLIER -119.53 13.23 12.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.586 -179.381 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 75.95 19.33 78.87 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.68 -0.771 . . . . 10.0 112.526 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 58.5 mt -92.65 175.51 6.79 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.935 -0.394 . . . . 10.0 109.935 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -152.22 155.15 37.19 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.382 -0.229 . . . . 10.0 110.382 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 845' ' ' GLN . . . . . 0.47 ' HG3' HD12 ' D' ' 838' ' ' LEU . 22.4 mp0 -75.6 71.01 2.48 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.995 0.426 . . . . 10.0 111.054 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -129.4 -70.45 0.65 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.669 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -104.62 15.31 28.26 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.395 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 16.0 m -111.5 129.74 55.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.198 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 6.1 p -121.69 153.12 25.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.486 -0.324 . . . . 10.0 110.517 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 20.1 t -100.16 136.28 32.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.132 0.492 . . . . 10.0 111.523 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 851' ' ' TYR . . . . . 0.51 ' CE2' HG22 ' D' ' 860' ' ' VAL . 86.9 m-85 -112.83 135.01 54.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.687 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 852' ' ' ARG . . . . . 0.494 ' HG3' ' HB ' ' D' ' 861' ' ' THR . 61.1 mtp180 -78.97 131.4 36.32 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 178.485 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 853' ' ' LEU . . . . . 0.796 HD22 ' H73' ' A' ' 5' ' ' PCW . 0.4 OUTLIER -106.73 114.12 28.03 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.121 0.486 . . . . 10.0 111.746 -179.315 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' D' D ' 854' ' ' ILE . . . . . 0.417 ' HA ' ' H71' ' A' ' 5' ' ' PCW . 2.4 pt -150.75 141.21 16.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 179.477 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt 68.47 -53.29 0.55 Allowed 'General case' 0 N--CA 1.472 0.631 0 O-C-N 123.653 0.596 . . . . 10.0 112.567 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 167.09 -30.56 0.19 Allowed Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 111.21 -0.756 . . . . 10.0 111.21 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 857' ' ' ARG . . . . . 0.637 ' HE ' ' H19' ' A' ' 2' ' ' PCW . 11.9 mmt180 -83.68 150.64 25.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.749 0.309 . . . . 10.0 110.629 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 858' ' ' LYS . . . . . 0.722 ' HE3' HD21 ' D' ' 853' ' ' LEU . 7.6 mptt -108.71 114.67 28.67 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.26 -0.427 . . . . 10.0 109.927 179.656 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.02 138.75 42.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.574 0.226 . . . . 10.0 111.212 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 860' ' ' VAL . . . . . 0.51 HG22 ' CE2' ' D' ' 851' ' ' TYR . 1.6 t -62.99 146.9 12.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.95 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 861' ' ' THR . . . . . 0.494 ' HB ' ' HG3' ' D' ' 852' ' ' ARG . 1.8 t -134.2 160.59 37.39 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.165 179.324 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -99.35 157.62 16.28 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.502 -0.317 . . . . 10.0 110.417 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -78.79 -29.6 45.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.931 0.395 . . . . 10.0 111.127 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -89.25 50.03 1.86 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.992 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 1.3 m -123.91 153.1 41.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.823 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -67.59 141.49 56.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.83 0.348 . . . . 10.0 110.811 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 9.9 tp -91.86 -14.4 8.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.183 0.516 . . . . 10.0 111.08 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 868' ' ' ALA . . . . . 0.453 ' N ' ' HD2' ' D' ' 869' ' ' PRO . . . -55.28 -49.37 92.79 Favored Pre-proline 0 CA--C 1.541 0.62 0 N-CA-C 113.795 1.035 . . . . 10.0 113.795 -179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 869' ' ' PRO . . . . . 0.453 ' HD2' ' N ' ' D' ' 868' ' ' ALA . 50.9 Cg_endo -68.89 -13.35 36.58 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 122.143 1.895 . . . . 10.0 113.058 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 8.8 mp -85.94 81.93 8.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.257 0.551 . . . . 10.0 110.557 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -139.52 123.4 17.63 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.107 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 87.68 15.6 61.36 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.911 -0.662 . . . . 10.0 112.02 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -127.09 159.44 34.2 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 122.871 -0.194 . . . . 10.0 110.613 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 874' ' ' GLU . . . . . 0.417 ' HB2' ' HB3' ' D' ' 853' ' ' LEU . 2.2 mp0 -102.47 174.07 6.07 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.092 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 93.1 mt -136.56 131.41 33.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.71 -0.223 . . . . 10.0 110.568 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 876' ' ' ILE . . . . . 0.809 HG12 ' HB2' ' D' ' 813' ' ' TYR . 6.5 mt -117.11 129.09 74.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.585 -0.279 . . . . 10.0 110.301 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 877' ' ' VAL . . . . . 0.563 HG11 HD21 ' D' ' 838' ' ' LEU . 24.3 t -102.64 126.92 56.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -140.79 179.22 6.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.95 0.405 . . . . 10.0 111.112 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 20.1 m -81.39 148.11 5.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.55 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 15.3 mt . . . . . 0 C--O 1.254 1.335 0 CA-C-O 118.402 -0.809 . . . . 10.0 111.063 -179.984 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PCW . . . . . 0.788 ' H82' HN1A ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PCW . . . . . 0.637 ' H19' ' HE ' ' D' ' 857' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PCW . . . . . 0.769 ' H61' ' H2 ' ' A' ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PCW . . . . . 0.589 H381 H242 ' A' ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PCW . . . . . 0.796 ' H73' HD22 ' D' ' 853' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PCW . . . . . 0.528 H242 H462 ' A' ' 24' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PCW . . . . . 0.589 H242 H381 ' A' ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PCW . . . . . 0.518 ' H83' ' O2P' ' A' ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PCW . . . . . 0.584 H121 H122 ' A' ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PCW . . . . . 0.819 ' H83' HN1A ' A' ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PCW . . . . . 0.693 H351 ' H40' ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PCW . . . . . 0.666 H232 H452 ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PCW . . . . . 0.814 ' H31' H151 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PCW . . . . . 0.814 H151 ' H31' ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PCW . . . . . 0.46 H151 H182 ' A' ' 15' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PCW . . . . . 0.544 H252 ' H65' ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PCW . . . . . 0.775 ' H41' H322 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PCW . . . . . 0.61 H162 H141 ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PCW . . . . . 0.769 ' H2 ' ' H61' ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PCW . . . . . 0.772 H332 H131 ' A' ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PCW . . . . . 0.753 ' H72' ' H1 ' ' A' ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PCW . . . . . 0.558 ' H2 ' ' H51' ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PCW . . . . . 0.68 H361 H321 ' A' ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PCW . . . . . 0.528 H462 H242 ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PCW . . . . . 0.603 ' H31' ' H72' ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PCW . . . . . 0.75 H441 ' H44' ' A' ' 33' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PCW . . . . . 0.756 H371 H422 ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PCW . . . . . 0.693 ' H40' H351 ' A' ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PCW . . . . . 0.533 H382 H452 ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PCW . . . . . 0.521 ' H73' ' O11' ' A' ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PCW . . . . . 0.429 ' H83' ' O31' ' A' ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PCW . . . . . 0.751 H371 ' H32' ' A' ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' 17F . . . . . 0.75 ' H44' H441 ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' 17F . . . . . 0.611 ' H1A' ' H42' ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' 17F . . . . . 0.788 HN1A ' H82' ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' 17F . . . . . 0.819 HN1A ' H83' ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' 17F . . . . . 0.424 ' H69' H382 ' A' ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' 17F . . . . . 0.751 ' H32' H371 ' A' ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' 17F . . . . . 0.544 ' H65' H252 ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' 17F . . . . . 0.72 ' HN1' ' NZ ' ' B' ' 5' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PCW . . . . . 0.707 H322 H372 ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PCW . . . . . 0.649 H211 H342 ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PCW . . . . . 0.651 H371 ' H10' ' A' ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PCW . . . . . 0.74 ' H12' ' H83' ' A' ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PCW . . . . . 0.859 H132 H331 ' A' ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PCW . . . . . 0.701 H321 H372 ' A' ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PCW . . . . . 0.44 ' H72' ' H42' ' A' ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PCW . . . . . 0.669 H332 H152 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PCW . . . . . 0.575 H211 ' H39' ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PCW . . . . . 0.481 ' H31' ' H4A' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PCW . . . . . 0.452 H471 H281 ' A' ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PCW . . . . . 0.707 H372 H322 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PCW . . . . . 0.663 H151 H362 ' A' ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PCW . . . . . 0.669 H152 H332 ' A' ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PCW . . . . . 0.657 H221 H482 ' A' ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PCW . . . . . 0.575 ' H39' H211 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PCW . . . . . 0.511 ' O11' ' H63' ' A' ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PCW . . . . . 0.634 H162 ' H34' ' A' ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' PCW . . . . . 0.523 H411 H231 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PCW . . . . . 0.607 ' O31' ' H41' ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PCW . . . . . 0.617 H422 H172 ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PCW . . . . . 0.632 H272 H451 ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PCW . . . . . 0.568 H152 H152 ' A' ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PCW . . . . . 0.52 H461 H242 ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PCW . . . . . 0.474 H342 ' H18' ' A' ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PCW . . . . . 0.642 ' H39' ' H66' ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PCW . . . . . 0.513 ' O31' ' H73' ' A' ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PCW . . . . . 0.74 ' H83' ' H12' ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PCW . . . . . 0.623 ' H41' ' O31' ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PCW . . . . . 0.701 H372 H321 ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PCW . . . . . 0.617 H172 H422 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' 17F . . . . . 0.8 ' H57' ' H30' ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' 17F . . . . . 0.642 ' H66' ' H39' ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' 17F . . . . . 0.651 ' H10' H371 ' A' ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' 17F . . . . . 0.458 ' H40' H251 ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' 17F . . . . . 0.634 ' H34' H162 ' A' ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' 17F . . . . . 0.561 ' H52' H461 ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' 17F . . . . . 0.698 ' H49' H261 ' A' ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' 17F . . . . . 0.524 ' H52' H211 ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 201' ' ' GNP . . . . . 0.579 H5'1 ' CD2' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.558 ' HA ' HD13 ' A' ' 204' ' ' LEU . 81.9 mt . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.939 0.4 . . . . 10.0 110.656 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 202' ' ' LYS . . . . . 0.448 ' NZ ' HG21 ' C' ' 576' ' ' VAL . 17.5 mttm -57.89 -37.21 73.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.452 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 93.6 mt -66.23 -40.27 90.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.67 -0.696 . . . . 10.0 110.253 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 204' ' ' LEU . . . . . 0.558 HD13 ' HA ' ' A' ' 201' ' ' LEU . 6.5 mp -65.36 -44.92 86.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.494 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -62.48 -38.68 90.82 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.268 0.556 . . . . 10.0 110.107 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 206' ' ' ASN . . . . . 0.422 ' O ' HG23 ' A' ' 210' ' ' VAL . 25.1 t-20 -68.29 -50.61 52.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.596 -0.729 . . . . 10.0 110.176 179.251 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 36.2 m0 -60.31 -35.47 75.67 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.084 -0.507 . . . . 10.0 111.891 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -63.29 -43.96 96.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.027 0.441 . . . . 10.0 110.124 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 17.5 m -68.66 -26.16 65.18 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.483 -0.781 . . . . 10.0 110.451 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 210' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 206' ' ' ASN . 70.7 t -78.47 -44.01 26.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.052 178.69 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.35 -40.94 98.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.622 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 3.3 p -64.16 -36.44 84.06 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 121.202 0.525 . . . . 10.0 109.918 179.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 69.8 m -68.38 -41.37 80.68 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.797 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -64.61 -40.53 95.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.35 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 2.5 p -67.0 -41.76 86.16 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 178.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 216' ' ' LYS . . . . . 0.426 ' HA ' ' HD3' ' A' ' 216' ' ' LYS . 27.8 mmtp -64.98 -38.6 91.49 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.617 -0.512 . . . . 10.0 109.617 178.416 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 39.2 mt -63.58 -44.72 93.23 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 86.9 mtt180 -65.84 -32.57 74.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.759 179.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -69.28 -20.26 63.91 Favored 'General case' 0 N--CA 1.461 0.107 0 CA-C-O 121.133 0.492 . . . . 10.0 109.983 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.29 -40.02 10.65 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.768 -0.827 . . . . 10.0 108.768 177.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 221' ' ' LEU . . . . . 0.591 ' HA ' ' HB ' ' A' ' 224' ' ' VAL . 76.2 mt -63.62 -30.07 71.23 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.245 179.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -54.16 -67.27 2.25 Favored Glycine 0 C--N 1.331 0.277 0 N-CA-C 110.82 -0.912 . . . . 10.0 110.82 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -62.47 -34.56 75.59 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.053 1.835 . . . . 10.0 110.94 177.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 224' ' ' VAL . . . . . 0.591 ' HB ' ' HA ' ' A' ' 221' ' ' LEU . 2.6 t -54.81 -46.86 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-N 116.563 -0.289 . . . . 10.0 111.777 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.515 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 1.5 p -64.32 -34.19 77.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.836 0.351 . . . . 10.0 110.727 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -73.2 -48.66 33.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.164 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -62.36 -43.68 98.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.629 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -65.7 -38.57 89.61 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.777 -0.453 . . . . 10.0 109.777 179.143 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 229' ' ' TRP . . . . . 0.515 ' HB2' ' O ' ' A' ' 225' ' ' THR . 0.9 OUTLIER -68.02 -41.02 82.81 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.366 179.211 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -61.94 -37.19 83.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.596 0.712 . . . . 10.0 109.402 178.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 10.5 m-80 -68.85 -43.9 74.49 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.742 -0.836 . . . . 10.0 108.742 177.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 48.8 mt -63.0 -28.73 70.3 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 115.32 -0.855 . . . . 10.0 110.384 178.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 233' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 229' ' ' TRP . 57.7 mm-40 -63.84 -40.73 97.27 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.373 179.05 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 234' ' ' LYS . . . . . 0.447 ' HD2' ' OD1' ' C' ' 539' ' ' ASN . 42.2 mttp -71.96 -35.29 69.52 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.839 -0.8 . . . . 10.0 108.839 178.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.92 -52.33 60.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.278 -0.873 . . . . 10.0 109.213 178.372 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 17.8 p -66.58 -32.15 73.3 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.603 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -65.12 -47.56 76.71 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 108.4 -0.963 . . . . 10.0 108.4 178.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -62.03 -45.19 96.62 Favored Glycine 0 N--CA 1.441 -1.016 0 N-CA-C 109.603 -1.399 . . . . 10.0 109.603 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 239' ' ' LEU . . . . . 0.605 ' HA ' ' HB2' ' A' ' 242' ' ' GLU . 75.2 mt -63.79 -30.54 71.62 Favored 'General case' 0 C--O 1.227 -0.131 0 O-C-N 123.608 0.24 . . . . 10.0 111.153 179.307 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 54.2 mtm-85 -65.35 -50.03 67.14 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.648 -0.871 . . . . 10.0 108.648 178.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -64.73 -40.62 95.63 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.53 -0.915 . . . . 10.0 108.53 178.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 242' ' ' GLU . . . . . 0.605 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 41.9 mm-40 -58.94 -51.9 68.05 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.202 -0.908 . . . . 10.0 110.715 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 62.3 mtm -63.84 -28.0 69.56 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.795 0.331 . . . . 10.0 110.818 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 56.6 m -70.78 -13.46 62.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.296 178.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 41.8 mttm -109.43 -53.31 2.67 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 108.64 -0.874 . . . . 10.0 108.64 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 246' ' ' ASP . . . . . 0.472 ' O ' HG23 ' A' ' 250' ' ' VAL . 7.3 t70 -52.14 -64.5 0.79 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.078 -0.965 . . . . 10.0 111.395 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 95.8 mt -57.98 -39.61 78.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.977 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -65.72 -44.45 86.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.682 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -64.85 -40.53 95.31 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.518 -0.549 . . . . 10.0 109.518 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 250' ' ' VAL . . . . . 0.692 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 54.2 t -62.08 -51.36 73.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.451 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.016 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.457 ' O ' HG12 ' A' ' 254' ' ' VAL . 84.0 mttt -66.16 -46.6 76.86 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.593 0.59 . . . . 10.0 112.593 -179.393 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.12 -43.87 97.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.187 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -80.32 -24.78 39.7 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.302 0.482 . . . . 10.0 112.302 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.692 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.4 OUTLIER -62.64 -27.52 43.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.924 -0.31 . . . . 10.0 110.728 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 255' ' ' GLN . . . . . 0.489 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 63.8 mt-30 -61.31 -62.0 6.8 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-N 116.526 -0.306 . . . . 10.0 110.591 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 256' ' ' PRO . . . . . 0.49 ' O ' ' HB2' ' A' ' 260' ' ' ASP . 32.4 Cg_endo -67.56 -28.51 38.04 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 121.73 1.62 . . . . 10.0 111.569 178.243 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -66.1 -50.37 64.29 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 109.524 -0.547 . . . . 10.0 109.524 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 258' ' ' LEU . . . . . 0.414 ' HG ' HG22 ' A' ' 254' ' ' VAL . 41.7 mt -68.92 -37.75 79.13 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.009 -0.542 . . . . 10.0 110.058 179.043 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -61.48 -44.55 96.88 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.497 -0.557 . . . . 10.0 109.497 178.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 260' ' ' ASP . . . . . 0.49 ' HB2' ' O ' ' A' ' 256' ' ' PRO . 9.4 t0 -58.57 -49.08 78.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.506 179.12 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -65.39 -46.39 80.26 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 115.466 -0.788 . . . . 10.0 110.934 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -58.93 -52.47 65.61 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 111.888 0.329 . . . . 10.0 111.888 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -57.05 -46.39 82.47 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 120.782 0.325 . . . . 10.0 111.289 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 0.1 OUTLIER -70.08 -38.28 75.68 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.639 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 15.3 t90 -66.43 -36.58 83.17 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 179.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 266' ' ' GLN . . . . . 0.444 ' O ' ' HB2' ' A' ' 270' ' ' GLU . 67.5 mt-30 -63.23 -42.21 99.21 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.465 -0.939 . . . . 10.0 108.465 178.11 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -66.56 -39.78 88.69 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.855 -0.795 . . . . 10.0 108.855 178.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 268' ' ' GLU . . . . . 0.45 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 22.9 mt-10 -60.21 -49.65 76.77 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.818 178.292 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 79.4 mmm -65.29 -44.67 87.22 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.703 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 270' ' ' GLU . . . . . 0.466 ' HG3' HH12 ' A' ' 273' ' ' ARG . 0.4 OUTLIER -60.91 -49.74 76.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.917 179.6 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 271' ' ' LEU . . . . . 0.467 ' O ' ' HG2' ' A' ' 275' ' ' LYS . 59.4 mt -64.2 -44.03 93.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.298 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 272' ' ' TYR . . . . . 0.49 ' O ' HG23 ' A' ' 276' ' ' VAL . 26.6 t80 -60.67 -47.35 86.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.222 -0.444 . . . . 10.0 109.979 179.374 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 273' ' ' ARG . . . . . 0.466 HH12 ' HG3' ' A' ' 270' ' ' GLU . 32.1 ttm105 -65.14 -37.34 87.11 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.125 0.488 . . . . 10.0 110.083 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 274' ' ' GLN . . . . . 0.418 ' HB2' ' O ' ' A' ' 270' ' ' GLU . 0.0 OUTLIER -63.08 -35.81 81.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.403 -0.817 . . . . 10.0 109.559 178.885 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.567 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 25.9 mmtp -80.84 -34.57 33.74 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.138 178.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 276' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 272' ' ' TYR . 12.0 t -51.78 -44.92 37.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 N-CA-C 112.112 0.412 . . . . 10.0 112.112 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 277' ' ' GLU . . . . . 0.44 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 54.0 mt-10 -50.6 -64.05 1.52 Allowed Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 112.613 0.597 . . . . 10.0 112.613 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 278' ' ' PRO . . . . . 0.519 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 50.2 Cg_endo -70.89 -35.93 8.57 Favored 'Trans proline' 0 C--N 1.355 0.91 0 C-N-CA 121.846 1.698 . . . . 10.0 113.031 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.641 HD22 ' HG2' ' C' ' 495' ' ' LYS . 28.5 mt -63.71 -39.78 95.15 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 121.031 -0.268 . . . . 10.0 111.0 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -73.86 -29.72 62.27 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.952 -0.759 . . . . 10.0 108.952 178.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 281' ' ' ALA . . . . . 0.422 ' O ' ' HG3' ' A' ' 285' ' ' GLU . . . -64.45 -44.52 90.85 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.89 -0.782 . . . . 10.0 108.89 178.418 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 282' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 65.7 mt-10 -58.9 -42.27 89.16 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 108.711 -0.848 . . . . 10.0 108.711 178.073 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 95.0 mt -63.36 -46.16 87.81 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.244 -0.889 . . . . 10.0 110.431 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -62.27 -54.1 45.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.897 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 285' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 281' ' ' ALA . 21.7 mt-10 -60.82 -44.74 96.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.08 0.467 . . . . 10.0 110.504 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.02 -44.07 97.91 Favored Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.689 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.83 -39.39 93.49 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 109.919 -0.4 . . . . 10.0 109.919 179.259 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 288' ' ' ARG . . . . . 0.57 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 96.8 mtt180 -60.07 -42.57 94.83 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.476 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 14.1 tm0? -67.07 -49.69 64.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.176 -0.466 . . . . 10.0 109.999 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 33.6 mttp -59.42 -47.1 86.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.501 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 77.8 mt -66.31 -35.42 80.34 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.455 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 292' ' ' HIS . . . . . 0.57 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 20.5 t60 -60.41 -50.17 74.64 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 293' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 297' ' ' LYS . 0.4 OUTLIER -64.12 -36.47 84.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.854 179.497 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 83.0 mt -71.51 -38.64 71.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.995 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -66.83 -41.93 86.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.473 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -77.72 2.37 17.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.268 0.556 . . . . 10.0 110.24 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 297' ' ' LYS . . . . . 1.034 ' HE2' ' HG ' ' C' ' 477' ' ' LEU . 29.3 tttp -105.25 -37.45 6.88 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.859 -0.793 . . . . 10.0 108.859 178.644 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 13.7 mt -68.45 -24.57 64.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.359 -0.837 . . . . 10.0 111.053 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -62.59 1.71 Allowed Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.495 -0.32 . . . . 10.0 111.851 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -68.06 -51.55 0.61 Allowed 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 122.055 1.837 . . . . 10.0 112.445 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.812 HD13 ' HG2' ' C' ' 473' ' ' LYS . 60.2 mt -66.98 -26.65 66.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.704 0.287 . . . . 10.0 111.171 -179.614 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -75.81 -40.11 31.98 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 109.35 -1.5 . . . . 10.0 109.35 177.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -64.65 -43.86 92.3 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.767 -0.827 . . . . 10.0 108.767 178.12 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -62.62 -40.15 96.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.441 -0.799 . . . . 10.0 108.909 178.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 14.7 tpt -61.75 -41.82 98.17 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 115.693 -0.685 . . . . 10.0 109.368 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 -64.78 -42.88 94.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.473 . . . . 10.0 109.963 178.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -63.44 -46.84 84.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.251 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 308' ' ' ARG . . . . . 0.672 ' HG3' HD21 ' C' ' 469' ' ' LEU . 16.5 mmt180 -68.19 -33.67 74.87 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.406 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 309' ' ' ALA . . . . . 0.401 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -65.5 -39.34 91.77 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 178.555 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 310' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' A' ' 314' ' ' ASP . 44.8 mtt85 -60.22 -47.22 86.91 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.031 -0.729 . . . . 10.0 109.031 178.213 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -64.68 -43.09 94.68 Favored 'General case' 0 C--O 1.226 -0.184 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 178.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 312' ' ' HIS . . . . . 0.709 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 0.4 OUTLIER -53.45 -54.42 37.3 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.424 -0.807 . . . . 10.0 110.331 179.052 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 39.9 t -73.84 -38.68 50.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.396 -0.82 . . . . 10.0 112.053 -178.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 314' ' ' ASP . . . . . 0.531 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 1.3 m-20 -63.51 -40.95 98.41 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.889 0.376 . . . . 10.0 110.632 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -66.76 -28.99 68.85 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 177.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 19.2 mt -74.28 -40.65 62.17 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.191 -0.913 . . . . 10.0 109.131 178.09 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -62.19 -47.1 85.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.975 0.416 . . . . 10.0 110.345 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 1.4 p -66.9 -15.24 63.52 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.618 -0.719 . . . . 10.0 111.664 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -103.27 -38.19 7.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.087 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 320' ' ' LEU . . . . . 0.44 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 39.9 mt -64.82 -34.72 79.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.387 -0.369 . . . . 10.0 111.19 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.94 -60.82 8.37 Favored Pre-proline 0 CA--C 1.535 0.395 0 O-C-N 123.213 0.32 . . . . 10.0 110.541 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -65.16 -30.06 55.51 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 121.524 1.482 . . . . 10.0 111.08 177.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 323' ' ' TYR . . . . . 0.44 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 4.2 m-30 -61.8 -56.42 19.67 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 110.249 -0.278 . . . . 10.0 110.249 178.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 324' ' ' SER . . . . . 0.405 ' HA ' ' HB2' ' A' ' 327' ' ' LEU . 17.0 p -66.72 -36.55 82.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.924 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -63.07 -48.61 77.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.3 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -71.57 -22.53 61.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.889 0.376 . . . . 10.0 110.009 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 327' ' ' LEU . . . . . 0.506 HD23 ' HG3' ' A' ' 330' ' ' ARG . 14.2 mt -69.98 -28.09 65.24 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 177.571 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -65.0 -39.73 93.9 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 107.323 -1.362 . . . . 10.0 107.323 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -64.93 -39.56 93.69 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.007 -0.997 . . . . 10.0 108.729 177.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 330' ' ' ARG . . . . . 0.69 ' O ' ' HG2' ' A' ' 334' ' ' ARG . 10.5 mmt180 -62.19 -53.4 55.84 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 108.658 -0.867 . . . . 10.0 108.658 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 331' ' ' LEU . . . . . 0.421 ' O ' ' HB2' ' A' ' 335' ' ' LEU . 95.6 mt -54.59 -44.01 72.65 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.454 -0.793 . . . . 10.0 110.366 179.351 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 332' ' ' ALA . . . . . 0.409 ' O ' ' HG3' ' A' ' 336' ' ' GLU . . . -62.97 -48.55 78.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.412 -0.358 . . . . 10.0 110.522 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.18 -45.64 90.5 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.592 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 334' ' ' ARG . . . . . 0.69 ' HG2' ' O ' ' A' ' 330' ' ' ARG . 4.0 mmt85 -66.68 -46.2 76.41 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.942 179.499 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 335' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 331' ' ' LEU . 5.2 mt -60.43 -41.37 93.85 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.797 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 336' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 332' ' ' ALA . 89.0 mt-10 -58.72 -44.53 90.42 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.901 -0.407 . . . . 10.0 109.901 178.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -68.77 -42.53 77.31 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.662 -0.496 . . . . 10.0 109.662 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 338' ' ' LEU . . . . . 0.491 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 71.6 mt -65.49 -24.38 67.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.398 179.25 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -89.5 -38.28 14.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.883 0.373 . . . . 10.0 110.841 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -72.94 -53.78 10.38 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.128 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -71.06 -32.52 69.23 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.509 -0.922 . . . . 10.0 108.509 178.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 342' ' ' GLY . . . . . 0.491 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -63.46 -46.37 92.71 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.344 -0.844 . . . . 10.0 111.121 179.13 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.72 -41.2 98.92 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 109.975 -1.25 . . . . 10.0 109.975 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.62 -44.18 91.36 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 345' ' ' ARG . . . . . 0.496 ' HD3' ' OE2' ' C' ' 433' ' ' GLU . 22.5 mtm180 -58.57 -45.07 89.81 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.397 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 87.4 mt -63.09 -51.25 67.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.816 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.24 -44.64 95.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.155 0.502 . . . . 10.0 110.373 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 348' ' ' GLU . . . . . 0.626 ' HB3' ' HZ1' ' A' ' 352' ' ' LYS . 27.8 mt-10 -65.5 -43.34 90.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.88 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -62.48 -36.22 81.79 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -64.86 -46.94 79.72 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.548 -0.538 . . . . 10.0 109.548 178.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -65.1 -41.46 94.95 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.246 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 352' ' ' LYS . . . . . 0.717 ' HZ2' ' HB3' ' C' ' 425' ' ' GLU . 16.1 mtmm -71.82 -16.91 62.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.481 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -86.67 -42.43 13.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.55 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.63 -40.29 96.52 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.948 -0.39 . . . . 10.0 109.948 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 355' ' ' GLU . . . . . 0.436 ' HA ' ' OG ' ' A' ' 358' ' ' SER . 5.4 mm-40 -71.14 -27.79 63.81 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.419 0.628 . . . . 10.0 109.461 178.348 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 356' ' ' HIS . . . . . 0.515 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 0.1 OUTLIER -73.75 -33.75 64.44 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.467 -0.938 . . . . 10.0 108.467 178.309 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 82.4 mt -78.68 -38.23 39.8 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.136 -0.938 . . . . 10.0 111.747 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 358' ' ' SER . . . . . 0.436 ' OG ' ' HA ' ' A' ' 355' ' ' GLU . 1.9 p -63.11 -45.89 89.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.923 0.392 . . . . 10.0 109.967 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 359' ' ' THR . . . . . 0.592 ' HA ' ' OE1' ' A' ' 362' ' ' GLU . 17.6 p -71.96 -15.98 62.08 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.473 0.654 . . . . 10.0 109.256 178.661 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 360' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 356' ' ' HIS . 18.6 tp -84.32 -28.87 26.78 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.396 -0.82 . . . . 10.0 109.118 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 3.1 m -64.71 -34.27 77.92 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.107 -1.071 . . . . 10.0 108.107 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 362' ' ' GLU . . . . . 0.592 ' OE1' ' HA ' ' A' ' 359' ' ' THR . 32.5 mt-10 -73.55 -0.08 14.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.703 -1.135 . . . . 10.0 110.538 178.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.658 ' HG2' HG22 ' C' ' 411' ' ' THR . 55.4 mttp -115.38 -37.06 4.13 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.548 -0.908 . . . . 10.0 108.548 177.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -75.29 -14.78 60.53 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.591 -0.731 . . . . 10.0 111.72 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.93 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 94.0 mttt -110.64 -71.19 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 120.73 -0.388 . . . . 10.0 112.028 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.93 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 40.7 Cg_exo -59.4 -52.22 5.11 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.06 1.84 . . . . 10.0 112.322 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 367' ' ' ALA . . . . . 0.587 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -62.82 -40.24 96.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.561 0.22 . . . . 10.0 111.468 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.75 -43.21 94.06 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.975 -0.38 . . . . 10.0 109.975 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 369' ' ' GLU . . . . . 0.599 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 16.0 mt-10 -65.34 -34.82 79.22 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 109.744 -0.465 . . . . 10.0 109.744 178.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -44.7 91.96 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 178.278 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 82.5 mt -62.29 -40.71 97.16 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.333 178.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.574 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 65.0 mtt180 -62.91 -43.68 98.14 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.249 -0.648 . . . . 10.0 109.249 178.621 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.599 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.3 mt-30 -62.33 -26.61 68.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.257 -0.883 . . . . 20.0 112.564 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -89.23 -38.63 6.67 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 109.684 -1.366 . . . . 10.0 109.684 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 31.9 mt -58.1 -35.88 72.08 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.706 0.262 . . . . 10.0 111.706 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 376' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 35.3 mt -55.96 -65.38 1.56 Allowed Pre-proline 0 CA--C 1.538 0.507 0 N-CA-C 111.612 0.227 . . . . 10.0 111.612 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.545 ' HD3' ' HB2' ' A' ' 376' ' ' LEU . 37.9 Cg_endo -66.9 -30.53 39.86 Favored 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 122.069 1.846 . . . . 10.0 111.783 179.18 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 4.3 t -64.89 -48.91 82.35 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 CA-C-O 120.514 0.197 . . . . 10.0 110.567 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 41.6 mt -64.22 -35.61 81.39 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 380' ' ' GLU . . . . . 0.442 ' HG3' ' O ' ' A' ' 376' ' ' LEU . 19.4 mt-10 -66.25 -53.7 33.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.799 178.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 5.5 p -60.54 -38.05 83.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.861 0.362 . . . . 10.0 110.464 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -63.12 -49.32 74.89 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.923 -0.58 . . . . 10.0 109.835 178.369 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -62.89 -42.22 99.69 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 116.483 -0.326 . . . . 10.0 110.863 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 48.0 t -58.43 -47.3 88.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 12.7 m -69.42 -38.96 78.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.148 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 386' ' ' PHE . . . . . 0.469 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 3.3 m-85 -67.36 -49.46 63.89 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.688 0.255 . . . . 10.0 111.688 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 92.1 mt -59.82 -41.34 91.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.49 -0.323 . . . . 10.0 111.233 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 388' ' ' SER . . . . . 0.429 ' HA ' ' OE1' ' A' ' 391' ' ' GLU . 22.6 p -72.23 -31.45 65.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.112 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -73.39 -33.89 65.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.904 0.383 . . . . 10.0 110.087 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 390' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 83.4 mt -60.2 -28.35 67.9 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.331 0.586 . . . . 10.0 109.913 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 391' ' ' GLU . . . . . 0.429 ' OE1' ' HA ' ' A' ' 388' ' ' SER . 39.0 mt-10 -65.78 -40.19 91.73 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.365 -0.834 . . . . 10.0 109.688 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 392' ' ' GLU . . . . . 0.548 ' HA ' ' HE3' ' A' ' 395' ' ' LYS . 0.7 OUTLIER -62.37 -47.4 84.34 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 120.86 0.362 . . . . 10.0 110.43 179.413 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -58.1 -46.32 85.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.465 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 10.5 m -65.21 -41.85 94.08 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.224 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 395' ' ' LYS . . . . . 0.548 ' HE3' ' HA ' ' A' ' 392' ' ' GLU . 50.5 mtmt -64.9 -41.34 95.68 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.631 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 396' ' ' LYS . . . . . 0.519 ' HE3' ' HB2' ' C' ' 587' ' ' ALA . 0.1 OUTLIER -82.87 -12.49 57.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.633 0.605 . . . . 10.0 112.633 -178.606 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 397' ' ' LEU . . . . . 0.85 ' O ' ' HB2' ' A' ' 398' ' ' ASN . 8.5 mt -76.69 -19.57 57.57 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.259 0.552 . . . . 10.0 110.415 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 398' ' ' ASN . . . . . 0.85 ' HB2' ' O ' ' A' ' 397' ' ' LEU . 98.9 m-20 . . . . . 0 C--N 1.326 -0.417 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.281 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 46.8 mt . . . . . 0 C--O 1.235 0.335 0 CA-C-O 121.18 0.514 . . . . 10.0 110.385 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -69.88 -39.55 76.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.503 -0.771 . . . . 10.0 110.079 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 82.1 mt -68.08 -37.02 80.75 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.24 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 81.5 mt -66.04 -42.81 89.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.699 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -46.46 85.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.453 0.644 . . . . 10.0 109.857 179.677 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 404' ' ' ASN . . . . . 0.447 ' O ' HG23 ' C' ' 408' ' ' VAL . 11.0 t-20 -62.92 -48.19 80.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.969 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 16.4 t90 -58.08 -37.74 75.05 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.104 -0.498 . . . . 10.0 112.173 -179.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -60.47 -41.39 94.09 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.071 0.462 . . . . 10.0 110.378 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 6.1 m -73.69 -19.93 60.68 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.595 -0.729 . . . . 10.0 110.623 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 408' ' ' VAL . . . . . 0.447 HG23 ' O ' ' C' ' 404' ' ' ASN . 54.6 t -74.19 -34.12 36.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.262 -0.644 . . . . 10.0 109.262 178.171 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.83 -39.37 83.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.188 178.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -44.46 84.3 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.176 -0.465 . . . . 10.0 109.949 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 411' ' ' THR . . . . . 0.658 HG22 ' HG2' ' A' ' 363' ' ' LYS . 2.2 p -66.49 -32.45 73.82 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.168 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.37 -39.32 92.13 Favored 'General case' 0 CA--C 1.521 -0.172 0 N-CA-C 108.494 -0.928 . . . . 10.0 108.494 177.687 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 413' ' ' SER . . . . . 0.437 ' C ' ' H ' ' C' ' 415' ' ' LEU . 73.5 m -64.9 -38.13 89.93 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 177.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -72.97 10.42 0.91 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.801 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 415' ' ' LEU . . . . . 0.437 ' H ' ' C ' ' C' ' 413' ' ' SER . 69.3 mt -124.78 -48.74 1.77 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.335 -0.987 . . . . 10.0 108.335 178.009 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -65.9 -49.69 67.14 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.231 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -69.14 -22.7 63.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.272 0.558 . . . . 10.0 109.883 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.93 -36.77 30.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.61 -0.723 . . . . 10.0 109.654 179.386 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 22.9 mt -60.69 -29.61 69.42 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.96 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -51.48 -73.85 0.34 Allowed Glycine 0 CA--C 1.519 0.332 0 C-N-CA 121.272 -0.49 . . . . 10.0 112.145 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.91 -36.06 98.85 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.629 2.219 . . . . 10.0 111.738 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 38.8 t -60.61 -49.8 82.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.795 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 23.9 p -70.89 -36.28 72.68 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.405 0.145 . . . . 10.0 110.728 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -55.94 -50.14 71.56 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.785 -0.821 . . . . 10.0 108.785 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 425' ' ' GLU . . . . . 0.717 ' HB3' ' HZ2' ' A' ' 352' ' ' LYS . 63.0 mt-10 -69.0 -40.76 78.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.18 -0.918 . . . . 10.0 109.93 178.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -58.54 -44.09 89.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.096 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 427' ' ' TRP . . . . . 0.483 ' O ' ' HG3' ' C' ' 431' ' ' GLU . 62.9 m95 -64.81 -38.93 92.63 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 178.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -63.53 -41.49 98.47 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.756 -0.831 . . . . 10.0 108.756 178.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 429' ' ' ASN . . . . . 0.675 ' HA ' ' HD2' ' C' ' 432' ' ' LYS . 23.6 t-20 -64.82 -43.66 92.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.337 -0.847 . . . . 10.0 109.463 178.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 33.4 mt -60.22 -35.06 74.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.052 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 431' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' C' ' 427' ' ' TRP . 51.2 mt-10 -65.94 -45.3 82.34 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 178.314 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 432' ' ' LYS . . . . . 0.675 ' HD2' ' HA ' ' C' ' 429' ' ' ASN . 32.0 mttt -57.35 -46.33 83.44 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 108.57 -0.9 . . . . 10.0 108.57 178.031 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 433' ' ' GLU . . . . . 0.496 ' OE2' ' HD3' ' A' ' 345' ' ' ARG . 5.9 mm-40 -60.11 -49.06 79.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.025 -0.988 . . . . 10.0 110.652 179.046 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 27.0 m -61.36 -44.75 96.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.438 -0.346 . . . . 10.0 111.002 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -64.79 -40.8 95.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.909 0.385 . . . . 10.0 110.215 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.94 -47.36 83.56 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.045 -1.222 . . . . 10.0 110.045 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 71.0 mt -60.71 -33.0 72.23 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -64.65 -48.79 73.53 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -62.99 -37.68 88.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.183 0.516 . . . . 10.0 110.08 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 440' ' ' GLU . . . . . 0.648 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 48.3 mt-10 -67.66 -55.75 12.04 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.685 -0.688 . . . . 10.0 110.38 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 71.6 mtm -68.13 -28.37 67.26 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 114.555 1.317 . . . . 10.0 114.555 -177.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.8 p -62.48 -43.6 98.41 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.013 -0.675 . . . . 10.0 109.642 179.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -78.22 -42.28 31.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.165 178.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 444' ' ' ASP . . . . . 0.466 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 2.9 t70 -57.62 -58.1 9.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.206 -0.906 . . . . 10.0 111.448 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 445' ' ' LEU . . . . . 0.433 ' O ' ' HG3' ' C' ' 449' ' ' LYS . 93.0 mt -64.39 -41.58 96.59 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.077 0.399 . . . . 10.0 112.077 -178.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -62.57 -48.17 80.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.027 0.441 . . . . 10.0 110.021 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -68.61 -25.17 64.73 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 179.074 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 448' ' ' VAL . . . . . 0.432 ' HB ' ' HA ' ' C' ' 445' ' ' LEU . 1.1 t -64.75 -42.84 96.08 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 N-CA-C 108.842 -0.799 . . . . 10.0 108.842 177.605 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 449' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' C' ' 445' ' ' LEU . 88.4 mttt -65.91 -34.53 78.33 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.225 -0.657 . . . . 10.0 109.225 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -81.0 0.21 36.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.4 -0.818 . . . . 10.0 111.265 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 451' ' ' LYS . . . . . 0.487 ' C ' ' HD2' ' C' ' 454' ' ' PRO . 56.7 mttm -117.47 -37.66 3.46 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.625 179.019 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 25.2 t -62.76 -41.41 92.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.28 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 453' ' ' GLN . . . . . 0.6 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 41.0 mt-30 -57.93 -58.52 18.01 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 116.665 -0.243 . . . . 10.0 110.701 178.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 454' ' ' PRO . . . . . 0.6 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 52.9 Cg_exo -60.32 -36.44 87.5 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 122.199 1.932 . . . . 10.0 110.931 178.092 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -60.9 -49.38 77.71 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.876 179.201 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 53.8 mt -70.54 -37.78 74.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.985 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -63.66 -47.61 80.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.096 0.474 . . . . 10.0 109.97 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 458' ' ' ASP . . . . . 0.75 ' HA ' ' HE3' ' C' ' 461' ' ' LYS . 28.5 t0 -68.73 -32.91 73.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.688 179.102 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -66.13 -42.75 88.69 Favored 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 108.446 -0.946 . . . . 10.0 108.446 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -62.74 -46.17 89.3 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.039 -0.726 . . . . 10.0 109.039 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 461' ' ' LYS . . . . . 0.75 ' HE3' ' HA ' ' C' ' 458' ' ' ASP . 12.9 mtmt -57.13 -42.42 80.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.604 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 13.7 mtmm -72.57 -40.55 66.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.358 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -22.3 65.01 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.882 179.401 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 464' ' ' GLN . . . . . 0.507 ' OE1' ' HA ' ' C' ' 461' ' ' LYS . 64.3 mt-30 -69.92 -44.2 70.12 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 107.949 -1.13 . . . . 10.0 107.949 177.18 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 1.262 ' O ' ' CG ' ' C' ' 469' ' ' LEU . 26.0 mt-10 -68.72 -32.07 71.59 Favored 'General case' 0 C--O 1.226 -0.165 0 N-CA-C 108.895 -0.78 . . . . 10.0 108.895 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -69.78 -55.27 10.31 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.564 -0.743 . . . . 10.0 109.989 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 45.1 tpp -61.26 -56.95 14.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.628 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -63.63 -40.69 97.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.642 0.258 . . . . 10.0 110.478 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 1.262 ' CG ' ' O ' ' C' ' 465' ' ' GLU . 96.4 mt -59.04 -47.4 85.35 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 115.836 -0.62 . . . . 20.0 110.438 179.087 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -68.02 -34.58 76.76 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.493 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -65.89 -43.61 87.78 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.21 -0.663 . . . . 10.0 109.21 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -69.24 -8.77 48.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.076 179.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 473' ' ' LYS . . . . . 0.812 ' HG2' HD13 ' A' ' 301' ' ' LEU . 92.5 mttt -101.99 -51.76 3.33 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.048 178.277 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 69.3 t -67.16 -39.87 84.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.599 -0.728 . . . . 10.0 112.876 -178.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -54.4 -58.88 11.92 Favored Pre-proline 0 N--CA 1.464 0.264 0 C-N-CA 120.916 -0.314 . . . . 10.0 111.693 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -68.64 -28.01 31.67 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 121.378 1.385 . . . . 10.0 110.555 178.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 477' ' ' LEU . . . . . 1.034 ' HG ' ' HE2' ' A' ' 297' ' ' LYS . 0.6 OUTLIER -65.76 -40.83 92.46 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.631 -0.507 . . . . 10.0 109.631 179.372 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 478' ' ' ARG . . . . . 0.644 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 17.7 ttm180 -62.95 -34.67 77.99 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.02 -0.733 . . . . 10.0 109.02 179.219 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -70.12 -49.55 49.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.004 -0.543 . . . . 10.0 109.948 178.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 480' ' ' GLU . . . . . 0.536 ' CD ' ' HZ3' ' A' ' 297' ' ' LYS . 23.8 mt-10 -62.83 -46.49 87.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.235 179.106 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 31.9 mt -66.08 -32.68 74.28 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.951 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 482' ' ' GLN . . . . . 0.644 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 4.2 tt0 -68.59 -41.46 79.59 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -70.43 -38.36 74.55 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 178.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -67.12 -32.89 81.63 Favored Glycine 0 N--CA 1.442 -0.909 0 N-CA-C 109.757 -1.337 . . . . 10.0 109.757 177.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 485' ' ' ALA . . . . . 0.59 ' HA ' ' HG2' ' C' ' 488' ' ' LYS . . . -73.09 -43.47 61.74 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 178.315 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 64.5 mtt180 -63.28 -38.65 91.99 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.847 -0.797 . . . . 10.0 108.847 178.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 -66.05 -50.41 64.24 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.49 177.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 488' ' ' LYS . . . . . 0.59 ' HG2' ' HA ' ' C' ' 485' ' ' ALA . 52.8 pttt -62.83 -32.7 73.96 Favored 'General case' 0 C--O 1.225 -0.193 0 O-C-N 123.292 0.37 . . . . 10.0 110.252 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 30.9 mt -69.56 -38.39 77.42 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -68.12 -41.97 80.91 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.204 -1.036 . . . . 10.0 108.204 177.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 491' ' ' GLU . . . . . 0.448 ' O ' ' HG3' ' C' ' 495' ' ' LYS . 36.6 mt-10 -61.27 -47.17 87.24 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.134 -0.939 . . . . 10.0 108.63 178.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 43.1 mt -65.79 -40.56 92.07 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.918 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -60.4 -45.5 93.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.013 0.435 . . . . 10.0 110.467 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -80.25 10.9 3.94 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.882 -179.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.641 ' HG2' HD22 ' A' ' 279' ' ' LEU . 12.5 mttm -120.13 -46.06 2.43 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.525 -0.761 . . . . 10.0 108.979 177.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 94.1 mt -69.67 -34.82 74.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.701 -0.681 . . . . 10.0 111.719 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 13.3 m -65.3 -58.25 12.75 Favored Pre-proline 0 CA--C 1.537 0.467 0 C-N-CA 120.682 -0.407 . . . . 10.0 111.297 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.56 -47.44 11.49 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 121.727 1.618 . . . . 10.0 111.588 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 499' ' ' LEU . . . . . 0.404 ' HA ' ' HB2' ' C' ' 502' ' ' GLU . 73.3 mt -66.63 -31.51 72.23 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-O 120.679 0.276 . . . . 10.0 111.213 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.29 -48.77 61.68 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 110.038 -1.225 . . . . 10.0 110.038 178.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -65.92 -39.88 90.94 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.244 -0.65 . . . . 10.0 109.244 178.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 502' ' ' GLU . . . . . 0.416 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 10.8 mt-10 -60.31 -52.79 63.77 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.602 178.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 503' ' ' MET . . . . . 0.658 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 42.8 mmm -57.95 -36.45 72.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.679 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 74.4 mtt180 -66.46 -43.48 85.39 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.898 -0.408 . . . . 10.0 109.898 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 505' ' ' ASP . . . . . 0.589 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 0.9 OUTLIER -66.73 -41.16 88.31 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 178.687 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.658 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 41.1 mtt180 -62.01 -42.98 99.74 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 178.281 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -63.79 -36.45 83.92 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.409 -0.814 . . . . 10.0 110.114 178.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 508' ' ' ARG . . . . . 0.589 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 67.5 mtt180 -62.58 -42.59 99.65 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.878 -0.786 . . . . 10.0 108.878 178.135 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -86.5 19.52 2.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.962 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -131.15 -53.43 1.04 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.996 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 86.5 t -68.12 -47.61 77.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.164 -0.471 . . . . 10.0 109.999 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.44 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 0.5 OUTLIER -66.23 -33.44 75.76 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 108.874 -0.788 . . . . 10.0 108.874 178.895 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -64.86 -50.07 68.06 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 107.671 -1.233 . . . . 10.0 107.671 177.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 21.2 mt -59.26 -35.52 73.85 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.736 178.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 515' ' ' ARG . . . . . 0.44 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 89.3 mtt180 -59.34 -53.75 54.6 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.779 -0.823 . . . . 10.0 108.779 177.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.59 14.56 0.99 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.608 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 517' ' ' HIS . . . . . 0.478 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 4.6 m-70 -126.43 -38.03 2.14 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 122.136 -0.353 . . . . 10.0 110.363 179.283 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 84.6 mt -87.69 -33.97 18.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.56 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -58.28 -57.88 22.99 Favored Pre-proline 0 C--N 1.33 -0.272 0 C-N-CA 121.174 -0.211 . . . . 10.0 111.499 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.61 -36.52 63.75 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 121.444 1.429 . . . . 10.0 110.613 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 521' ' ' TYR . . . . . 0.478 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 22.1 t80 -61.46 -46.46 89.95 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.895 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 522' ' ' SER . . . . . 0.424 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 6.3 p -67.6 -31.1 70.9 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.969 -0.382 . . . . 10.0 109.969 179.225 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -67.76 -41.92 82.58 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.884 -0.784 . . . . 10.0 108.884 178.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 524' ' ' GLU . . . . . 0.431 ' O ' ' HG3' ' C' ' 528' ' ' ARG . 4.3 mt-10 -67.12 -37.8 84.49 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 177.256 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 525' ' ' LEU . . . . . 0.472 HD23 ' HD2' ' C' ' 528' ' ' ARG . 21.3 mt -62.58 -32.26 73.22 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.401 -0.818 . . . . 10.0 109.809 178.11 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 526' ' ' ARG . . . . . 0.424 ' HG3' ' O ' ' C' ' 522' ' ' SER . 71.4 mtt180 -65.74 -37.99 87.89 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.386 -0.598 . . . . 10.0 109.386 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -68.64 -43.59 75.98 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.593 -0.891 . . . . 10.0 108.593 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 528' ' ' ARG . . . . . 0.472 ' HD2' HD23 ' C' ' 525' ' ' LEU . 80.8 mtt180 -61.54 -43.95 97.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.808 -1.087 . . . . 10.0 109.466 178.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 30.2 mt -65.16 -35.99 82.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.719 -0.673 . . . . 10.0 109.793 178.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.86 -46.65 86.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.095 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.66 -44.65 77.35 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.53 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 10.2 mtt180 -62.14 -46.0 90.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.672 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 47.9 mt -67.52 -32.69 73.66 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.505 -0.316 . . . . 10.0 110.537 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -64.68 -44.62 89.77 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.224 -0.658 . . . . 10.0 109.224 178.369 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.59 -41.53 96.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.428 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 83.9 mt -65.49 -28.97 69.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.67 178.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -77.57 -43.89 30.29 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.86 -0.422 . . . . 10.0 109.86 178.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -62.33 -48.58 79.19 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.714 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 539' ' ' ASN . . . . . 0.447 ' OD1' ' HD2' ' A' ' 234' ' ' LYS . 95.7 m-20 -71.21 -35.3 71.48 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 115.479 -0.782 . . . . 10.0 109.458 178.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 540' ' ' GLY . . . . . 0.41 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -60.27 -45.98 95.11 Favored Glycine 0 N--CA 1.445 -0.737 0 N-CA-C 111.279 -0.728 . . . . 10.0 111.279 178.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.85 99.69 Favored Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 111.048 -0.821 . . . . 10.0 111.048 179.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.81 -45.26 82.98 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 543' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' C' ' 543' ' ' ARG . 53.4 mtt180 -61.5 -39.7 91.9 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.715 179.314 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 544' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 75.4 mt -60.1 -42.26 94.29 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 178.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -68.51 -45.36 72.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.754 -0.657 . . . . 10.0 109.323 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.03 -51.88 67.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.522 -0.763 . . . . 10.0 110.208 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -60.45 -38.8 85.31 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.162 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -67.66 -41.72 83.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.054 0.454 . . . . 10.0 110.703 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.62 -50.54 64.66 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 550' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' C' ' 554' ' ' HIS . 0.0 OUTLIER -63.01 -32.96 74.44 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.885 179.567 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.21 -43.15 92.45 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.647 -0.501 . . . . 10.0 109.647 178.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 25.3 m -63.52 -45.0 92.62 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.489 -0.56 . . . . 10.0 109.489 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -64.41 -39.62 94.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.46 178.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 554' ' ' HIS . . . . . 0.456 ' HB2' ' O ' ' C' ' 550' ' ' LYS . 16.5 t-80 -64.3 -41.55 96.79 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.616 -0.72 . . . . 10.0 110.124 178.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 79.7 mt -68.6 -38.23 80.44 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.483 -0.326 . . . . 10.0 110.429 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 19.3 m -66.91 -39.05 87.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.396 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 3.2 p -73.95 -25.37 59.91 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.36 179.105 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 558' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' C' ' 554' ' ' HIS . 32.8 mt -75.84 -41.27 52.99 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 108.738 -0.838 . . . . 10.0 108.738 177.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 559' ' ' SER . . . . . 0.58 ' HA ' ' HB3' ' C' ' 562' ' ' ALA . 47.0 m -61.53 -25.95 67.62 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.526 -0.761 . . . . 10.0 110.819 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -61.29 -21.94 64.4 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.839 -0.619 . . . . 10.0 110.51 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -117.43 -21.72 8.52 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.886 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 562' ' ' ALA . . . . . 0.58 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -66.42 -21.72 66.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.87 179.376 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 563' ' ' LYS . . . . . 0.936 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 86.7 mttt -109.89 -67.59 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.596 178.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 564' ' ' PRO . . . . . 0.936 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 31.2 Cg_exo -61.25 -54.56 1.7 Allowed 'Trans proline' 0 C--N 1.357 0.982 0 C-N-CA 122.164 1.91 . . . . 10.0 113.098 -179.337 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 565' ' ' ALA . . . . . 0.422 ' O ' ' HG ' ' C' ' 569' ' ' LEU . . . -63.04 -44.64 95.32 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.925 -0.31 . . . . 10.0 111.685 -179.274 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 566' ' ' LEU . . . . . 0.451 HD23 ' HA ' ' C' ' 566' ' ' LEU . 4.1 mt -60.63 -40.94 93.81 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-O 120.756 0.312 . . . . 10.0 110.356 178.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 567' ' ' GLU . . . . . 0.712 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 20.0 mm-40 -64.79 -37.62 88.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.306 178.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.29 -39.96 78.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.942 178.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 569' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' C' ' 565' ' ' ALA . 78.2 mt -61.6 -44.7 96.52 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.25 -0.648 . . . . 10.0 109.25 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -65.0 -38.6 91.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.514 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 571' ' ' GLN . . . . . 0.712 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.3 mt-30 -70.05 -18.24 63.28 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.745 -0.661 . . . . 20.0 112.584 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -94.2 -35.55 5.99 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 108.961 -1.656 . . . . 10.0 108.961 178.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 573' ' ' LEU . . . . . 0.632 ' HA ' HG12 ' C' ' 576' ' ' VAL . 63.5 mt -67.51 -40.92 85.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.366 -0.417 . . . . 10.0 111.82 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 94.5 mt -53.79 -60.75 6.48 Favored Pre-proline 0 CA--C 1.534 0.364 0 N-CA-C 112.418 0.525 . . . . 10.0 112.418 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -66.34 -36.41 27.64 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 121.744 1.629 . . . . 10.0 112.401 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 576' ' ' VAL . . . . . 0.632 HG12 ' HA ' ' C' ' 573' ' ' LEU . 1.9 p -67.3 -37.43 79.05 Favored 'Isoleucine or valine' 0 C--N 1.34 0.165 0 C-N-CA 120.434 -0.506 . . . . 10.0 111.411 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 577' ' ' LEU . . . . . 0.489 ' O ' ' HG3' ' C' ' 581' ' ' LYS . 6.2 mt -63.31 -41.14 98.92 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.178 -0.675 . . . . 10.0 109.178 178.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 578' ' ' GLU . . . . . 0.473 ' O ' HG23 ' C' ' 582' ' ' VAL . 43.0 mt-10 -64.5 -45.45 87.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.515 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 3.9 p -67.28 -31.15 71.28 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 121.165 0.507 . . . . 10.0 110.14 178.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.06 -35.98 74.65 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.764 -0.828 . . . . 10.0 108.764 178.276 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 581' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' C' ' 577' ' ' LEU . 87.8 mttt -63.97 -37.92 89.19 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.383 178.409 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 582' ' ' VAL . . . . . 0.473 HG23 ' O ' ' C' ' 578' ' ' GLU . 58.4 t -62.59 -43.26 98.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 N-CA-C 108.895 -0.78 . . . . 10.0 108.895 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 8.6 m -66.07 -40.01 90.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.407 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -69.36 -48.61 60.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.109 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 585' ' ' LEU . . . . . 0.484 ' O ' ' HG3' ' C' ' 589' ' ' GLU . 76.9 mt -57.63 -47.79 81.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.626 -0.261 . . . . 10.0 110.706 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 25.9 p -61.45 -42.39 98.68 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 587' ' ' ALA . . . . . 0.519 ' HB2' ' HE3' ' A' ' 396' ' ' LYS . . . -62.31 -44.0 97.53 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.235 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 91.5 mt -57.63 -44.98 85.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.471 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 589' ' ' GLU . . . . . 0.525 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 45.5 mt-10 -67.08 -53.14 33.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.977 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -58.09 -47.03 84.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.208 -0.451 . . . . 10.0 112.075 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -63.03 -43.68 98.05 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.355 0.502 . . . . 10.0 112.355 -179.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 10.2 p -65.11 -29.28 70.13 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.807 -0.357 . . . . 10.0 111.427 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 593' ' ' LYS . . . . . 0.525 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 89.6 mttt -68.67 -22.45 64.38 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.082 0.467 . . . . 10.0 110.371 178.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.06 -4.65 31.93 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.491 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 86.2 mt -95.68 -40.98 9.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.395 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 . . . . . 0 C--O 1.252 1.224 0 CA-C-O 118.411 -0.804 . . . . 10.0 110.468 -179.865 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 72.6 mtp . . . . . 0 C--O 1.233 0.234 0 CA-C-O 121.204 0.526 . . . . 10.0 110.576 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 5.5 t -160.3 152.86 20.94 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.602 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.685 ' HB2' ' H73' ' A' ' 30' ' ' PCW . 38.0 tt0 -86.97 118.96 26.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.236 179.522 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -108.58 120.02 41.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.021 0.438 . . . . 10.0 111.811 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.637 ' NZ ' HN1A ' A' ' 40' ' ' 17F . 2.8 mtmt -109.59 116.2 31.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.53 179.318 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.539 HD22 HD23 ' B' ' 159' ' ' LEU . 45.3 mt -110.73 117.98 34.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.44 -0.345 . . . . 10.0 111.197 -178.655 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 47.6 t -104.69 118.19 51.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.026 0.441 . . . . 10.0 110.686 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 23.4 t -92.21 116.64 33.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 17.2 m -108.47 170.09 2.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.909 0.385 . . . . 10.0 111.256 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 150.39 170.95 18.2 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.901 -0.666 . . . . 10.0 111.581 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.454 ' O ' HG22 ' B' ' 14' ' ' VAL . . . -87.9 -174.24 4.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.878 0.371 . . . . 10.0 111.371 -179.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.38 141.58 21.43 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.004 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 108.6 -21.52 28.01 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.647 -0.787 . . . . 10.0 112.18 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.51 HG23 ' HG3' ' B' ' 16' ' ' LYS . 21.9 m -80.04 162.4 3.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 120.938 0.399 . . . . 10.0 110.854 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 15' ' ' GLY . . . . . 0.507 ' HA2' ' O1A' ' B' ' 201' ' ' GNP . . . -90.2 52.14 3.47 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.809 -0.71 . . . . 10.0 113.451 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.51 ' HG3' HG23 ' B' ' 14' ' ' VAL . 42.1 mtmt -60.73 -58.71 7.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.12 0.486 . . . . 10.0 110.34 179.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -65.93 -32.04 73.32 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.266 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.02 -50.21 69.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.908 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 86.0 mt -59.54 -42.27 91.94 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 121.03 0.443 . . . . 10.0 110.076 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' THR . . . . . 0.478 ' O ' HG12 ' B' ' 24' ' ' ILE . 14.4 m -61.37 -53.68 53.54 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.569 -0.741 . . . . 10.0 111.423 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 96.3 mt -61.43 -32.69 54.04 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-O 120.759 0.314 . . . . 10.0 111.115 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.67 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 7.4 tp-100 -67.09 -27.84 67.69 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.142 0.496 . . . . 10.0 110.62 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 23.6 tp -88.58 -33.32 17.73 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.827 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' ILE . . . . . 0.478 HG12 ' O ' ' B' ' 20' ' ' THR . 42.5 mm -81.1 -69.48 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.935 -179.319 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -84.17 -14.19 50.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.77 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.67 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 53.6 m-80 68.18 29.09 6.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.588 0.709 . . . . 10.0 109.129 -178.477 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 74.9 t60 -124.97 144.64 50.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.987 -1.006 . . . . 10.0 110.165 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -103.09 131.71 49.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.657 0.265 . . . . 10.0 110.899 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 4.3 m -91.84 125.76 44.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.144 178.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.35 -11.25 26.07 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.281 0.562 . . . . 10.0 110.689 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -87.5 146.13 25.95 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.877 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.581 ' HD1' " H4'" ' B' ' 201' ' ' GNP . 26.6 t80 -88.5 64.83 7.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.963 0.411 . . . . 10.0 110.224 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.14 140.0 76.39 Favored Pre-proline 0 C--O 1.237 0.432 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.065 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -71.57 -179.51 3.77 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 122.777 2.318 . . . . 10.0 113.007 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 35' ' ' THR . . . . . 0.424 HG22 ' HA ' ' B' ' 59' ' ' ALA . 1.0 OUTLIER -166.9 136.0 2.85 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.846 179.745 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.784 HD11 HG21 ' D' ' 809' ' ' THR . 3.5 mt -117.21 -66.3 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.523 ' O ' HG23 ' D' ' 821' ' ' VAL . 2.8 tm-20 -147.79 94.92 2.42 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 179.138 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 38' ' ' ASP . . . . . 0.457 ' O ' HD12 ' B' ' 56' ' ' LEU . 25.1 m-20 -118.89 150.21 40.25 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.094 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.19 141.02 46.9 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.883 -0.327 . . . . 10.0 111.397 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 40' ' ' TYR . . . . . 0.673 ' CE2' HG22 ' D' ' 840' ' ' VAL . 30.1 m-85 -124.29 147.26 48.25 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.53 -0.304 . . . . 10.0 111.811 -178.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 41' ' ' ARG . . . . . 0.661 ' NH1' ' HB2' ' D' ' 817' ' ' LYS . 0.0 OUTLIER -125.11 136.44 53.64 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 112.891 0.7 . . . . 10.0 112.891 -178.856 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 42' ' ' LYS . . . . . 0.47 ' HD2' HD13 ' B' ' 24' ' ' ILE . 28.8 tttm -158.72 157.89 32.62 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.226 -0.897 . . . . 10.0 109.626 178.5 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -133.86 123.31 24.53 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.142 -0.318 . . . . 10.0 110.142 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 10.0 m -138.36 165.65 24.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.847 0.356 . . . . 10.0 111.101 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.729 HG22 ' HB ' ' B' ' 50' ' ' THR . 16.0 t -90.32 97.06 6.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.667 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 46' ' ' ILE . . . . . 0.575 HD11 HD11 ' B' ' 53' ' ' LEU . 46.1 mt -86.45 120.13 35.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.674 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 51.7 m-20 68.53 -67.26 0.21 Allowed 'General case' 0 N--CA 1.465 0.293 0 O-C-N 123.766 0.667 . . . . 10.0 111.291 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . -155.12 -12.25 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 121.039 -0.6 . . . . 10.0 112.871 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -121.81 132.99 54.9 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 117.145 0.472 . . . . 10.0 111.769 -179.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.729 ' HB ' HG22 ' B' ' 45' ' ' VAL . 9.9 t -79.83 130.76 35.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.993 -0.548 . . . . 10.0 110.605 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -142.45 150.79 41.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.888 0.375 . . . . 10.0 111.602 -179.428 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 26.6 tp -79.86 129.29 34.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.158 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.575 HD11 HD11 ' B' ' 46' ' ' ILE . 82.6 mt -111.99 123.03 49.38 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.939 -179.174 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -103.04 103.16 13.23 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.027 -1.101 . . . . 10.0 108.027 177.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.475 HD12 HD11 ' B' ' 24' ' ' ILE . 26.9 mt -92.94 138.86 19.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.959 -0.564 . . . . 10.0 111.502 -177.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.457 HD12 ' O ' ' B' ' 38' ' ' ASP . 37.2 tp -114.01 121.14 42.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.882 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.436 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 6.5 t70 -98.72 96.22 7.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.433 -0.803 . . . . 10.0 108.888 179.403 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 47.5 p -80.64 163.52 23.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.721 -0.672 . . . . 10.0 112.689 -178.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.424 ' HA ' HG22 ' B' ' 35' ' ' THR . . . -66.73 158.37 30.39 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.734 -0.666 . . . . 10.0 111.102 179.402 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -83.62 -53.58 3.35 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.8 -0.714 . . . . 10.0 111.776 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -113.31 135.51 53.77 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.054 -0.35 . . . . 20.0 110.054 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -158.66 -178.26 7.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.687 0.279 . . . . 10.0 110.843 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -113.94 -91.77 0.5 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.153 0.501 . . . . 10.0 109.968 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -159.85 78.99 0.7 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.652 -0.704 . . . . 10.0 109.915 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 48.6 m -91.46 130.86 37.24 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.586 -0.734 . . . . 10.0 111.056 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.36 -34.5 73.96 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 121.245 0.545 . . . . 10.0 109.834 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 83.9 mmm -62.7 -40.29 96.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.412 -0.813 . . . . 10.0 109.81 178.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.65 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 0.4 OUTLIER -66.18 -44.97 82.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.437 179.793 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -58.4 -32.24 68.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.811 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.483 ' HG3' ' H12' ' A' ' 17' ' ' PCW . 6.3 tt0 -61.67 -58.36 8.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.998 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 71' ' ' TYR . . . . . 0.65 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 21.0 p90 -70.61 -11.95 61.26 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 113.146 0.795 . . . . 10.0 113.146 -178.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 66.3 mmm -75.6 -16.52 60.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.27 -0.423 . . . . 10.0 109.992 178.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 73' ' ' ARG . . . . . 0.718 ' HG2' ' HB ' ' B' ' 103' ' ' VAL . 20.0 mtt180 -95.18 -17.5 21.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.44 . . . . 10.0 111.245 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -87.18 13.33 9.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.319 -0.4 . . . . 10.0 111.68 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -104.73 138.25 14.06 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.61 -0.805 . . . . 10.0 111.656 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -91.38 -37.4 13.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.268 0.556 . . . . 10.0 110.74 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -132.09 143.55 15.14 Favored Glycine 0 N--CA 1.444 -0.782 0 N-CA-C 110.82 -0.912 . . . . 10.0 110.82 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -124.62 123.35 39.86 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.242 0.544 . . . . 10.0 112.111 -178.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.627 ' HG ' HD22 ' B' ' 159' ' ' LEU . 97.5 mt -92.18 115.77 28.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.602 -0.726 . . . . 10.0 109.666 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 80' ' ' CYS . . . . . 0.426 ' HB3' HD12 ' B' ' 93' ' ' ILE . 9.8 m -86.37 85.59 7.33 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.783 -0.451 . . . . 10.0 109.783 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 39.6 t -82.93 119.36 32.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.005 -0.543 . . . . 10.0 112.099 -178.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.795 ' HB3' HD11 ' B' ' 93' ' ' ILE . 19.3 p90 -133.81 135.34 43.75 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.047 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -79.07 128.46 33.3 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.652 -0.249 . . . . 10.0 110.437 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 84' ' ' ILE . . . . . 0.678 HD11 ' HA ' ' B' ' 118' ' ' CYS . 34.0 pt -70.89 -13.26 16.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.815 0.34 . . . . 10.0 111.899 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 85' ' ' ASN . . . . . 0.51 ' OD1' ' HD2' ' B' ' 117' ' ' LYS . 3.7 p-10 -94.17 -2.76 52.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.05 0.453 . . . . 10.0 110.023 179.419 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -126.25 102.51 7.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.034 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.29 -37.39 69.81 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.094 -0.503 . . . . 10.0 112.331 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 23.5 tptp -57.87 -34.94 70.3 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 111.928 0.344 . . . . 10.0 111.928 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 62.1 m -66.56 -35.63 80.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.652 -0.249 . . . . 10.0 111.015 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -68.22 -39.18 82.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.246 0.546 . . . . 10.0 109.971 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -73.55 -34.42 65.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.922 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.84 -14.02 62.62 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.959 -0.564 . . . . 10.0 111.965 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 93' ' ' ILE . . . . . 0.795 HD11 ' HB3' ' B' ' 82' ' ' PHE . 32.9 mm -58.6 -42.48 84.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.903 0.382 . . . . 10.0 110.322 179.417 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -66.7 -32.49 73.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.252 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -66.98 -38.14 85.51 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.193 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -80.41 -32.27 37.51 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.123 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -56.96 -48.03 79.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.766 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -65.78 -35.74 81.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.224 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -62.05 -44.55 96.45 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.476 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 53.0 mt -66.86 -39.21 83.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.277 0.561 . . . . 10.0 110.337 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 101' ' ' LYS . . . . . 0.672 ' HE3' ' HG2' ' B' ' 107' ' ' GLU . 45.2 mtpt -68.54 -20.95 64.58 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.465 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 1.6 ttp-105 -84.48 -38.94 19.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.607 -0.27 . . . . 10.0 111.589 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.718 ' HB ' ' HG2' ' B' ' 73' ' ' ARG . 34.7 m -71.79 -26.02 25.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 112.391 0.515 . . . . 10.0 112.391 -179.211 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.444 ' HG2' HG23 ' B' ' 103' ' ' VAL . 66.5 mmtt -107.27 -9.6 16.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.447 179.46 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 105' ' ' ASP . . . . . 0.478 ' OD2' ' H71' ' A' ' 32' ' ' PCW . 5.8 t70 54.06 38.15 28.4 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.514 -0.766 . . . . 10.0 112.351 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 22.7 t -156.49 156.66 34.1 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.421 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 107' ' ' GLU . . . . . 0.672 ' HG2' ' HE3' ' B' ' 101' ' ' LYS . 24.9 mt-10 -95.42 -17.17 21.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.051 -0.522 . . . . 10.0 109.647 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 108' ' ' ASP . . . . . 0.43 ' OD1' ' HE2' ' B' ' 169' ' ' LYS . 12.8 t70 -85.71 74.78 10.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.352 -0.84 . . . . 10.0 110.298 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 44.4 t -129.37 132.82 24.52 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.795 -0.639 . . . . 10.0 109.903 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -64.04 103.3 0.41 Allowed 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.935 2.424 . . . . 10.0 112.241 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 111' ' ' MET . . . . . 0.402 ' HB2' HG21 ' B' ' 139' ' ' ILE . 38.3 mtt -126.29 153.27 45.03 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.305 -0.628 . . . . 10.0 109.305 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 112' ' ' VAL . . . . . 0.458 ' HB ' HD23 ' B' ' 79' ' ' LEU . 96.9 t -135.5 130.56 50.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 18.2 tp -80.75 114.42 19.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.496 -0.927 . . . . 10.0 108.496 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 19.4 t -111.66 110.83 33.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.073 0.463 . . . . 10.0 112.185 -177.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -82.75 136.19 15.0 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 109.011 -1.635 . . . . 10.0 109.011 177.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -121.55 153.52 37.89 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 117.557 0.679 . . . . 10.0 112.366 -178.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 117' ' ' LYS . . . . . 0.51 ' HD2' ' OD1' ' B' ' 85' ' ' ASN . 90.4 mttt 69.65 44.19 0.91 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.256 -0.884 . . . . 10.0 112.615 178.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 118' ' ' CYS . . . . . 0.678 ' HA ' HD11 ' B' ' 84' ' ' ILE . 18.7 p -79.58 -4.12 50.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.376 0.608 . . . . 10.0 110.172 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -93.39 1.31 56.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.342 -0.845 . . . . 10.0 110.19 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.412 HD12 ' HB3' ' B' ' 117' ' ' LYS . 40.5 mt -99.92 141.5 22.88 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.172 -0.467 . . . . 10.0 109.741 178.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -81.19 7.99 4.63 Favored 'Trans proline' 0 CA--C 1.529 0.25 0 C-N-CA 122.701 2.267 . . . . 10.0 112.284 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.49 35.43 1.64 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.943 0.402 . . . . 10.0 111.042 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 4.7 ttt180 -60.92 105.28 0.45 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.136 0.493 . . . . 10.0 112.296 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.1 m -94.56 -41.62 9.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.902 -0.59 . . . . 10.0 109.617 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 38.3 t -93.93 111.24 24.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.695 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.16 158.08 36.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.055 0.455 . . . . 10.0 111.272 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 127' ' ' THR . . . . . 0.503 ' O ' ' HG3' ' B' ' 131' ' ' GLN . 0.2 OUTLIER -56.93 -40.11 75.74 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.768 -0.651 . . . . 10.0 112.381 -179.373 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 19.8 tptt -59.85 -46.41 89.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.497 0.189 . . . . 10.0 111.239 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -55.67 -43.12 76.05 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.205 0.526 . . . . 10.0 110.438 178.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.48 -44.32 83.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.545 -0.752 . . . . 10.0 111.539 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.503 ' HG3' ' O ' ' B' ' 127' ' ' THR . 71.1 mt-30 -64.61 -35.13 79.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.802 0.334 . . . . 10.0 110.992 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -61.05 -49.72 76.23 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.74 -0.663 . . . . 10.0 110.656 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 13.7 tp -67.24 -42.2 84.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.766 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.23 74.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.673 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 21.5 tpt180 -60.3 -38.24 83.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.354 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 38.2 m -70.79 -24.57 62.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.655 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -93.72 -7.97 42.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.019 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 72.25 26.78 71.32 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.825 -0.625 . . . . 10.0 111.697 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 139' ' ' ILE . . . . . 0.402 HG21 ' HB2' ' B' ' 111' ' ' MET . 47.7 pt -122.83 149.76 57.11 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.668 0.27 . . . . 10.0 110.672 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -77.34 151.81 29.94 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.629 2.219 . . . . 10.0 111.602 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -111.78 126.83 55.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.367 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 41.3 mm -126.22 126.18 68.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.061 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 143' ' ' GLU . . . . . 0.537 ' HG2' ' HB3' ' B' ' 118' ' ' CYS . 4.0 tt0 -90.46 125.3 35.53 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 144' ' ' THR . . . . . 0.638 ' HA ' ' O ' ' B' ' 150' ' ' GLN . 74.0 p -132.29 160.26 36.73 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.662 0.986 . . . . 10.0 113.662 -177.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -155.36 123.68 5.9 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.224 -1.353 . . . . 10.0 107.98 178.096 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -74.28 -30.39 62.08 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.344 0.498 . . . . 10.0 112.344 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 33.1 tttp -64.93 -45.92 83.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.485 -0.325 . . . . 10.0 111.458 -179.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.75 -0.93 36.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.956 -179.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 149' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' B' ' 149' ' ' ARG . 16.9 ttt85 57.28 47.49 16.71 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.426 0.631 . . . . 10.0 110.924 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 150' ' ' GLN . . . . . 0.638 ' O ' ' HA ' ' B' ' 144' ' ' THR . 33.8 tp60 -83.53 106.52 15.33 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.054 -179.297 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 59.05 22.13 54.6 Favored Glycine 0 CA--C 1.52 0.377 0 N-CA-C 114.742 0.657 . . . . 10.0 114.742 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 60.9 t -64.69 -48.28 85.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 117.273 0.536 . . . . 10.0 110.23 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -64.49 -46.36 83.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.186 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -63.61 -31.23 72.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.57 -0.741 . . . . 10.0 112.525 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.68 -44.12 85.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.069 0.462 . . . . 10.0 110.444 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -72.02 -37.31 69.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.55 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -64.47 -40.44 95.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.969 0.414 . . . . 10.0 110.782 179.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 46.9 m -61.54 -40.56 95.14 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.004 179.055 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.627 HD22 ' HG ' ' B' ' 79' ' ' LEU . 30.9 tp -62.17 -45.57 92.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.396 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 160' ' ' VAL . . . . . 0.485 HG21 HD13 ' B' ' 46' ' ' ILE . 89.7 t -60.21 -41.97 88.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.308 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 67.6 mtm-85 -62.66 -37.92 88.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.108 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -67.71 -39.09 84.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.914 0.388 . . . . 10.0 110.284 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 163' ' ' ILE . . . . . 0.534 HG22 ' HE2' ' B' ' 167' ' ' LYS . 71.7 mt -66.75 -39.57 83.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 178.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -61.99 -42.74 99.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.183 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 21.9 mtmm -67.68 -32.68 73.51 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.123 179.074 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 -61.99 -45.61 92.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.355 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 167' ' ' LYS . . . . . 0.534 ' HE2' HG22 ' B' ' 163' ' ' ILE . 59.1 mttm -63.8 -36.14 82.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.479 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -63.24 -41.83 99.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.781 -0.645 . . . . 10.0 109.397 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 169' ' ' LYS . . . . . 0.43 ' HE2' ' OD1' ' B' ' 108' ' ' ASP . 56.7 tttp -68.34 -39.71 81.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.965 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 97.2 mtp -65.15 -20.81 66.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.969 0.414 . . . . 10.0 111.524 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 171' ' ' SER . . . . . 0.606 ' HB3' ' H83' ' A' ' 11' ' ' PCW . 13.5 m -98.25 12.56 34.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.735 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -129.67 -40.18 1.41 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.97 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.51 163.69 18.06 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.903 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 159.89 -137.27 4.99 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.783 -0.723 . . . . 10.0 112.22 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 175' ' ' LYS . . . . . 0.412 ' HD2' ' HA ' ' B' ' 175' ' ' LYS . 20.7 tptm -79.22 69.1 5.37 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.219 0.533 . . . . 10.0 111.179 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 53.7 tttt -131.17 89.77 2.78 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.982 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -116.07 130.36 56.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.185 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -80.0 -52.85 7.32 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.129 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -87.33 105.6 17.36 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.455 0.645 . . . . 10.0 110.386 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 25.0 mtmm -102.88 54.11 0.77 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.807 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 1.3 m -78.28 161.9 26.92 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.917 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 182' ' ' LYS . . . . . 0.686 ' HA ' ' H61' ' A' ' 4' ' ' PCW . 39.4 tttm -97.5 -16.45 20.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.038 0.447 . . . . 10.0 110.437 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 13.9 t -139.56 -173.48 3.63 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.811 -0.632 . . . . 10.0 110.172 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -85.4 160.69 19.7 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.852 0.358 . . . . 10.0 110.428 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 57.7 m . . . . . 0 C--N 1.322 -0.59 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.621 179.543 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.248 0 N-CA-C 112.031 -0.427 . . . . 10.0 112.031 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D ' 809' ' ' THR . . . . . 0.784 HG21 HD11 ' B' ' 36' ' ' ILE . 9.6 p -136.97 146.73 45.74 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.707 0.289 . . . . 10.0 110.958 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 810' ' ' VAL . . . . . 0.424 HG23 HG22 ' D' ' 824' ' ' VAL . 92.5 t -106.74 133.15 52.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.283 -0.417 . . . . 10.0 109.888 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 811' ' ' LYS . . . . . 0.417 ' HB2' ' HG3' ' D' ' 874' ' ' GLU . 7.2 mtmp? -85.98 106.87 17.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.285 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 46.9 t -95.84 124.21 48.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.334 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -101.56 130.93 47.96 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.969 -0.382 . . . . 10.0 109.969 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 45.2 mt -103.42 155.98 36.08 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.555 -178.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 815' ' ' PRO . . . . . 0.499 ' HB3' ' HA ' ' D' ' 878' ' ' GLU . 74.4 Cg_endo -74.58 53.38 3.13 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 123.424 2.75 . . . . 10.0 112.036 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -152.63 31.86 0.51 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 817' ' ' LYS . . . . . 0.791 ' HZ2' ' HN1' ' A' ' 37' ' ' 17F . 88.4 mttt 53.96 32.54 15.56 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 114.675 -1.148 . . . . 10.0 111.439 -179.293 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 818' ' ' GLN . . . . . 0.409 HE22 ' C ' ' B' ' 40' ' ' TYR . 73.5 mt-30 -136.99 -179.2 5.56 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 114.13 1.159 . . . . 10.0 114.13 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.02 171.44 15.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.16 -0.927 . . . . 10.0 112.178 -178.377 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 45.2 m -155.01 131.52 10.51 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.623 -1.251 . . . . 10.0 107.623 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 821' ' ' VAL . . . . . 0.684 HG12 ' HB ' ' D' ' 809' ' ' THR . 4.0 t -97.28 113.26 31.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 120.562 -0.455 . . . . 10.0 111.081 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 26.1 t -105.61 137.82 33.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.883 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 823' ' ' THR . . . . . 0.743 ' HA ' HG22 ' D' ' 809' ' ' THR . 1.2 m -72.95 144.62 47.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.766 179.482 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 824' ' ' VAL . . . . . 0.424 HG22 HG23 ' D' ' 810' ' ' VAL . 45.2 t -76.19 119.47 24.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.552 -0.295 . . . . 10.0 110.403 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -114.08 130.42 56.57 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.917 0.389 . . . . 10.0 111.063 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -75.28 129.86 38.13 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.979 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 82.88 2.2 90.65 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.971 -0.558 . . . . 10.0 112.582 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 7.1 ttt -89.44 126.97 35.78 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 122.726 -0.279 . . . . 10.0 110.39 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 829' ' ' SER . . . . . 0.644 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 1.0 OUTLIER -82.11 150.68 27.36 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.391 -0.226 . . . . 10.0 110.391 179.592 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 92.9 t -54.05 -38.85 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 O-C-N 123.228 0.33 . . . . 10.0 110.885 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 831' ' ' TYR . . . . . 0.614 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 80.8 t80 -57.13 -31.05 64.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.319 -0.4 . . . . 10.0 111.396 179.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -82.98 -45.67 13.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.509 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.33 -42.68 78.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.031 0.443 . . . . 10.0 111.352 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 834' ' ' LEU . . . . . 0.482 HD13 ' HB3' ' D' ' 837' ' ' ALA . 1.3 mm? -80.28 -8.57 59.53 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.855 -179.252 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 835' ' ' ASP . . . . . 0.608 ' O ' ' HG2' ' D' ' 839' ' ' LYS . 29.7 t70 -61.45 -61.19 2.71 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 110.051 -0.352 . . . . 10.0 110.051 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 39.3 mttt -62.77 -29.81 70.98 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.885 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 837' ' ' ALA . . . . . 0.482 ' HB3' HD13 ' D' ' 834' ' ' LEU . . . -69.05 -25.77 64.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.942 0.401 . . . . 10.0 110.762 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 838' ' ' LEU . . . . . 0.579 HD12 ' HG3' ' D' ' 845' ' ' GLN . 40.0 mt -93.07 -44.3 8.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.149 179.307 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 839' ' ' LYS . . . . . 0.608 ' HG2' ' O ' ' D' ' 835' ' ' ASP . 10.5 mmtt -61.27 -23.63 65.81 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.668 179.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 840' ' ' VAL . . . . . 0.673 HG22 ' CE2' ' B' ' 40' ' ' TYR . 1.4 p -49.66 -20.88 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 N-CA-C 112.916 0.71 . . . . 10.0 112.916 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 841' ' ' ARG . . . . . 0.43 ' HG3' ' HG ' ' D' ' 843' ' ' LEU . 13.9 ptp180 -140.59 23.17 2.31 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.368 0.604 . . . . 10.0 111.721 177.645 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 75.59 28.41 61.4 Favored Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 115.601 -0.727 . . . . 10.0 114.654 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 843' ' ' LEU . . . . . 0.43 ' HG ' ' HG3' ' D' ' 841' ' ' ARG . 96.6 mt -92.4 154.26 18.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 117.598 0.699 . . . . 10.0 110.215 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -121.68 143.28 49.44 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.815 0.341 . . . . 10.0 111.602 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 845' ' ' GLN . . . . . 0.579 ' HG3' HD12 ' D' ' 838' ' ' LEU . 21.5 mp0 -60.64 -28.69 68.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.813 -0.63 . . . . 10.0 111.822 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -76.81 -4.34 43.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.468 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 2.2 t -131.95 18.16 4.61 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 120.966 0.412 . . . . 10.0 110.972 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 79.6 m -142.65 153.29 43.3 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.485 -0.325 . . . . 10.0 110.472 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 14.6 p -130.6 141.81 45.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.42 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 850' ' ' VAL . . . . . 0.449 HG21 ' HG ' ' D' ' 834' ' ' LEU . 26.0 t -109.75 122.96 65.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.351 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 851' ' ' TYR . . . . . 0.602 ' HE1' HG22 ' D' ' 860' ' ' VAL . 48.9 m-85 -103.8 142.85 33.66 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.953 179.662 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 42.3 mmm-85 -82.89 164.78 20.27 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.333 -0.849 . . . . 10.0 109.819 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 853' ' ' LEU . . . . . 0.566 HD13 HD11 ' D' ' 876' ' ' ILE . 16.2 tp -124.52 62.07 1.13 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.469 0.652 . . . . 10.0 110.551 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 44.3 mt -84.4 102.25 10.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.28 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp 61.44 17.07 8.07 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.431 -0.804 . . . . 10.0 112.194 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 105.05 -18.32 42.99 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.94 -0.648 . . . . 10.0 112.412 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 857' ' ' ARG . . . . . 0.461 HH11 H161 ' A' ' 10' ' ' PCW . 10.0 mmm180 -81.35 138.45 35.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.968 0.413 . . . . 10.0 110.897 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 858' ' ' LYS . . . . . 0.447 ' HE3' ' CD1' ' D' ' 876' ' ' ILE . 12.5 mptt -88.34 122.36 31.77 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.466 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 3.7 m -122.53 136.1 54.8 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.037 -0.529 . . . . 10.0 109.787 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 860' ' ' VAL . . . . . 0.602 HG22 ' HE1' ' D' ' 851' ' ' TYR . 6.4 t -75.74 123.91 32.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 110.391 -0.225 . . . . 10.0 110.391 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 3.2 t -104.6 160.7 14.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.544 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -99.1 149.63 22.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.569 -0.287 . . . . 10.0 110.914 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 863' ' ' TRP . . . . . 0.614 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 99.4 m95 -70.55 -27.42 64.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.924 -179.142 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.16 1.61 39.63 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.532 0.567 . . . . 10.0 112.532 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 23.5 m -84.98 148.2 26.32 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 179.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 866' ' ' ALA . . . . . 0.644 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -82.48 150.33 27.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.026 0.441 . . . . 10.0 111.622 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 867' ' ' ILE . . . . . 0.475 HD12 HD13 ' D' ' 870' ' ' LEU . 8.8 tp -84.7 -10.32 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.845 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 868' ' ' ALA . . . . . 0.618 ' HB3' ' HD3' ' D' ' 869' ' ' PRO . . . -58.11 -55.6 43.64 Favored Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 113.024 0.75 . . . . 10.0 113.024 -179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 869' ' ' PRO . . . . . 0.618 ' HD3' ' HB3' ' D' ' 868' ' ' ALA . 3.4 Cg_exo -77.81 13.21 1.74 Allowed 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 122.345 2.03 . . . . 10.0 112.161 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 870' ' ' LEU . . . . . 0.475 HD13 HD12 ' D' ' 867' ' ' ILE . 0.2 OUTLIER -103.83 -8.0 20.1 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.094 -0.503 . . . . 10.0 109.983 179.785 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -58.01 127.28 31.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.78 -0.646 . . . . 10.0 111.285 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 121.85 -16.43 8.87 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.479 -0.867 . . . . 10.0 113.402 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -126.95 -170.58 2.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.11 0.455 . . . . 10.0 112.115 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 874' ' ' GLU . . . . . 0.417 ' HG3' ' HB2' ' D' ' 811' ' ' LYS . 4.4 mp0 -113.26 170.24 8.37 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.991 -0.549 . . . . 10.0 110.784 -178.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 36.8 mt -130.83 129.74 42.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.671 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 876' ' ' ILE . . . . . 0.756 HG23 ' H62' ' A' ' 10' ' ' PCW . 17.5 mt -114.38 112.73 41.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.312 -179.568 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 877' ' ' VAL . . . . . 0.516 HG11 HD21 ' D' ' 838' ' ' LEU . 24.4 t -97.74 137.08 26.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 120.728 0.299 . . . . 10.0 110.615 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 878' ' ' GLU . . . . . 0.57 ' OE2' ' H62' ' A' ' 8' ' ' PCW . 0.0 OUTLIER -140.55 171.05 14.66 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.091 -0.504 . . . . 10.0 109.909 179.233 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' D' D ' 879' ' ' VAL . . . . . 0.641 ' O ' ' H51' ' A' ' 8' ' ' PCW . 5.8 m -105.11 149.15 8.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.076 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 92.3 mt . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.739 -0.648 . . . . 10.0 111.495 -179.197 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PCW . . . . . 0.667 H121 ' H32' ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PCW . . . . . 0.702 H321 H351 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PCW . . . . . 0.854 H322 ' H51' ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PCW . . . . . 0.686 ' H61' ' HA ' ' B' ' 182' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PCW . . . . . 0.552 H421 H162 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PCW . . . . . 0.953 H341 H152 ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PCW . . . . . 0.763 H122 ' H32' ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PCW . . . . . 0.641 ' H51' ' O ' ' D' ' 879' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PCW . . . . . 0.719 ' H2 ' ' H32' ' A' ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PCW . . . . . 0.756 ' H62' HG23 ' D' ' 876' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PCW . . . . . 0.719 ' H32' ' H2 ' ' A' ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PCW . . . . . 0.511 H432 H242 ' A' ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PCW . . . . . 0.62 H442 ' H73' ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PCW . . . . . 0.638 H352 ' H59' ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PCW . . . . . 0.594 ' H71' ' O2 ' ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PCW . . . . . 0.763 ' H32' H122 ' A' ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PCW . . . . . 0.702 H351 H321 ' A' ' 2' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PCW . . . . . 0.616 ' O1P' H321 ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PCW . . . . . 0.599 H141 H142 ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PCW . . . . . 0.777 H361 H122 ' A' ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PCW . . . . . 0.452 ' H63' ' O ' ' D' ' 853' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PCW . . . . . 0.552 ' O3P' ' H81' ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PCW . . . . . 0.509 H162 H122 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PCW . . . . . 0.474 ' H61' ' O2P' ' A' ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PCW . . . . . 0.659 ' H40' H231 ' A' ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PCW . . . . . 0.615 H131 H151 ' A' ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PCW . . . . . 0.43 ' O31' ' H12' ' A' ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PCW . . . . . 0.953 H152 H341 ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PCW . . . . . 0.659 H231 ' H40' ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PCW . . . . . 0.685 ' H73' ' HB2' ' B' ' 3' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PCW . . . . . 0.648 H122 H432 ' A' ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PCW . . . . . 0.536 ' H20' H283 ' A' ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' 17F . . . . . 0.628 HN1A ' H83' ' A' ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' 17F . . . . . 0.638 ' H59' H352 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' 17F . . . . . 0.667 ' H32' H121 ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' 17F . . . . . 0.483 H20A ' H39' ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' 17F . . . . . 0.791 ' HN1' ' HZ2' ' D' ' 817' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' 17F . . . . . 0.535 ' H75' H482 ' A' ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' 17F . . . . . 0.662 ' H8 ' ' H33' ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' 17F . . . . . 0.637 HN1A ' NZ ' ' B' ' 5' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PCW . . . . . 0.716 H351 ' H39' ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PCW . . . . . 0.655 H262 H241 ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PCW . . . . . 0.434 ' H11' ' C12' ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PCW . . . . . 0.569 H362 ' H39' ' A' ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PCW . . . . . 0.401 H411 H382 ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PCW . . . . . 0.714 H122 H181 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PCW . . . . . 0.639 H371 H431 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PCW . . . . . 0.714 H181 H122 ' A' ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PCW . . . . . 0.558 H462 H482 ' A' ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PCW . . . . . 0.546 H341 ' H2 ' ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PCW . . . . . 0.716 ' H39' H351 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PCW . . . . . 0.49 H261 H231 ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PCW . . . . . 0.639 H431 H371 ' A' ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PCW . . . . . 0.535 H482 ' H75' ' A' ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PCW . . . . . 0.546 ' H2 ' H341 ' A' ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PCW . . . . . 0.586 H321 H161 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PCW . . . . . 0.599 ' H41' ' H12' ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PCW . . . . . 0.761 H121 ' H11' ' A' ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' PCW . . . . . 0.711 H461 ' H40' ' A' ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PCW . . . . . 0.664 H152 H212 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PCW . . . . . 0.511 H131 ' O31' ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PCW . . . . . 0.711 ' H40' H461 ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PCW . . . . . 0.546 H331 H182 ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PCW . . . . . 0.489 H131 ' H73' ' A' ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PCW . . . . . 0.608 H151 H19A ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PCW . . . . . 0.418 H452 H252 ' A' ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PCW . . . . . 0.569 ' H39' H362 ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PCW . . . . . 0.511 H331 H332 ' A' ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PCW . . . . . 0.522 H141 ' H32' ' A' ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PCW . . . . . 0.522 H411 H362 ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PCW . . . . . 0.488 ' H20' H352 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' 17F . . . . . 0.41 ' H57' H19A ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' 17F . . . . . 0.5 ' H38' ' H68' ' A' ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' 17F . . . . . 0.504 ' H6 ' ' H12' ' A' ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 77' ' ' 17F . . . . . 0.761 ' H11' H121 ' A' ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' 17F . . . . . 0.608 H19A H151 ' A' ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 80' ' ' 17F . . . . . 0.58 ' H76' H361 ' A' ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 201' ' ' GNP . . . . . 0.581 " H4'" ' HD1' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 88.4 mt . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 121.047 0.451 . . . . 10.0 110.432 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 202' ' ' LYS . . . . . 0.425 ' HE2' HG22 ' C' ' 576' ' ' VAL . 93.8 mttt -59.23 -44.33 92.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.575 -0.739 . . . . 10.0 111.202 -179.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 71.4 mt -75.28 -36.83 61.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.785 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 73.1 mt -60.33 -50.71 72.52 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.118 0.485 . . . . 10.0 111.045 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.16 -35.69 81.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.012 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -68.99 -41.75 77.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.512 179.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 17.5 m0 -62.51 -33.55 75.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.309 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -66.73 -33.37 75.49 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.233 0.54 . . . . 10.0 109.926 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 19.2 m -73.05 -26.3 61.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.815 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 95.3 t -78.99 -44.89 24.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.514 178.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.11 -37.5 87.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.27 -0.423 . . . . 10.0 111.507 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 212' ' ' SER . . . . . 0.518 ' O ' ' HG2' ' A' ' 216' ' ' LYS . 2.9 p -64.84 -36.15 83.41 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 178.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 40.6 m -71.96 -38.14 69.82 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 109.351 -0.611 . . . . 10.0 109.351 178.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -60.49 -45.87 92.18 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.421 178.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.95 -42.35 99.79 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.357 -0.383 . . . . 10.0 110.281 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 216' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 212' ' ' SER . 31.8 mmtt -64.32 -35.24 80.23 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.034 0.445 . . . . 10.0 109.91 178.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 55.8 mt -67.67 -46.19 73.08 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 86.3 mtt180 -61.97 -45.12 95.04 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.223 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -56.2 -42.38 77.09 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.583 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -79.26 -30.0 42.89 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.708 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 221' ' ' LEU . . . . . 0.457 HD11 H181 ' A' ' 15' ' ' PCW . 17.5 mt -61.93 -30.81 71.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.538 -0.301 . . . . 10.0 111.068 179.428 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -56.12 -67.0 2.44 Favored Glycine 0 C--N 1.331 0.268 0 N-CA-C 111.421 -0.671 . . . . 10.0 111.421 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -60.66 -37.11 81.85 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 121.955 1.77 . . . . 10.0 111.438 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 8.0 t -56.05 -47.18 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 O-C-N 123.172 0.295 . . . . 10.0 111.591 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 1.4 p -65.78 -39.16 90.72 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.517 -0.473 . . . . 10.0 110.03 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -61.29 -47.72 84.7 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 109.476 -0.565 . . . . 10.0 109.476 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -64.09 -41.3 97.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.364 179.095 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -62.36 -48.36 80.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.026 179.048 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 229' ' ' TRP . . . . . 0.478 ' HA ' ' HE3' ' A' ' 229' ' ' TRP . 2.2 m95 -67.02 -40.7 87.29 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.5 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -56.07 -52.47 64.15 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.13 0.491 . . . . 10.0 110.037 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 54.0 m-80 -64.98 -42.99 94.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.413 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 7.1 mt -63.53 -33.49 75.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.248 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 233' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' A' ' 237' ' ' GLU . 3.5 mm-40 -66.96 -34.77 78.48 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.781 0.324 . . . . 10.0 110.403 179.017 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 16.3 mttp -72.96 -38.52 66.71 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.283 -1.006 . . . . 10.0 108.283 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.42 -53.84 49.04 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 114.97 -1.014 . . . . 10.0 109.732 178.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 6.5 p -64.12 -36.41 83.94 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.193 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 237' ' ' GLU . . . . . 0.472 ' HA ' ' HD2' ' A' ' 240' ' ' ARG . 36.7 tt0 -59.05 -46.28 88.63 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 109.086 -0.709 . . . . 10.0 109.086 178.259 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -63.41 -44.69 96.4 Favored Glycine 0 N--CA 1.442 -0.906 0 N-CA-C 109.582 -1.407 . . . . 10.0 109.582 178.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 239' ' ' LEU . . . . . 0.5 ' HA ' ' HB2' ' A' ' 242' ' ' GLU . 94.3 mt -63.09 -31.96 73.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.762 -0.219 . . . . 10.0 111.167 179.031 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 240' ' ' ARG . . . . . 0.472 ' HD2' ' HA ' ' A' ' 237' ' ' GLU . 49.2 mtt180 -66.18 -41.13 90.7 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.484 -0.562 . . . . 10.0 109.484 178.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -78.52 -25.01 45.46 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.259 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 242' ' ' GLU . . . . . 0.5 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 8.1 mt-10 -76.68 -62.62 1.57 Allowed 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.473 -0.785 . . . . 10.0 110.199 178.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 243' ' ' MET . . . . . 0.593 ' HA ' ' HB3' ' A' ' 246' ' ' ASP . 93.1 mmm -56.79 -30.56 63.8 Favored 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 113.25 0.833 . . . . 10.0 113.25 -178.502 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 3.1 p -63.38 -50.97 67.82 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.404 -0.518 . . . . 10.0 109.761 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -74.98 -33.1 61.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.044 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 246' ' ' ASP . . . . . 0.593 ' HB3' ' HA ' ' A' ' 243' ' ' MET . 11.6 t70 -59.74 -59.38 5.53 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.125 178.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.25 -35.42 78.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.878 -0.601 . . . . 10.0 111.114 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -61.89 -45.82 92.09 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 120.67 0.271 . . . . 10.0 110.585 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -72.19 -38.36 69.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.05 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 250' ' ' VAL . . . . . 0.645 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 41.3 t -61.81 -39.33 83.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.92 -0.4 . . . . 10.0 109.92 178.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -75.29 -46.61 32.4 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.869 0.366 . . . . 10.0 110.769 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.33 74.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.526 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -90.2 -20.08 23.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.327 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.645 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -62.23 -29.9 47.67 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.206 0 N-CA-C 109.997 -0.371 . . . . 10.0 109.997 179.317 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -64.2 3.36 Favored Pre-proline 0 C--O 1.219 -0.513 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.147 178.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -59.87 -31.76 94.29 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 121.73 1.62 . . . . 10.0 111.548 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -61.21 -57.7 11.35 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.008 0.432 . . . . 10.0 109.895 178.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 96.3 mt -73.1 -38.56 66.3 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.822 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -58.42 -49.18 78.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.761 0.315 . . . . 10.0 110.448 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.48 -45.53 92.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.839 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 261' ' ' PHE . . . . . 0.403 ' HD1' ' HA ' ' A' ' 261' ' ' PHE . 6.1 m-85 -63.72 -37.56 87.83 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 116.059 -0.518 . . . . 10.0 111.106 179.33 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -69.6 -39.94 76.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.682 0.277 . . . . 10.0 110.266 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 48.7 mttp -64.27 -42.88 96.24 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 177.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.479 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 14.1 mptt -65.05 -44.5 88.8 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 178.167 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 6.7 t90 -60.6 -36.62 79.01 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.685 -0.689 . . . . 10.0 110.24 179.555 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -61.99 -49.89 74.27 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.733 -0.84 . . . . 10.0 108.733 178.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -59.85 -43.79 94.45 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.753 -0.658 . . . . 10.0 109.344 178.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 268' ' ' GLU . . . . . 0.479 ' HG3' ' O ' ' A' ' 264' ' ' LYS . 27.4 mt-10 -61.09 -47.24 87.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.596 -0.729 . . . . 10.0 111.258 179.766 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 95.6 mmm -71.43 -43.66 66.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.811 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -61.61 -48.16 82.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.903 0.382 . . . . 10.0 110.248 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 69.4 mt -67.23 -23.59 65.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.5 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 272' ' ' TYR . . . . . 0.455 ' O ' HG23 ' A' ' 276' ' ' VAL . 0.1 OUTLIER -74.75 -51.51 13.98 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 177.971 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 45.0 mtt85 -60.4 -41.28 93.54 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.668 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.05 -20.54 58.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.611 -0.722 . . . . 10.0 111.063 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.666 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 47.5 mttp -103.19 -41.09 6.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.643 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 276' ' ' VAL . . . . . 0.568 ' O ' ' HB2' ' A' ' 280' ' ' ARG . 38.5 t -47.11 -43.18 7.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 112.432 0.531 . . . . 10.0 112.432 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 63.9 mt-10 -64.3 -63.78 3.45 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 112.755 0.65 . . . . 10.0 112.755 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.37 -36.15 88.27 Favored 'Trans proline' 0 C--N 1.357 0.982 0 C-N-CA 121.807 1.671 . . . . 10.0 111.998 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.681 HD22 ' HE2' ' C' ' 495' ' ' LYS . 23.1 mt -67.63 -31.57 71.68 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 110.005 -0.368 . . . . 10.0 110.005 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 280' ' ' ARG . . . . . 0.568 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 5.9 mtt180 -72.89 -35.85 67.19 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -58.96 -46.66 87.5 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.5 -0.555 . . . . 10.0 109.5 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -65.0 -40.63 95.23 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 178.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -43.41 97.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.42 -0.809 . . . . 10.0 109.696 179.327 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 284' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 280' ' ' ARG . 79.0 mt-30 -69.6 -44.93 69.74 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.536 179.577 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -60.79 -49.73 76.3 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 110.177 -0.305 . . . . 10.0 110.177 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -59.47 -42.43 97.58 Favored Glycine 0 N--CA 1.443 -0.843 0 N-CA-C 110.863 -0.895 . . . . 10.0 110.863 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -66.1 -44.58 83.94 Favored 'General case' 0 C--O 1.223 -0.334 0 O-C-N 123.539 0.199 . . . . 10.0 110.814 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 37.1 mtt180 -58.89 -46.74 87.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.906 0.384 . . . . 10.0 110.194 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -61.72 -47.55 84.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.525 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 290' ' ' LYS . . . . . 0.518 ' HE3' ' HA2' ' C' ' 484' ' ' GLY . 0.1 OUTLIER -59.97 -44.06 94.71 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.266 179.306 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 291' ' ' LEU . . . . . 0.478 ' O ' ' HG3' ' A' ' 295' ' ' GLN . 77.0 mt -60.25 -40.23 89.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.275 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -64.62 -47.68 77.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.015 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -64.52 -31.0 72.03 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.072 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 39.6 mt -72.2 -40.97 67.48 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.881 -0.6 . . . . 10.0 109.575 178.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 295' ' ' GLN . . . . . 0.478 ' HG3' ' O ' ' A' ' 291' ' ' LEU . 69.2 mt-30 -60.55 -36.18 77.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.234 0.54 . . . . 10.0 109.666 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -72.4 3.77 4.44 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.667 179.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 297' ' ' LYS . . . . . 0.6 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 45.2 mttp -126.24 -24.69 3.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.567 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 82.6 mt -76.54 -33.08 58.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.631 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 299' ' ' SER . . . . . 0.778 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 4.5 m -89.66 -61.6 0.22 Allowed Pre-proline 0 CA--C 1.538 0.513 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.815 179.128 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 300' ' ' PRO . . . . . 0.778 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 52.7 Cg_exo -59.05 -63.86 0.12 Allowed 'Trans proline' 0 C--N 1.357 0.986 0 C-N-CA 122.4 2.067 . . . . 10.0 112.244 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.6 ' HB2' ' O ' ' A' ' 297' ' ' LYS . 88.4 mt -63.17 -25.86 68.54 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.414 179.293 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -68.17 -49.03 49.43 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 110.1 -1.2 . . . . 10.0 110.1 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -63.44 -35.75 81.47 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.912 -0.403 . . . . 10.0 109.912 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -64.3 -45.12 89.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.095 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.7 ttt -67.47 -33.77 75.79 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.094 -0.706 . . . . 10.0 109.094 178.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 306' ' ' ARG . . . . . 0.471 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 95.3 mtt180 -64.19 -44.2 92.72 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.165 -0.68 . . . . 10.0 109.165 178.038 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 307' ' ' ASP . . . . . 0.428 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 18.4 t70 -65.58 -42.42 91.78 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.269 179.262 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 308' ' ' ARG . . . . . 1.103 ' HG3' HD21 ' C' ' 469' ' ' LEU . 11.4 mmt180 -62.6 -37.57 86.76 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 178.156 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 309' ' ' ALA . . . . . 0.533 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -67.22 -35.99 80.76 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 115.844 -0.616 . . . . 10.0 109.713 178.101 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 310' ' ' ARG . . . . . 0.471 ' HG3' ' O ' ' A' ' 306' ' ' ARG . 54.5 mtt180 -60.92 -50.86 71.71 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.72 -0.844 . . . . 10.0 108.72 178.461 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.33 -37.51 87.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.741 178.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 312' ' ' HIS . . . . . 0.681 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 0.3 OUTLIER -57.85 -55.29 36.81 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.202 178.758 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 87.5 t -71.28 -40.04 73.34 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.264 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.608 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 314' ' ' ASP . . . . . 0.639 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 36.7 t70 -60.57 -47.82 84.5 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.978 -0.289 . . . . 10.0 110.366 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -64.95 -28.32 69.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.358 0.599 . . . . 10.0 109.398 178.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 316' ' ' LEU . . . . . 0.537 ' HG ' ' HE3' ' C' ' 462' ' ' LYS . 8.9 mt -71.2 -39.88 71.52 Favored 'General case' 0 C--O 1.216 -0.698 0 N-CA-C 108.744 -0.836 . . . . 10.0 108.744 177.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.639 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 81.5 mtt180 -61.45 -43.92 98.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.356 -0.383 . . . . 10.0 110.398 179.524 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -15.66 63.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.847 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -106.17 -39.08 6.07 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.504 -0.317 . . . . 10.0 111.756 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 50.2 mt -60.15 -36.25 77.11 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 122.251 0.22 . . . . 10.0 111.132 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 321' ' ' ALA . . . . . 0.401 ' HB3' ' CD ' ' A' ' 322' ' ' PRO . . . -60.75 -62.06 6.72 Favored Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.657 179.064 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.401 ' CD ' ' HB3' ' A' ' 321' ' ' ALA . 15.7 Cg_endo -60.78 -33.83 92.41 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.709 1.606 . . . . 10.0 110.899 178.028 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 323' ' ' TYR . . . . . 0.473 ' O ' ' HG ' ' A' ' 327' ' ' LEU . 6.7 m-30 -60.33 -49.77 76.26 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 178.632 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 32.6 m -66.59 -37.77 85.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.172 179.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 325' ' ' ASP . . . . . 0.525 ' O ' ' HG3' ' A' ' 329' ' ' GLN . 0.8 OUTLIER -65.41 -41.26 93.78 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.919 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 326' ' ' GLU . . . . . 0.483 ' HB3' ' OE1' ' C' ' 447' ' ' GLU . 56.5 mt-10 -66.0 -37.38 85.79 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.778 -0.823 . . . . 10.0 108.778 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 327' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 323' ' ' TYR . 51.4 mt -61.77 -37.08 82.98 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.03 178.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -64.32 -40.79 96.61 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 329' ' ' GLN . . . . . 0.525 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 77.8 mt-30 -62.16 -42.67 99.48 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 178.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 330' ' ' ARG . . . . . 0.645 ' O ' ' HG2' ' A' ' 334' ' ' ARG . 59.8 mtt180 -65.48 -50.6 64.74 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 115.512 -0.767 . . . . 10.0 109.671 178.324 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 331' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 331' ' ' LEU . 1.9 mm? -55.87 -40.5 73.02 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.923 -0.581 . . . . 10.0 110.587 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.24 -45.46 94.42 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -64.42 -45.83 85.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.267 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 334' ' ' ARG . . . . . 0.694 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 7.6 mmt85 -61.35 -46.19 91.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.54 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 335' ' ' LEU . . . . . 0.435 ' O ' ' HG3' ' A' ' 339' ' ' LYS . 64.5 mt -62.18 -41.99 98.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.962 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -61.08 -42.38 98.4 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 178.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.26 -40.39 86.2 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 338' ' ' LEU . . . . . 0.584 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 78.2 mt -67.75 -20.72 65.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.125 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 339' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 335' ' ' LEU . 71.4 mttt -87.35 -47.68 8.6 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 178.648 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -67.97 -62.33 1.45 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.958 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -68.76 -39.09 80.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.285 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 342' ' ' GLY . . . . . 0.584 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -60.5 -43.63 98.61 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.934 -0.65 . . . . 10.0 111.74 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -64.79 -43.36 96.31 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 110.415 -1.074 . . . . 10.0 110.415 178.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -62.93 -40.43 97.6 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.413 -0.588 . . . . 10.0 109.413 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -60.21 -44.48 95.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.073 -0.967 . . . . 10.0 109.863 178.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 73.7 mt -64.68 -40.48 95.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.121 179.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -63.31 -45.81 89.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.73 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.02 -42.74 97.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.934 -0.576 . . . . 10.0 109.837 178.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -62.43 -41.67 98.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.114 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -65.37 -41.66 93.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.382 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.89 -48.46 80.37 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.642 -0.503 . . . . 10.0 109.642 178.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 352' ' ' LYS . . . . . 0.683 ' NZ ' ' HB2' ' C' ' 425' ' ' GLU . 47.6 mttm -62.43 -41.51 98.76 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.494 -0.775 . . . . 10.0 110.295 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 353' ' ' ALA . . . . . 0.406 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -62.78 -45.76 91.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.196 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 28.8 m -61.38 -45.51 94.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.892 -0.594 . . . . 10.0 110.67 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 355' ' ' GLU . . . . . 0.519 ' HA ' ' OE1' ' A' ' 355' ' ' GLU . 7.2 mm-40 -71.53 -31.19 66.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.003 0.43 . . . . 10.0 111.366 179.247 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 356' ' ' HIS . . . . . 0.427 ' HA ' ' OG1' ' A' ' 359' ' ' THR . 38.5 t-80 -72.39 -25.39 61.48 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 40.9 mt -71.88 -39.84 69.35 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.252 -0.648 . . . . 10.0 109.252 178.336 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -44.12 88.03 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 178.419 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 359' ' ' THR . . . . . 0.427 ' OG1' ' HA ' ' A' ' 356' ' ' HIS . 1.1 p -70.71 -20.57 62.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.723 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 360' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 360' ' ' LEU . 9.3 mt -80.38 -39.24 28.79 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.642 -0.873 . . . . 10.0 108.642 177.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 16.2 m -66.54 -31.78 72.71 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.534 -0.913 . . . . 10.0 108.534 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 362' ' ' GLU . . . . . 0.51 ' HB3' ' HD3' ' C' ' 414' ' ' LYS . 46.0 mm-40 -75.06 9.01 2.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.086 -0.961 . . . . 10.0 110.782 178.565 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.58 ' HG2' HG22 ' C' ' 411' ' ' THR . 63.1 mttp -128.33 -46.69 1.33 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.268 -1.012 . . . . 10.0 108.268 178.186 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -67.61 -7.3 25.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.458 -0.792 . . . . 10.0 112.518 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.488 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 96.4 mttt -106.42 -66.96 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.526 0 C-N-CA 120.95 -0.3 . . . . 10.0 111.806 178.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.488 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 40.1 Cg_endo -66.28 -47.59 3.16 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 121.58 1.52 . . . . 10.0 112.557 -178.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 367' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -65.08 -38.98 92.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.506 0.193 . . . . 10.0 111.122 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 1.5 mt -68.47 -39.85 81.24 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.701 -0.4 . . . . 10.0 110.065 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 369' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 27.5 mt-10 -68.96 -35.38 76.68 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.557 -0.535 . . . . 10.0 109.557 178.577 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -47.21 81.82 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.855 -1.165 . . . . 10.0 107.855 177.574 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 371' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 367' ' ' ALA . 65.3 mt -62.28 -41.19 98.27 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.311 -0.859 . . . . 10.0 110.775 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 372' ' ' ARG . 52.4 mtt180 -63.39 -43.34 97.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.114 0.483 . . . . 10.0 110.035 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.5 mt-30 -68.13 -21.06 64.95 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.439 -0.8 . . . . 20.0 111.869 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -93.24 -37.35 5.66 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.821 -0.912 . . . . 10.0 110.821 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 18.5 mt -59.52 -37.52 78.55 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.306 0.484 . . . . 10.0 112.306 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 376' ' ' LEU . . . . . 0.447 ' HB2' ' CD ' ' A' ' 377' ' ' PRO . 81.8 mt -58.85 -62.33 5.97 Favored Pre-proline 0 CA--C 1.535 0.378 0 N-CA-C 111.734 0.272 . . . . 10.0 111.734 179.805 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.447 ' CD ' ' HB2' ' A' ' 376' ' ' LEU . 29.6 Cg_endo -63.68 -35.17 59.75 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.012 1.808 . . . . 10.0 112.044 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 15.6 t -64.46 -47.25 90.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-O 120.645 0.26 . . . . 10.0 110.581 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 379' ' ' LEU . . . . . 0.442 HD21 ' H52' ' A' ' 38' ' ' 17F . 18.3 mt -63.92 -32.3 73.78 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.655 -0.498 . . . . 10.0 109.655 178.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -69.87 -46.96 64.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.429 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.1 p -62.49 -36.85 83.82 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.187 -0.672 . . . . 10.0 109.187 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -68.47 -45.85 71.33 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.339 -0.846 . . . . 10.0 109.845 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 25.3 mtmt -60.17 -45.44 93.09 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.991 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 70.8 t -59.7 -44.63 94.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 109.752 -0.462 . . . . 10.0 109.752 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 27.9 m -65.93 -40.55 91.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.493 178.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 386' ' ' PHE . . . . . 0.443 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 7.4 m-30 -65.23 -48.0 74.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.764 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 75.1 mt -58.77 -48.67 80.43 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.256 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 388' ' ' SER . . . . . 0.406 ' HB2' ' NZ ' ' C' ' 594' ' ' LYS . 18.3 p -66.44 -25.52 66.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.519 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -82.0 -42.07 19.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.41 179.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 390' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 84.5 mt -58.48 -41.37 85.14 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.41 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -64.45 -36.36 83.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.245 178.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.79 -43.28 84.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.039 0.447 . . . . 10.0 110.954 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -56.84 -52.43 65.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.761 -0.654 . . . . 10.0 111.009 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 394' ' ' THR . . . . . 1.27 HG22 ' CG ' ' A' ' 398' ' ' ASN . 0.9 OUTLIER -69.32 -22.47 63.77 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.838 0.352 . . . . 10.0 111.234 -179.633 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -68.1 -37.67 81.45 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.324 -0.398 . . . . 10.0 111.069 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 396' ' ' LYS . . . . . 0.641 ' HE3' ' HA ' ' C' ' 587' ' ' ALA . 3.7 mptp? -91.89 -38.58 12.22 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.956 0.408 . . . . 10.0 111.953 -179.222 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 9.4 mp -75.97 -36.33 59.3 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.2 -0.455 . . . . 10.0 111.689 -178.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 398' ' ' ASN . . . . . 1.27 ' CG ' HG22 ' A' ' 394' ' ' THR . 9.5 m120 . . . . . 0 N--CA 1.465 0.282 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.172 -179.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 1.1 mm? . . . . . 0 N--CA 1.464 0.243 0 CA-C-O 121.052 0.453 . . . . 10.0 110.677 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 12.6 mtmt -84.89 45.54 1.17 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.848 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 6.8 mp -63.1 -31.36 72.48 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.771 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 402' ' ' LEU . . . . . 0.44 HD23 ' H ' ' C' ' 402' ' ' LEU . 0.3 OUTLIER -65.43 -37.34 86.63 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.392 -0.822 . . . . 10.0 110.386 179.617 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.4 -38.6 74.69 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -68.22 -36.34 79.35 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.118 -0.697 . . . . 10.0 109.118 178.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 68.9 t90 -66.49 -36.7 83.38 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.419 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -60.68 -46.39 90.53 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.939 -0.573 . . . . 10.0 109.96 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -32.81 74.69 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.129 0.49 . . . . 10.0 109.979 179.19 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 36.0 t -67.9 -37.61 78.7 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.089 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 177.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 21.8 m -68.52 -42.13 78.93 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.684 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.98 -43.36 88.03 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.897 -0.321 . . . . 10.0 110.538 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 411' ' ' THR . . . . . 0.58 HG22 ' HG2' ' A' ' 363' ' ' LYS . 7.4 p -65.7 -38.14 88.4 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.409 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.58 -40.1 88.77 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.156 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 30.8 m -62.52 -44.67 95.79 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 178.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 414' ' ' LYS . . . . . 0.51 ' HD3' ' HB3' ' A' ' 362' ' ' GLU . 89.8 mttt -69.43 -25.29 64.04 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.137 178.649 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.0 -36.38 67.01 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.998 -1.112 . . . . 10.0 107.998 177.648 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -72.68 -23.6 60.9 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.235 -0.893 . . . . 10.0 110.191 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 417' ' ' GLU . . . . . 0.512 ' O ' ' HD2' ' C' ' 421' ' ' PRO . 78.4 mt-10 -64.33 -38.83 92.41 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 107.923 -1.14 . . . . 10.0 107.923 176.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 418' ' ' GLN . . . . . 0.73 ' O ' ' HB ' ' C' ' 422' ' ' VAL . 1.4 mt-30 -69.36 -30.19 68.14 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 115.103 -0.953 . . . . 10.0 109.057 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 88.5 mt -72.3 -1.74 16.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.633 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -92.82 -93.29 1.47 Allowed Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.748 -0.739 . . . . 10.0 111.483 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 421' ' ' PRO . . . . . 0.512 ' HD2' ' O ' ' C' ' 417' ' ' GLU . 9.6 Cg_endo -52.94 -46.03 36.73 Favored 'Trans proline' 0 N--CA 1.473 0.3 0 C-N-CA 123.321 2.681 . . . . 10.0 113.172 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 422' ' ' VAL . . . . . 0.73 ' HB ' ' O ' ' C' ' 418' ' ' GLN . 67.6 t -55.08 -42.47 65.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.429 0.157 . . . . 10.0 111.178 -179.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 2.8 m -72.71 -34.42 67.11 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.962 0.411 . . . . 10.0 110.069 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -61.7 -52.84 62.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.946 -0.57 . . . . 10.0 109.782 178.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 425' ' ' GLU . . . . . 0.683 ' HB2' ' NZ ' ' A' ' 352' ' ' LYS . 0.4 OUTLIER -68.51 -19.38 64.52 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.925 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -70.8 -42.79 69.86 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.292 -1.003 . . . . 10.0 108.292 178.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 18.9 m0 -69.4 -33.71 73.41 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.691 -0.855 . . . . 10.0 108.691 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 428' ' ' ASP . . . . . 0.478 ' O ' ' HB2' ' C' ' 431' ' ' GLU . 12.6 t70 -67.89 -41.83 82.13 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.772 -0.825 . . . . 10.0 108.772 177.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -63.95 -38.79 92.37 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.572 -0.899 . . . . 10.0 108.572 177.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 30.1 mt -66.6 -27.78 67.98 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.707 -0.678 . . . . 10.0 109.986 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 431' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' C' ' 428' ' ' ASP . 18.3 mm-40 -68.18 -38.81 82.44 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 107.705 -1.22 . . . . 10.0 107.705 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -68.57 -41.83 79.18 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.52 -0.919 . . . . 10.0 108.52 177.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 56.3 mm-40 -58.96 -53.76 54.78 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 115.353 -0.84 . . . . 10.0 109.886 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 16.4 p -63.52 -37.05 85.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 10.0 112.073 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -69.59 -45.4 68.72 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -63.95 -48.47 75.7 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.271 -1.132 . . . . 10.0 110.271 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 20.4 mt -62.58 -28.47 69.9 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 109.974 -0.38 . . . . 10.0 109.974 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 438' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' C' ' 438' ' ' ARG . 7.6 mtt180 -65.3 -42.88 92.63 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 178.512 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -65.22 -44.34 88.55 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 440' ' ' GLU . . . . . 0.694 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 45.5 mt-10 -62.65 -55.17 29.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.434 -0.803 . . . . 10.0 110.375 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 87.0 mmm -59.61 -45.7 91.15 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 112.972 0.73 . . . . 10.0 112.972 -179.108 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 15.8 p -57.28 -51.18 70.39 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.913 -0.315 . . . . 10.0 111.08 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -65.84 -46.18 79.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.726 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 444' ' ' ASP . . . . . 0.654 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 0.1 OUTLIER -60.18 -43.57 95.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.214 -179.808 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 445' ' ' LEU . . . . . 0.467 ' O ' HG12 ' C' ' 448' ' ' VAL . 63.3 mt -70.69 -45.06 65.7 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.673 0.273 . . . . 10.0 111.175 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -59.98 -45.21 93.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.126 0.488 . . . . 10.0 110.345 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 447' ' ' GLU . . . . . 0.503 ' OE1' ' HE2' ' C' ' 451' ' ' LYS . 4.5 tt0 -74.87 -26.8 59.93 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.454 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 448' ' ' VAL . . . . . 0.654 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.3 OUTLIER -66.91 -35.0 73.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.769 0.319 . . . . 10.0 110.383 179.488 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -70.47 -34.0 71.91 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.48 -0.933 . . . . 10.0 108.48 177.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -82.2 -1.45 49.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.034 -0.984 . . . . 10.0 109.95 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 451' ' ' LYS . . . . . 0.503 ' HE2' ' OE1' ' C' ' 447' ' ' GLU . 14.3 mttm -105.5 -44.41 4.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.603 -0.726 . . . . 10.0 109.055 178.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 452' ' ' VAL . . . . . 0.431 HG23 ' O ' ' C' ' 448' ' ' VAL . 53.6 t -61.07 -34.95 62.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.894 -0.593 . . . . 10.0 110.376 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -56.99 -62.46 5.11 Favored Pre-proline 0 CA--C 1.537 0.469 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.148 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -65.5 -29.25 53.23 Favored 'Trans proline' 0 C--N 1.36 1.164 0 C-N-CA 121.6 1.534 . . . . 10.0 111.08 178.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 455' ' ' TYR . . . . . 0.403 ' HB2' ' HA ' ' C' ' 452' ' ' VAL . 0.4 OUTLIER -61.32 -56.0 25.34 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 178.67 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 41.9 mt -61.05 -40.86 95.22 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.424 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -59.59 -50.31 74.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.804 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -72.12 -37.29 69.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.776 -178.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -65.17 -47.62 76.34 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -67.11 -32.33 73.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.26 -0.427 . . . . 10.0 109.948 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 461' ' ' LYS . . . . . 0.409 ' HE3' ' HB2' ' C' ' 461' ' ' LYS . 0.4 OUTLIER -63.15 -52.16 63.57 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.979 -0.748 . . . . 10.0 108.979 178.444 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 462' ' ' LYS . . . . . 0.537 ' HE3' ' HG ' ' A' ' 316' ' ' LEU . 22.7 mttm -66.34 -34.32 77.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.188 -0.915 . . . . 10.0 110.108 179.146 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 6.9 m95 -68.64 -32.54 72.46 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.239 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 464' ' ' GLN . . . . . 0.454 ' O ' ' HG3' ' C' ' 468' ' ' GLU . 13.6 mm-40 -66.85 -44.26 81.48 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 107.875 -1.157 . . . . 10.0 107.875 177.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 0.681 ' HB2' ' HE1' ' A' ' 312' ' ' HIS . 29.6 mt-10 -62.78 -41.79 99.4 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.833 -0.802 . . . . 10.0 108.833 177.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.55 -44.03 95.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.971 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 9.0 mmt -61.26 -44.44 97.24 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.57 -0.53 . . . . 10.0 109.57 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 468' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' C' ' 464' ' ' GLN . 50.9 mt-10 -61.89 -52.55 63.64 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.955 -0.757 . . . . 10.0 108.955 178.112 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 1.103 HD21 ' HG3' ' A' ' 308' ' ' ARG . 96.2 mt -54.6 -49.21 70.99 Favored 'General case' 0 C--O 1.225 -0.187 0 CA-C-N 115.62 -0.718 . . . . 20.0 111.474 179.4 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -60.49 -45.7 92.83 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 116.42 -0.355 . . . . 10.0 111.093 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -68.17 -46.16 71.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.608 0.242 . . . . 10.0 111.286 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -69.07 -15.94 63.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.798 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 473' ' ' LYS . . . . . 0.619 ' O ' ' HB2' ' C' ' 477' ' ' LEU . 65.2 mttt -97.31 -51.96 3.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.154 178.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 24.7 t -59.44 -39.08 78.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.107 -0.497 . . . . 10.0 112.049 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -54.86 -63.77 2.61 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 112.238 0.458 . . . . 10.0 112.238 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -68.86 -27.49 30.9 Favored 'Trans proline' 0 C--N 1.354 0.866 0 C-N-CA 121.823 1.682 . . . . 10.0 111.141 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 477' ' ' LEU . . . . . 0.619 ' HB2' ' O ' ' C' ' 473' ' ' LYS . 10.4 tp -65.3 -51.5 60.28 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 478' ' ' ARG . . . . . 0.508 ' HA ' ' HB2' ' C' ' 481' ' ' LEU . 61.0 mtt180 -67.21 -31.61 72.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.607 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -63.85 -45.49 89.27 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.381 -0.6 . . . . 10.0 109.381 178.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.84 -30.46 56.35 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.298 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 481' ' ' LEU . . . . . 0.508 ' HB2' ' HA ' ' C' ' 478' ' ' ARG . 20.4 mt -69.47 -40.77 76.9 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 109.679 -0.489 . . . . 10.0 109.679 178.558 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -67.02 -46.07 75.61 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.826 -0.435 . . . . 10.0 109.826 178.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -64.6 -41.46 96.2 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.798 -0.816 . . . . 10.0 108.798 178.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 484' ' ' GLY . . . . . 0.518 ' HA2' ' HE3' ' A' ' 290' ' ' LYS . . . -64.42 -40.07 97.45 Favored Glycine 0 N--CA 1.443 -0.869 0 N-CA-C 110.88 -0.888 . . . . 10.0 110.88 178.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.39 -38.62 81.49 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 109.465 -0.569 . . . . 10.0 109.465 178.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -63.41 -43.71 96.71 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 108.797 -0.816 . . . . 10.0 108.797 178.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -65.04 -41.66 95.0 Favored 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 109.203 -0.666 . . . . 10.0 109.203 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 488' ' ' LYS . . . . . 0.479 ' HD2' ' HA ' ' C' ' 488' ' ' LYS . 28.4 tptt -65.41 -42.4 92.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.085 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 67.7 mt -65.87 -43.66 87.73 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -61.55 -45.88 92.28 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.497 -0.927 . . . . 10.0 108.497 178.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 491' ' ' GLU . . . . . 0.76 ' HG2' ' HE3' ' C' ' 495' ' ' LYS . 6.8 tt0 -57.19 -51.96 67.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.875 -1.057 . . . . 10.0 109.03 178.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 78.6 mt -63.93 -42.22 97.42 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.865 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -61.36 -44.28 97.45 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.612 0.244 . . . . 10.0 111.233 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -72.08 -2.05 17.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.009 0.433 . . . . 10.0 111.253 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.76 ' HE3' ' HG2' ' C' ' 491' ' ' GLU . 93.1 mttt -111.31 -47.42 3.19 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.91 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 93.7 mt -64.93 -28.29 69.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.729 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 497' ' ' SER . . . . . 0.506 ' O ' ' HG3' ' C' ' 501' ' ' GLU . 46.8 m -68.25 -62.17 3.35 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 120.791 -0.363 . . . . 10.0 110.832 178.601 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -62.19 -38.42 55.62 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.63 1.554 . . . . 10.0 111.288 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 499' ' ' LEU . . . . . 0.522 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 13.0 mt -70.58 -32.39 69.76 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.581 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -63.65 -48.18 79.8 Favored Glycine 0 N--CA 1.449 -0.441 0 N-CA-C 110.807 -0.917 . . . . 10.0 110.807 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 501' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' C' ' 497' ' ' SER . 27.6 mt-10 -63.05 -39.94 96.24 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 178.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 502' ' ' GLU . . . . . 0.808 ' HG2' ' HE ' ' C' ' 506' ' ' ARG . 27.4 tt0 -64.61 -45.53 86.51 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.039 179.128 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 503' ' ' MET . . . . . 0.663 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 85.2 mmm -60.62 -35.74 76.91 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.624 -0.51 . . . . 10.0 109.624 178.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 55.4 mtt180 -67.66 -41.58 83.56 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -63.13 -42.42 99.51 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.999 -0.741 . . . . 10.0 108.999 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.808 ' HE ' ' HG2' ' C' ' 502' ' ' GLU . 43.5 mtt180 -62.43 -47.32 84.6 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.148 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.45 -46.14 89.6 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 115.318 -0.856 . . . . 10.0 110.479 179.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -61.45 -46.03 91.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.784 0.326 . . . . 10.0 110.19 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 509' ' ' ALA . . . . . 0.452 ' HB1' ' CE ' ' A' ' 264' ' ' LYS . . . -63.96 -36.15 83.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.634 179.421 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -76.0 -45.9 32.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.839 179.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 76.3 t -67.45 -43.38 87.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.619 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.402 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 8.4 t70 -64.56 -35.84 82.29 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.025 -0.732 . . . . 10.0 109.025 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.62 -44.39 86.66 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 107.316 -1.365 . . . . 10.0 107.316 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 50.9 mt -59.8 -35.42 74.64 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.24 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 515' ' ' ARG . . . . . 0.402 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 67.6 mtt180 -62.02 -49.35 76.36 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.638 -0.504 . . . . 10.0 109.638 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 4.7 p -81.81 6.15 16.48 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.899 -0.591 . . . . 10.0 111.865 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 517' ' ' HIS . . . . . 0.504 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 2.2 m-70 -116.96 -45.86 2.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.857 0.36 . . . . 10.0 110.954 179.712 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 97.8 mt -76.04 -38.23 57.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.481 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -58.47 -58.66 17.41 Favored Pre-proline 0 CA--C 1.533 0.315 0 N-CA-C 111.658 0.244 . . . . 10.0 111.658 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.55 -37.5 58.08 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 121.518 1.479 . . . . 10.0 111.094 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 521' ' ' TYR . . . . . 0.504 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 16.4 t80 -60.58 -47.54 85.76 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.802 0.334 . . . . 10.0 110.28 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 34.9 m -69.4 -32.35 71.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.066 -0.515 . . . . 10.0 109.94 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 523' ' ' ASP . . . . . 0.675 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 22.6 t70 -67.31 -41.65 85.0 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.288 -0.634 . . . . 10.0 109.288 178.283 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -63.74 -38.82 92.52 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 107.971 -1.122 . . . . 10.0 107.971 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 525' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' C' ' 521' ' ' TYR . 79.7 mt -65.15 -31.64 72.93 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 115.142 -0.935 . . . . 10.0 110.061 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 526' ' ' ARG . . . . . 0.675 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 66.3 mtt180 -63.39 -34.24 77.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.169 0.509 . . . . 10.0 109.706 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -80.04 -48.0 13.99 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.023 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 50.8 mtt180 -64.84 -50.86 64.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.738 -0.665 . . . . 10.0 111.835 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 70.5 mt -60.62 -33.03 72.16 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.329 -0.249 . . . . 10.0 110.329 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -66.55 -39.58 88.61 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.944 -0.761 . . . . 10.0 108.944 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.27 -41.39 81.11 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 109.216 -0.661 . . . . 10.0 109.216 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -60.89 -43.99 97.73 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.33 -0.85 . . . . 10.0 108.8 178.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 60.0 mt -67.97 -34.62 76.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.679 -0.692 . . . . 10.0 110.078 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.41 -42.63 99.58 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.179 -0.675 . . . . 10.0 109.179 178.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -66.92 -43.6 82.86 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.176 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 88.5 mt -66.02 -24.8 66.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.758 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -80.18 -42.85 22.61 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.78 -0.452 . . . . 10.0 109.78 178.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -67.68 -47.76 68.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.366 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -74.22 -35.87 63.9 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.426 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -63.94 -46.59 91.12 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.423 -1.071 . . . . 10.0 110.423 178.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.62 -41.96 99.75 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 110.5 -1.04 . . . . 10.0 110.5 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 542' ' ' ALA . . . . . 0.469 ' O ' ' HG3' ' C' ' 546' ' ' GLU . . . -62.73 -53.07 59.99 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 543' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' C' ' 543' ' ' ARG . 54.3 mtt85 -52.99 -46.81 68.49 Favored 'General case' 0 C--O 1.221 -0.427 0 O-C-N 123.781 0.676 . . . . 10.0 110.784 179.135 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 544' ' ' LEU . . . . . 0.648 ' O ' ' HB2' ' C' ' 548' ' ' HIS . 54.6 mt -59.34 -42.77 92.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.462 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -71.86 -42.85 66.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.756 0.312 . . . . 10.0 110.842 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 546' ' ' GLU . . . . . 0.577 ' O ' ' HD2' ' C' ' 550' ' ' LYS . 52.0 mt-10 -66.81 -52.72 40.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.633 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 547' ' ' TYR . . . . . 0.839 ' HA ' ' HB2' ' C' ' 550' ' ' LYS . 21.2 m-30 -65.45 -20.25 66.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.643 0.259 . . . . 10.0 111.174 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 548' ' ' HIS . . . . . 0.648 ' HB2' ' O ' ' C' ' 544' ' ' LEU . 2.8 t-80 -68.33 -39.4 81.96 Favored 'General case' 0 CA--C 1.519 -0.25 0 N-CA-C 107.619 -1.252 . . . . 10.0 107.619 177.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 549' ' ' ALA . . . . . 0.574 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -78.13 -32.74 50.53 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.15 -0.932 . . . . 10.0 108.768 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 550' ' ' LYS . . . . . 0.839 ' HB2' ' HA ' ' C' ' 547' ' ' TYR . 0.2 OUTLIER -64.11 -33.89 76.81 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.441 -0.8 . . . . 10.0 109.492 178.448 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.83 -45.51 89.26 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.443 -0.798 . . . . 10.0 109.103 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -33.76 76.48 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.262 179.135 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 553' ' ' GLU . . . . . 0.574 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 89.0 mt-10 -60.8 -37.28 81.41 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 108.49 -0.929 . . . . 10.0 108.49 178.072 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -80.14 -36.19 35.56 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.216 -0.902 . . . . 10.0 110.998 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 65.4 mt -63.75 -41.89 97.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.843 0.354 . . . . 10.0 111.072 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 2.7 p -67.43 -39.68 85.47 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.986 0.422 . . . . 10.0 110.342 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 7.5 p -74.21 -24.75 59.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.919 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 20.5 mt -74.89 -33.05 62.0 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.992 -0.744 . . . . 10.0 108.992 177.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 49.2 m -61.95 -26.82 68.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.298 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -65.34 -17.37 64.47 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-O 121.383 0.611 . . . . 10.0 110.26 178.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 561' ' ' LYS . . . . . 0.408 ' HA ' ' HB3' ' C' ' 565' ' ' ALA . 3.8 mptt -111.15 -35.08 5.99 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.899 179.078 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -63.96 -22.6 66.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.64 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 563' ' ' LYS . . . . . 0.964 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 75.9 mttt -114.15 -70.6 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.49 0 CA-C-O 119.313 -0.375 . . . . 10.0 111.951 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 564' ' ' PRO . . . . . 0.964 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 50.8 Cg_exo -58.43 -51.76 6.8 Favored 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 122.151 1.901 . . . . 10.0 113.2 -179.433 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 565' ' ' ALA . . . . . 0.408 ' HB3' ' HA ' ' C' ' 561' ' ' LYS . . . -63.82 -41.5 97.85 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.065 -0.254 . . . . 10.0 111.408 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 1.1 mt -63.88 -38.52 91.39 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.829 -0.348 . . . . 10.0 110.107 178.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 567' ' ' GLU . . . . . 0.47 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 26.6 mm-40 -66.84 -39.03 87.5 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 178.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.66 -41.16 96.29 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.726 -0.842 . . . . 10.0 108.726 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 51.5 mt -63.15 -42.97 99.54 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.762 178.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -64.9 -43.03 94.2 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.021 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 571' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.6 mt-30 -65.36 -20.53 66.43 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.733 -0.667 . . . . 20.0 111.591 179.107 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -92.86 -38.37 5.5 Favored Glycine 0 CA--C 1.523 0.548 0 N-CA-C 109.397 -1.481 . . . . 10.0 109.397 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 26.4 mt -54.78 -42.71 72.08 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.36 0.504 . . . . 10.0 112.36 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 574' ' ' LEU . . . . . 0.791 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 96.0 mt -58.99 -62.05 6.6 Favored Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 120.811 -0.356 . . . . 10.0 111.709 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 575' ' ' PRO . . . . . 0.791 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 53.0 Cg_exo -58.36 -38.64 89.59 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.231 1.954 . . . . 10.0 111.741 178.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 576' ' ' VAL . . . . . 0.425 HG22 ' HE2' ' A' ' 202' ' ' LYS . 27.3 t -63.31 -46.75 94.73 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-O 120.722 0.296 . . . . 10.0 110.413 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 24.1 mt -64.61 -39.57 93.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.252 -0.277 . . . . 10.0 110.252 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 578' ' ' GLU . . . . . 0.499 ' O ' HG23 ' C' ' 582' ' ' VAL . 24.2 mt-10 -63.15 -48.95 76.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.33 -0.395 . . . . 10.0 110.631 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 23.1 p -65.79 -39.79 91.31 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.768 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.14 -40.77 96.87 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 116.22 -0.445 . . . . 10.0 109.831 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -61.26 -37.77 84.31 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.515 178.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 582' ' ' VAL . . . . . 0.499 HG23 ' O ' ' C' ' 578' ' ' GLU . 86.0 t -62.98 -46.21 96.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.21 -0.45 . . . . 10.0 109.874 179.127 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.17 -34.84 77.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.104 -0.498 . . . . 10.0 111.079 179.288 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -73.62 -44.77 56.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.158 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 15.8 mt -58.41 -47.38 84.1 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.393 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 14.1 p -64.11 -39.89 95.03 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.312 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 587' ' ' ALA . . . . . 0.641 ' HA ' ' HE3' ' A' ' 396' ' ' LYS . . . -62.81 -50.71 69.91 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.998 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 67.9 mt -62.79 -28.64 70.13 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.166 0.432 . . . . 10.0 112.166 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -86.57 -33.15 20.32 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.556 0.576 . . . . 10.0 112.556 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -85.13 -38.7 18.76 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.65 0.611 . . . . 10.0 112.65 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -67.1 -29.24 68.94 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 112.25 0.463 . . . . 10.0 112.25 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.28 -30.21 70.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.848 0.356 . . . . 10.0 110.905 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -63.47 -26.62 68.81 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.928 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 594' ' ' LYS . . . . . 0.406 ' NZ ' ' HB2' ' A' ' 388' ' ' SER . 0.1 OUTLIER -94.97 -4.59 46.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.594 -179.103 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 82.8 mt -98.5 -15.79 19.44 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.359 -0.382 . . . . 10.0 111.398 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 42.8 t30 . . . . . 0 C--O 1.246 0.877 0 CA-C-O 118.412 -0.804 . . . . 10.0 110.229 179.927 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.43 ' N ' ' H51' ' A' ' 9' ' ' PCW . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.241 0 N-CA-C 109.818 -0.438 . . . . 10.0 109.818 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.5 m -109.94 104.59 13.53 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.793 0.33 . . . . 10.0 110.468 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.549 ' OE2' ' H72' ' A' ' 30' ' ' PCW . 17.5 tt0 -99.65 116.32 31.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.45 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -109.51 119.61 39.96 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.582 -179.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.523 ' HE2' ' O4 ' ' A' ' 40' ' ' 17F . 6.8 mptt -93.86 122.89 36.81 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 178.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.617 HD22 HD23 ' B' ' 159' ' ' LEU . 42.4 mt -117.93 124.37 48.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.836 0.351 . . . . 10.0 111.232 -178.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 29.2 t -107.86 114.14 45.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.226 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 26.0 t -91.15 117.09 33.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.36 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 19.1 m -113.68 161.41 12.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.719 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 152.57 172.03 20.65 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 111.321 -0.711 . . . . 10.0 111.321 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.562 ' HB3' HG13 ' B' ' 14' ' ' VAL . . . -66.74 167.05 11.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.189 0.519 . . . . 10.0 112.081 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -67.66 -16.57 67.98 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 115.863 -0.608 . . . . 10.0 113.94 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -115.0 18.72 16.08 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.398 -0.906 . . . . 10.0 113.73 -179.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.562 HG13 ' HB3' ' B' ' 11' ' ' ALA . 35.8 m -80.27 -32.27 13.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 117.691 0.746 . . . . 10.0 112.184 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.69 39.34 2.76 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.782 -0.723 . . . . 10.0 113.129 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -61.14 -47.99 83.67 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.9 p -62.49 -43.28 99.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.517 0.199 . . . . 10.0 111.106 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.01 -47.47 85.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.126 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 35.8 mt -61.82 -44.99 95.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.391 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' THR . . . . . 0.425 ' O ' HG12 ' B' ' 24' ' ' ILE . 6.7 m -65.82 -51.4 59.26 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.041 -0.527 . . . . 10.0 112.283 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 50.3 mt -62.48 -30.27 48.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-O 120.932 0.396 . . . . 10.0 110.688 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.55 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 28.4 tp60 -66.28 -25.1 66.71 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.753 179.181 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 36.2 tp -95.15 -32.97 12.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.066 0.46 . . . . 10.0 110.219 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' ILE . . . . . 0.425 HG12 ' O ' ' B' ' 20' ' ' THR . 48.8 mm -73.27 -63.48 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.997 -0.547 . . . . 10.0 112.058 -179.543 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -110.04 -3.6 16.36 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 -178.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.55 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 20.1 m-80 66.57 38.51 4.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.4 0.619 . . . . 10.0 109.703 -178.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 21.2 t60 -123.52 114.21 19.77 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.55 -179.256 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -85.1 134.82 34.18 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.592 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 m -98.96 115.19 38.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 N-CA-C 109.668 -0.493 . . . . 10.0 109.668 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -85.84 -7.07 58.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.081 -0.508 . . . . 10.0 111.65 -178.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -101.39 161.61 13.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.077 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.802 ' HA ' H5'1 ' B' ' 201' ' ' GNP . 68.6 t80 -85.81 91.7 8.41 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.084 0.469 . . . . 10.0 110.854 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.11 135.16 37.5 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.097 179.097 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.3 172.29 14.38 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.605 2.203 . . . . 10.0 112.364 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 35' ' ' THR . . . . . 0.802 HG22 ' HA ' ' B' ' 59' ' ' ALA . 0.9 OUTLIER -165.6 136.13 3.68 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.398 -179.779 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 4.2 mp -130.56 -62.54 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 107.398 -1.334 . . . . 10.0 107.398 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.94 85.36 1.68 Allowed 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.029 -0.987 . . . . 10.0 109.031 178.515 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -120.86 110.41 16.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.611 -0.722 . . . . 10.0 111.006 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 39' ' ' SER . . . . . 0.416 ' HB2' ' NE2' ' D' ' 818' ' ' GLN . 0.0 OUTLIER -100.51 149.1 24.05 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.464 -0.789 . . . . 10.0 112.292 -179.158 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -124.54 176.39 6.55 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.245 -0.888 . . . . 10.0 109.129 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 41' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' B' ' 41' ' ' ARG . 40.6 ttm180 -163.09 130.56 3.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.571 0.224 . . . . 10.0 111.268 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -157.49 158.02 34.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.401 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -120.83 128.0 52.44 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 7.9 m -139.53 173.52 10.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.999 0.428 . . . . 10.0 110.96 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 21.9 t -103.43 106.03 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.545 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 58.9 mt -102.99 114.42 42.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.684 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.829 ' HB2' HH22 ' B' ' 164' ' ' ARG . 29.7 m-20 61.32 27.19 16.89 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.947 -0.57 . . . . 10.0 111.571 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.63 -9.25 73.92 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.566 -0.826 . . . . 10.0 113.035 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -105.43 124.33 49.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.858 0.361 . . . . 10.0 110.903 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 12.7 t -80.85 136.91 36.17 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.723 -0.473 . . . . 10.0 109.723 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -154.68 161.0 41.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.727 0.299 . . . . 10.0 111.18 -179.256 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 29.7 tp -96.45 130.15 43.66 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 86.7 mt -109.3 115.86 30.78 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.925 0.393 . . . . 10.0 112.012 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -101.15 97.32 7.87 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.044 -1.095 . . . . 10.0 108.044 178.124 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 27.5 mt -93.5 129.24 44.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.897 -0.592 . . . . 10.0 112.496 -177.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 48.3 tp -119.26 115.59 24.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.861 -0.608 . . . . 10.0 109.91 178.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -89.59 119.31 29.9 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.793 -0.639 . . . . 10.0 110.293 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 40.2 p -75.74 156.83 34.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.881 -0.6 . . . . 10.0 112.074 -178.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.802 ' HA ' HG22 ' B' ' 35' ' ' THR . . . -57.38 155.17 9.56 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.488 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.52 -53.14 26.22 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.636 -0.792 . . . . 10.0 111.587 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -132.77 128.79 37.59 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.854 -0.424 . . . . 20.0 109.854 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.476 ' HG2' ' H ' ' B' ' 63' ' ' GLU . 2.2 tt0 -140.09 171.41 14.21 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.152 -0.476 . . . . 10.0 109.77 -179.739 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 63' ' ' GLU . . . . . 0.476 ' H ' ' HG2' ' B' ' 62' ' ' GLU . 20.5 mt-10 -108.18 -86.54 0.51 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.198 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -164.38 93.29 0.67 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.029 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 31.5 t -118.42 153.56 33.89 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.894 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.93 -28.76 69.75 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.179 0.514 . . . . 10.0 110.188 179.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 11.2 mmm -64.08 -31.59 72.83 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.06 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.559 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 48.8 ttt85 -67.17 -52.47 40.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.397 -0.82 . . . . 10.0 110.572 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -31.77 67.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.602 -0.727 . . . . 10.0 110.099 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.746 ' HB2' ' H12' ' A' ' 17' ' ' PCW . 14.2 tt0 -61.71 -57.59 11.36 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.31 -0.859 . . . . 10.0 112.313 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 71' ' ' TYR . . . . . 0.559 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 4.9 p90 -71.07 -18.71 62.54 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.373 0.879 . . . . 10.0 113.373 -178.362 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 84.9 mtp -89.39 -5.51 57.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.09 0.472 . . . . 10.0 111.016 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 73' ' ' ARG . . . . . 0.599 ' HD3' H322 ' A' ' 1' ' ' PCW . 11.0 ttm105 -89.18 -33.1 17.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.671 -179.203 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -47.48 62.19 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.837 0.68 . . . . 10.0 112.837 -178.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.49 148.38 45.29 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.678 -0.772 . . . . 10.0 113.897 -178.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -107.52 -45.65 4.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.192 0.52 . . . . 10.0 109.795 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -92.05 133.77 11.91 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.239 -0.744 . . . . 10.0 111.239 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -125.69 132.1 52.47 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.329 0.492 . . . . 10.0 112.329 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.726 ' HG ' HD22 ' B' ' 159' ' ' LEU . 78.0 mt -97.3 114.35 26.1 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.762 179.31 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 80' ' ' CYS . . . . . 0.499 ' HB3' HD12 ' B' ' 93' ' ' ILE . 21.1 m -87.31 89.94 8.18 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 21.9 t -91.14 123.48 43.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.78 -0.645 . . . . 10.0 111.417 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.639 ' HB3' HD11 ' B' ' 93' ' ' ILE . 38.5 p90 -132.95 168.73 17.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.822 -0.626 . . . . 10.0 109.668 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -102.8 120.89 41.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 110.022 -0.362 . . . . 10.0 110.022 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 84' ' ' ILE . . . . . 0.924 HD11 ' HA ' ' B' ' 118' ' ' CYS . 42.2 pt -68.99 -7.75 8.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 112.124 0.416 . . . . 10.0 112.124 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -102.92 7.12 39.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.279 0.562 . . . . 10.0 110.603 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -141.77 100.54 3.77 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.065 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.9 -27.04 64.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.886 -0.597 . . . . 10.0 112.16 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 9.2 tmtm? -58.28 -47.58 83.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.515 -0.311 . . . . 10.0 110.939 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 71.1 p -67.75 -31.0 70.61 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.26 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -67.19 -40.74 86.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.091 0.472 . . . . 10.0 110.142 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -71.88 -29.36 64.27 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.727 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.57 -11.64 61.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.914 -0.584 . . . . 10.0 112.006 -179.511 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 93' ' ' ILE . . . . . 0.639 HD11 ' HB3' ' B' ' 82' ' ' PHE . 33.3 mm -59.46 -40.93 83.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.887 0.375 . . . . 10.0 110.086 179.119 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -64.18 -39.9 94.97 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 108.692 -0.855 . . . . 10.0 108.692 178.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 8.2 t-160 -63.26 -39.33 94.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.227 -0.897 . . . . 10.0 110.132 179.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 96' ' ' TYR . . . . . 0.401 ' O ' HG13 ' B' ' 100' ' ' ILE . 21.0 m-85 -69.88 -52.22 26.62 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.529 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 97' ' ' ARG . . . . . 0.573 ' NH1' ' HB3' ' B' ' 137' ' ' TYR . 8.6 ttt180 -54.1 -43.11 70.13 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.629 0.252 . . . . 10.0 111.435 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -65.39 -38.03 88.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.343 -0.389 . . . . 10.0 111.267 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.21 -36.45 77.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.965 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 100' ' ' ILE . . . . . 0.401 HG13 ' O ' ' B' ' 96' ' ' TYR . 73.8 mt -70.99 -37.86 69.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.344 178.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 101' ' ' LYS . . . . . 0.876 ' HD2' ' HG3' ' B' ' 107' ' ' GLU . 33.4 ttpt -60.39 -32.17 71.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.663 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 1.2 ttp-105 -68.01 -29.97 69.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.667 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.825 HG23 ' HE2' ' B' ' 104' ' ' LYS . 22.3 m -95.57 -9.35 9.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.541 -0.3 . . . . 10.0 111.536 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.825 ' HE2' HG23 ' B' ' 103' ' ' VAL . 14.0 mmtt -103.96 -18.22 14.68 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.572 -0.286 . . . . 10.0 110.861 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 15.2 t70 75.87 -39.0 0.36 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.644 -0.707 . . . . 10.0 112.527 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 5.0 m -107.73 156.29 19.26 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.726 0.298 . . . . 10.0 111.026 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 107' ' ' GLU . . . . . 0.876 ' HG3' ' HD2' ' B' ' 101' ' ' LYS . 35.1 mp0 -81.18 -19.66 42.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.944 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -79.16 84.12 5.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.522 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 19.8 t -127.39 132.6 24.41 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.858 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -65.53 99.23 0.36 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.581 2.188 . . . . 10.0 111.322 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 111' ' ' MET . . . . . 0.441 ' HB2' HG21 ' B' ' 139' ' ' ILE . 66.9 mtt -121.56 153.79 37.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.592 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 112' ' ' VAL . . . . . 0.609 ' HB ' HD23 ' B' ' 79' ' ' LEU . 99.1 t -134.62 130.67 53.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 179.197 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 113' ' ' LEU . . . . . 0.486 ' HG ' ' HE1' ' B' ' 82' ' ' PHE . 14.6 tp -85.35 114.67 22.59 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.644 -0.502 . . . . 10.0 109.644 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 66.2 t -109.34 112.05 38.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.784 -178.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -93.93 97.82 2.26 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 110.339 -1.104 . . . . 10.0 110.339 178.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 116' ' ' ASN . . . . . 0.557 ' HA ' ' O ' ' B' ' 144' ' ' THR . 65.3 t30 -87.07 162.67 17.45 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.139 0.422 . . . . 10.0 112.139 -178.414 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 92.8 mttt 74.15 34.95 0.8 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.207 -0.906 . . . . 10.0 112.455 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 118' ' ' CYS . . . . . 0.924 ' HA ' HD11 ' B' ' 84' ' ' ILE . 5.4 p -71.74 -7.47 48.29 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.983 0.42 . . . . 10.0 111.457 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -90.33 -5.12 56.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.785 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 68.0 mt -96.52 129.22 33.76 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.267 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.79 1.1 8.47 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 123.191 2.594 . . . . 10.0 112.136 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.35 16.16 5.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.419 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -56.8 122.29 11.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.65 -0.705 . . . . 10.0 111.902 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.71 -22.54 11.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.318 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 38.9 t -98.55 118.18 44.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.56 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 126' ' ' ASP . . . . . 0.578 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 31.7 t70 -72.12 151.24 43.16 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.263 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 2.0 m -58.59 -42.55 88.31 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.243 0.46 . . . . 10.0 112.243 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -67.13 -34.67 78.09 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.678 0.251 . . . . 10.0 111.678 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 129' ' ' GLN . . . . . 0.578 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 50.6 mt-30 -61.36 -43.34 99.03 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.232 0.539 . . . . 10.0 109.931 179.493 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.53 -42.78 64.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.643 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -59.86 -43.97 94.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.053 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -61.25 -43.48 98.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.718 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 31.2 tp -65.04 -40.41 94.76 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.232 -0.44 . . . . 10.0 109.897 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.32 -46.43 88.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.707 -0.678 . . . . 10.0 110.402 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.425 HH11 ' HD3' ' B' ' 135' ' ' ARG . 7.0 tpt180 -64.54 -32.9 74.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.242 -0.436 . . . . 10.0 110.482 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 44.0 m -70.61 -18.31 62.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.593 179.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 137' ' ' TYR . . . . . 0.573 ' HB3' ' NH1' ' B' ' 97' ' ' ARG . 8.1 m-30 -106.08 1.11 26.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.852 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 66.69 28.93 74.01 Favored Glycine 0 CA--C 1.517 0.199 0 CA-C-N 115.914 -0.584 . . . . 10.0 112.801 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 139' ' ' ILE . . . . . 0.441 HG21 ' HB2' ' B' ' 111' ' ' MET . 49.4 pt -123.21 153.84 65.02 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.593 0.235 . . . . 10.0 110.874 -179.306 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -83.29 149.22 13.25 Favored 'Trans proline' 0 C--O 1.235 0.332 0 C-N-CA 122.435 2.09 . . . . 10.0 112.019 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -109.46 128.22 54.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.253 -0.431 . . . . 10.0 110.12 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 24.7 mm -126.48 123.99 64.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.085 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 143' ' ' GLU . . . . . 0.528 ' HG2' ' HB3' ' B' ' 118' ' ' CYS . 4.3 tt0 -83.01 127.01 33.17 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 107.792 -1.188 . . . . 10.0 107.792 178.191 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 144' ' ' THR . . . . . 0.557 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 11.1 m -133.58 160.6 36.99 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.136 0.493 . . . . 10.0 112.21 -177.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 145' ' ' SER . . . . . 0.437 ' HA ' ' OD1' ' B' ' 116' ' ' ASN . 12.7 t -157.58 123.53 4.72 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.025 -0.731 . . . . 10.0 109.025 178.085 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -76.89 -21.39 54.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.074 0.464 . . . . 10.0 110.065 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -73.06 -48.4 36.32 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.173 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 34.2 p -92.04 -6.21 51.48 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.032 0.444 . . . . 10.0 111.205 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 149' ' ' ARG . . . . . 0.41 ' HG3' ' CG ' ' B' ' 22' ' ' GLN . 3.4 ttt-85 58.86 38.13 24.64 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.354 -0.839 . . . . 10.0 111.484 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -107.22 136.07 47.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.057 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 76.44 -10.09 18.38 Favored Glycine 0 CA--C 1.518 0.254 0 O-C-N 123.531 0.519 . . . . 10.0 114.332 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 22.5 t -55.52 -54.82 21.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 112.117 0.414 . . . . 10.0 112.117 -178.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.91 -47.7 82.14 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.994 -178.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -62.46 -36.55 82.8 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.255 0.465 . . . . 10.0 112.255 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -59.42 -47.19 86.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.935 0.398 . . . . 10.0 110.48 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -68.81 -42.55 77.13 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.644 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 17.2 m-30 -61.67 -43.69 98.37 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.658 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.523 ' O ' ' HG2' ' B' ' 162' ' ' GLU . 97.0 m -59.11 -40.45 85.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.26 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.726 HD22 ' HG ' ' B' ' 79' ' ' LEU . 30.1 tp -57.5 -44.69 85.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.289 0.566 . . . . 10.0 109.56 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 44.5 t -65.73 -38.23 81.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.179 179.126 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 161' ' ' ARG . . . . . 0.516 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 76.6 mtt180 -63.04 -35.68 81.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.843 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 162' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' B' ' 158' ' ' THR . 10.3 mm-40 -69.83 -41.4 75.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.05 0.452 . . . . 10.0 110.004 179.121 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 163' ' ' ILE . . . . . 0.541 ' O ' ' HG2' ' B' ' 167' ' ' LYS . 85.1 mt -62.85 -43.64 99.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.31 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 164' ' ' ARG . . . . . 0.829 HH22 ' HB2' ' B' ' 47' ' ' ASP . 0.2 OUTLIER -55.34 -48.44 74.21 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.707 179.327 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 29.1 mtmm -64.77 -37.58 88.1 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.238 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -61.25 -43.05 99.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.845 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 167' ' ' LYS . . . . . 0.541 ' HG2' ' O ' ' B' ' 163' ' ' ILE . 72.3 mmtt -65.97 -46.6 77.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.39 179.63 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.63 -47.82 83.68 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.384 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -62.9 -34.92 78.45 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.014 0.376 . . . . 10.0 112.014 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 15.1 mmt -71.74 -34.92 69.92 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.901 0.381 . . . . 10.0 110.583 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 21.6 m -70.85 -24.59 62.54 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.2 -0.455 . . . . 10.0 111.409 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 172' ' ' LYS . . . . . 0.425 ' HA ' ' H83' ' A' ' 6' ' ' PCW . 27.5 mtmt -97.34 -4.68 38.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.754 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 47.8 t0 62.62 94.96 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.794 0.683 . . . . 10.0 112.015 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . -83.07 76.18 2.28 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.816 -0.707 . . . . 10.0 112.227 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 39.1 mmtm -73.76 74.14 1.56 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.087 0.47 . . . . 10.0 111.13 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -113.65 115.65 28.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.852 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 20.3 mmmt 70.97 -59.92 0.53 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.995 0.739 . . . . 10.0 112.995 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -75.43 93.09 2.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.926 0.393 . . . . 10.0 110.367 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.36 155.79 15.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.872 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 180' ' ' LYS . . . . . 0.832 ' NZ ' ' HN1' ' A' ' 33' ' ' 17F . 85.7 mttt -94.76 101.16 12.98 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 178.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 10.8 m -70.89 87.48 0.72 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.555 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 182' ' ' LYS . . . . . 0.442 ' HB3' ' H ' ' B' ' 183' ' ' THR . 23.2 mmtt -151.35 -156.9 0.76 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.211 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 183' ' ' THR . . . . . 0.442 ' H ' ' HB3' ' B' ' 182' ' ' LYS . 0.3 OUTLIER -73.48 100.78 3.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.343 179.802 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 184' ' ' LYS . . . . . 0.44 ' HA ' ' HD2' ' B' ' 184' ' ' LYS . 19.4 tptp -105.13 -9.86 17.5 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.81 -179.326 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 85.7 m . . . . . 0 C--O 1.236 0.37 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.938 179.905 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.036 -0.426 . . . . 10.0 112.036 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.28 131.75 53.78 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.806 0.336 . . . . 10.0 110.694 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 49.0 t -118.64 140.83 40.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.996 -178.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.96 123.11 34.2 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.353 178.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 812' ' ' VAL . . . . . 0.828 HG11 HD11 ' D' ' 834' ' ' LEU . 47.0 t -107.6 136.96 41.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 116.11 -0.496 . . . . 10.0 109.952 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -90.58 133.3 35.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.933 0.397 . . . . 10.0 111.487 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 83.7 mt -101.67 147.63 34.13 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.766 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 815' ' ' PRO . . . . . 0.487 ' HD3' ' HB ' ' D' ' 877' ' ' VAL . 60.4 Cg_endo -72.72 45.16 0.84 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 123.247 2.631 . . . . 10.0 113.458 -178.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -148.98 27.58 0.86 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.117 0.484 . . . . 10.0 109.998 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 817' ' ' LYS . . . . . 0.53 ' HG2' ' H11' ' A' ' 22' ' ' PCW . 49.3 mttm 60.37 44.16 12.57 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.176 -0.92 . . . . 10.0 111.826 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 818' ' ' GLN . . . . . 0.416 ' NE2' ' HB2' ' B' ' 39' ' ' SER . 76.8 mt-30 -147.91 177.1 9.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.952 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 819' ' ' ARG . . . . . 0.402 ' HD2' HH11 ' D' ' 819' ' ' ARG . 0.0 OUTLIER -143.97 168.46 19.92 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.858 0.361 . . . . 10.0 111.287 -178.975 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 12.0 t -147.63 151.55 36.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.737 -0.665 . . . . 10.0 109.283 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 4.2 t -104.9 117.46 50.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.809 0.338 . . . . 10.0 111.016 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 21.1 t -112.68 140.81 30.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.716 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.22 137.03 33.71 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.71 179.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 22.0 t -87.43 120.88 37.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.824 0.345 . . . . 10.0 110.15 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 825' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' D' ' 825' ' ' ARG . 16.5 mtp180 -129.34 135.11 48.32 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.698 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -78.84 49.37 0.9 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.92 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . -161.04 25.98 0.27 Allowed Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 120.457 -0.878 . . . . 10.0 112.34 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 11.6 ptm -151.94 159.06 43.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.626 0.25 . . . . 10.0 111.128 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 829' ' ' SER . . . . . 0.72 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 93.9 p -100.98 -179.71 4.13 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.737 -179.407 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 830' ' ' VAL . . . . . 0.543 HG11 HG21 ' D' ' 850' ' ' VAL . 98.6 t -67.1 -33.39 62.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 108.898 -0.779 . . . . 10.0 108.898 178.63 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 831' ' ' TYR . . . . . 0.47 ' O ' ' HB2' ' D' ' 835' ' ' ASP . 73.4 t80 -59.38 -43.14 92.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.463 -0.789 . . . . 10.0 110.546 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -68.73 -56.07 9.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.115 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 1.7 m -57.59 -37.22 72.84 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.383 0.883 . . . . 10.0 113.383 -178.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 834' ' ' LEU . . . . . 0.828 HD11 HG11 ' D' ' 812' ' ' VAL . 3.4 mm? -91.89 -8.98 44.87 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.915 0.709 . . . . 10.0 112.915 -178.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 835' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' D' ' 831' ' ' TYR . 24.2 t70 -62.07 -56.81 15.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.956 0.407 . . . . 10.0 110.499 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -59.93 -33.16 71.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.82 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -67.75 -36.57 80.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.491 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 838' ' ' LEU . . . . . 0.708 HD21 HG11 ' D' ' 877' ' ' VAL . 88.0 mt -86.13 -43.31 13.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.42 -0.355 . . . . 10.0 111.913 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 839' ' ' LYS . . . . . 0.493 ' HA ' ' HD3' ' D' ' 839' ' ' LYS . 16.1 mmtp -61.64 -30.71 70.89 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.16 0.429 . . . . 10.0 112.16 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 5.1 p -71.11 -17.82 20.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.926 0.394 . . . . 10.0 111.226 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 841' ' ' ARG . . . . . 0.444 ' HA ' ' HD2' ' D' ' 841' ' ' ARG . 0.6 OUTLIER -108.93 -2.85 18.01 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.893 0.331 . . . . 10.0 111.893 -179.758 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 83.91 33.52 20.98 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 120.934 -0.651 . . . . 10.0 113.057 179.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 64.3 mt -121.27 154.78 35.89 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -123.15 152.56 41.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.855 0.36 . . . . 10.0 111.035 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -66.73 -6.24 15.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.592 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -74.13 -27.1 60.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.691 -0.686 . . . . 10.0 111.599 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 1.9 m -124.38 20.57 8.79 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.655 0.264 . . . . 10.0 111.697 -178.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 82.6 m -143.9 157.34 44.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.926 0.393 . . . . 10.0 110.721 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 849' ' ' VAL . . . . . 0.551 ' HB ' HD11 ' D' ' 880' ' ' LEU . 4.4 p -144.43 156.54 14.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.87 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 850' ' ' VAL . . . . . 0.691 HG12 HG22 ' D' ' 877' ' ' VAL . 3.8 m -100.62 127.95 53.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.168 0.508 . . . . 10.0 112.3 -179.144 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 851' ' ' TYR . . . . . 0.475 ' CE1' HG22 ' D' ' 860' ' ' VAL . 74.5 m-85 -107.03 117.28 33.64 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.673 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 852' ' ' ARG . . . . . 0.671 ' HD2' ' OE1' ' D' ' 873' ' ' GLU . 12.7 mtm180 -75.93 127.39 32.89 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 110.126 -0.324 . . . . 10.0 110.126 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 853' ' ' LEU . . . . . 0.523 HD12 ' H72' ' A' ' 21' ' ' PCW . 0.5 OUTLIER -90.66 87.66 6.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.008 0.433 . . . . 10.0 110.883 -179.243 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 54.1 mt -99.67 103.1 14.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.353 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt 52.91 28.7 6.83 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.42 0.896 . . . . 10.0 113.42 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 98.53 6.37 56.47 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.535 -0.841 . . . . 10.0 113.318 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 857' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' D' ' 857' ' ' ARG . 45.0 mmt-85 -113.99 117.03 30.18 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.387 -0.478 . . . . 10.0 111.143 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 858' ' ' LYS . . . . . 0.423 ' HE3' ' O31' ' A' ' 10' ' ' PCW . 92.7 mttt -73.43 109.59 7.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.819 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 4.0 m -104.42 117.4 34.08 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.422 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 860' ' ' VAL . . . . . 0.475 HG22 ' CE1' ' D' ' 851' ' ' TYR . 2.1 t -67.55 132.86 32.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.742 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 28.7 m -136.27 146.75 47.03 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.118 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -81.4 170.03 16.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.508 -179.469 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -83.26 -18.49 38.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.04 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.04 -16.41 63.15 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.702 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.19 148.38 43.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.273 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 866' ' ' ALA . . . . . 0.72 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -82.16 161.57 22.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.385 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 9.2 tp -89.32 -0.48 8.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.499 0.666 . . . . 10.0 110.861 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 868' ' ' ALA . . . . . 0.491 ' HB3' ' HD3' ' D' ' 869' ' ' PRO . . . -62.42 -51.33 74.1 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 113.193 0.812 . . . . 10.0 113.193 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 869' ' ' PRO . . . . . 0.491 ' HD3' ' HB3' ' D' ' 868' ' ' ALA . 2.9 Cg_exo -78.08 31.8 0.44 Allowed 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 122.491 2.127 . . . . 10.0 112.864 -179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 870' ' ' LEU . . . . . 0.5 HD11 ' HD3' ' D' ' 852' ' ' ARG . 3.4 mm? -117.62 25.96 10.04 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.239 0.542 . . . . 10.0 110.108 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -71.78 105.38 3.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.915 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 90.17 13.16 60.74 Favored Glycine 0 CA--C 1.517 0.217 0 C-N-CA 120.842 -0.694 . . . . 10.0 113.095 178.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 873' ' ' GLU . . . . . 0.671 ' OE1' ' HD2' ' D' ' 852' ' ' ARG . 5.1 tt0 -114.43 156.15 25.04 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 122.709 -0.289 . . . . 10.0 110.648 -179.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -114.4 154.5 28.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.577 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 875' ' ' LEU . . . . . 0.476 HD23 ' HG2' ' D' ' 852' ' ' ARG . 6.3 mt -128.21 135.56 49.87 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.409 -0.359 . . . . 10.0 111.696 -178.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 876' ' ' ILE . . . . . 0.499 ' CD1' ' H12' ' A' ' 10' ' ' PCW . 63.9 mt -118.88 118.28 57.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 108.488 -0.93 . . . . 10.0 108.488 178.016 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 877' ' ' VAL . . . . . 0.708 HG11 HD21 ' D' ' 838' ' ' LEU . 11.9 t -90.02 124.3 42.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.566 0.222 . . . . 10.0 110.58 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -127.0 155.29 43.44 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.014 0.435 . . . . 10.0 111.045 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 13.5 t -76.28 143.55 12.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.426 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 880' ' ' LEU . . . . . 0.595 ' OXT' ' H63' ' A' ' 8' ' ' PCW . 79.7 mt . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.438 -0.791 . . . . 10.0 111.313 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PCW . . . . . 0.788 H122 ' H20' ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PCW . . . . . 0.508 H321 H352 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PCW . . . . . 0.793 H332 ' H31' ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PCW . . . . . 0.462 H342 H172 ' A' ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PCW . . . . . 0.619 ' H12' H361 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PCW . . . . . 0.572 ' H32' H18A ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PCW . . . . . 0.882 ' H2 ' ' H11' ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PCW . . . . . 0.638 H152 H141 ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PCW . . . . . 0.92 H322 H351 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PCW . . . . . 0.769 H381 H142 ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PCW . . . . . 0.592 ' H39' ' H71' ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PCW . . . . . 0.838 ' H72' ' HN1' ' A' ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PCW . . . . . 0.676 H332 H142 ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PCW . . . . . 0.92 H351 H322 ' A' ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PCW . . . . . 0.645 ' H42' ' H1 ' ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PCW . . . . . 0.882 ' H11' ' H2 ' ' A' ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PCW . . . . . 0.746 ' H12' ' HB2' ' B' ' 70' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PCW . . . . . 0.788 H232 H442 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PCW . . . . . 0.782 H241 H161 ' A' ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PCW . . . . . 0.656 H332 H131 ' A' ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PCW . . . . . 0.523 ' H72' HD12 ' D' ' 853' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PCW . . . . . 0.561 H361 H372 ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PCW . . . . . 0.793 ' H31' H332 ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PCW . . . . . 0.552 ' H51' ' H73' ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PCW . . . . . 0.458 H232 H462 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PCW . . . . . 0.629 H461 H471 ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PCW . . . . . 0.524 H222 H442 ' A' ' 8' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PCW . . . . . 0.592 ' H71' ' H39' ' A' ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PCW . . . . . 0.701 H371 H441 ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PCW . . . . . 0.653 H442 H471 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PCW . . . . . 0.445 H462 H442 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PCW . . . . . 0.529 H122 ' H33' ' A' ' 33' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' 17F . . . . . 0.832 ' HN1' ' NZ ' ' B' ' 180' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' 17F . . . . . 0.648 ' H42' ' H52' ' A' ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' 17F . . . . . 0.788 ' H20' H122 ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' 17F . . . . . 0.63 ' H19' H181 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 38' ' ' 17F . . . . . 0.545 ' H57' H232 ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' 17F . . . . . 0.645 ' H1 ' ' H42' ' A' ' 15' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' 17F . . . . . 0.838 ' HN1' ' H72' ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PCW . . . . . 0.627 H261 H452 ' A' ' 58' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PCW . . . . . 0.701 H162 H141 ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PCW . . . . . 0.698 H372 H122 ' A' ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PCW . . . . . 0.778 H371 H431 ' A' ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PCW . . . . . 0.932 ' H40' ' H61' ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PCW . . . . . 0.567 H172 H131 ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PCW . . . . . 0.635 ' H20' ' H20' ' A' ' 76' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PCW . . . . . 0.689 H332 H181 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PCW . . . . . 0.788 H442 H232 ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PCW . . . . . 0.605 ' C4 ' ' HN1' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PCW . . . . . 0.591 ' H11' ' H32' ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PCW . . . . . 0.701 H141 H162 ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PCW . . . . . 0.792 H361 H122 ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PCW . . . . . 0.689 H181 H332 ' A' ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PCW . . . . . 0.661 H382 H362 ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PCW . . . . . 0.731 H331 H131 ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PCW . . . . . 0.932 ' H61' ' H40' ' A' ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PCW . . . . . 0.627 H452 H261 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PCW . . . . . 0.78 ' H40' H161 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' PCW . . . . . 0.641 H322 ' H62' ' A' ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PCW . . . . . 0.78 H161 ' H40' ' A' ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PCW . . . . . 0.717 H351 H332 ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PCW . . . . . 0.641 ' H62' H322 ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PCW . . . . . 0.792 H122 H361 ' A' ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PCW . . . . . 0.479 ' O31' ' H51' ' A' ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PCW . . . . . 0.633 ' H20' H321 ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PCW . . . . . 0.633 H321 ' H20' ' A' ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PCW . . . . . 0.596 ' H31' H171 ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PCW . . . . . 0.778 H431 H371 ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PCW . . . . . 0.596 H171 ' H31' ' A' ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PCW . . . . . 0.687 H321 ' H19' ' A' ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PCW . . . . . 0.717 H332 H351 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' 17F . . . . . 0.646 ' H53' H262 ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' 17F . . . . . 0.966 ' H4A' HN1A ' A' ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' 17F . . . . . 0.648 ' H52' ' H42' ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' 17F . . . . . 0.635 ' H20' ' H20' ' A' ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' 17F . . . . . 0.636 HN1A ' H62' ' A' ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' 17F . . . . . 0.605 ' HN1' ' C4 ' ' A' ' 50' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' 17F . . . . . 0.966 HN1A ' H4A' ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' 17F . . . . . 0.529 ' H18' ' H11' ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 201' ' ' GNP . . . . . 0.802 H5'1 ' HA ' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 74.8 mt . . . . . 0 CA--C 1.518 -0.28 0 CA-C-O 121.288 0.566 . . . . 10.0 110.171 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 41.5 mttm -61.42 -35.83 78.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.948 -1.023 . . . . 10.0 110.458 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 25.0 mt -66.6 -34.24 77.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.833 -0.622 . . . . 10.0 110.799 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 95.9 mt -66.43 -44.08 83.91 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.344 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.62 -35.16 76.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.956 0.407 . . . . 10.0 110.535 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 206' ' ' ASN . . . . . 0.448 ' O ' HG23 ' A' ' 210' ' ' VAL . 25.9 t-20 -65.66 -48.11 73.26 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 178.144 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 3.2 m95 -65.77 -30.65 71.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.725 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -63.05 -34.57 77.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.396 0.617 . . . . 10.0 109.717 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 49.6 m -78.21 -23.18 47.62 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.458 -0.792 . . . . 10.0 109.671 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 210' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 206' ' ' ASN . 77.6 t -77.76 -45.75 27.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.806 -0.633 . . . . 10.0 109.697 178.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 4.9 p -63.31 -43.14 98.65 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.887 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 26.8 p -61.09 -42.35 98.35 Favored 'General case' 0 C--N 1.333 -0.113 0 N-CA-C 109.75 -0.463 . . . . 10.0 109.75 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 84.6 m -67.31 -38.49 85.04 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.877 178.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 214' ' ' PHE . . . . . 0.445 ' HD1' ' HA ' ' A' ' 214' ' ' PHE . 1.7 m-30 -61.47 -40.64 95.25 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.089 0.471 . . . . 10.0 109.958 178.51 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 28.6 m -68.26 -45.97 71.71 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.092 178.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.4 -31.77 73.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.066 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 11.2 mt -67.49 -40.66 85.23 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.47 -0.567 . . . . 10.0 109.47 178.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 218' ' ' ARG . . . . . 0.594 ' HD3' H141 ' A' ' 15' ' ' PCW . 85.6 mtm180 -72.66 -33.42 66.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.861 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -62.14 -30.51 71.09 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -90.9 -32.66 15.93 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.329 -0.85 . . . . 10.0 109.952 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 221' ' ' LEU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 218' ' ' ARG . 18.3 mt -59.56 -38.02 79.99 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.532 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -53.21 -67.83 1.93 Allowed Glycine 0 C--N 1.33 0.231 0 N-CA-C 111.426 -0.67 . . . . 10.0 111.426 178.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -58.73 -37.89 91.8 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.565 2.177 . . . . 10.0 111.786 177.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 4.6 t -55.94 -50.39 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-O 120.609 0.242 . . . . 10.0 110.754 179.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 4.7 p -67.16 -32.32 73.35 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.56 -0.456 . . . . 10.0 110.366 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -64.56 -52.0 59.88 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 178.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 227' ' ' GLU . . . . . 0.468 ' HG2' ' HG2' ' C' ' 546' ' ' GLU . 1.5 mp0 -61.18 -43.91 98.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.845 178.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -61.06 -48.82 79.95 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.838 179.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 17.5 m95 -63.28 -39.11 93.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.723 0.297 . . . . 10.0 110.833 179.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -62.8 -49.99 72.77 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.213 0.53 . . . . 10.0 110.269 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 231' ' ' ASN . . . . . 0.553 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 72.7 m-20 -68.45 -36.03 78.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.783 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 13.6 mt -65.05 -32.34 74.01 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -68.28 -37.52 80.77 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.942 -0.762 . . . . 10.0 108.942 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 234' ' ' LYS . . . . . 0.553 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 70.4 mttt -67.81 -39.95 83.89 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.734 -0.839 . . . . 10.0 108.734 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.26 -50.83 68.63 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.626 -0.716 . . . . 10.0 109.468 178.41 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 2.2 p -63.59 -38.06 89.7 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.819 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 237' ' ' GLU . . . . . 0.41 ' OE1' ' HD2' ' A' ' 240' ' ' ARG . 2.8 mm-40 -61.38 -44.05 97.82 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 109.917 -0.401 . . . . 10.0 109.917 178.562 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -66.03 -45.54 86.82 Favored Glycine 0 N--CA 1.443 -0.866 0 N-CA-C 109.19 -1.564 . . . . 10.0 109.19 177.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 46.8 mt -59.63 -34.21 72.49 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 115.256 -0.472 . . . . 10.0 111.166 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 240' ' ' ARG . . . . . 0.41 ' HD2' ' OE1' ' A' ' 237' ' ' GLU . 69.9 mtt180 -70.72 -44.38 66.98 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 178.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -64.78 -29.64 70.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.318 -0.856 . . . . 10.0 109.757 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 242' ' ' GLU . . . . . 0.634 ' HB3' HH21 ' C' ' 532' ' ' ARG . 15.5 mt-10 -86.93 -38.83 16.32 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.716 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 243' ' ' MET . . . . . 0.478 ' HA ' ' HB2' ' A' ' 246' ' ' ASP . 1.7 mmt -62.01 -36.64 82.13 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.827 -0.17 . . . . 10.0 111.329 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 2.0 p -62.0 -39.99 94.11 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.79 -0.819 . . . . 10.0 108.79 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -73.35 -45.57 54.3 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.201 178.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 246' ' ' ASP . . . . . 0.478 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.4 OUTLIER -53.91 -54.26 41.25 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 115.892 -0.595 . . . . 10.0 109.462 179.048 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.58 ' HB3' ' HE2' ' A' ' 251' ' ' LYS . 75.7 mt -63.52 -44.17 95.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.142 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -58.69 -55.18 38.45 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 120.746 0.308 . . . . 10.0 110.815 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -63.89 -50.09 70.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.821 -0.627 . . . . 10.0 111.603 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 250' ' ' VAL . . . . . 0.644 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 46.1 t -59.55 -45.58 93.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 112.057 0.391 . . . . 10.0 112.057 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.58 ' HE2' ' HB3' ' A' ' 247' ' ' LEU . 57.6 mtmt -72.48 -40.52 66.87 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.348 0.499 . . . . 10.0 112.348 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -68.68 -33.35 73.82 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.892 0.377 . . . . 10.0 110.696 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -88.12 -24.51 23.36 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.498 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.644 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.6 OUTLIER -63.45 -24.25 35.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.016 0.436 . . . . 10.0 110.005 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 255' ' ' GLN . . . . . 0.552 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 15.9 mt-30 -62.45 -64.5 2.98 Favored Pre-proline 0 N--CA 1.451 -0.419 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.43 178.258 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 256' ' ' PRO . . . . . 0.552 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 20.0 Cg_endo -63.59 -29.19 70.05 Favored 'Trans proline' 0 C--N 1.361 1.193 0 C-N-CA 121.802 1.668 . . . . 10.0 111.363 177.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 257' ' ' TYR . . . . . 0.494 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 5.0 m-30 -59.58 -57.77 11.52 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 109.424 -0.584 . . . . 10.0 109.424 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 72.7 mt -72.35 -32.86 66.85 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 115.686 -0.688 . . . . 10.0 111.003 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 259' ' ' ASP . . . . . 0.484 ' HB3' ' HA ' ' A' ' 256' ' ' PRO . 25.1 t70 -60.98 -49.06 78.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.748 0.309 . . . . 10.0 110.585 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -63.31 -44.97 93.48 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -61.41 -43.65 98.5 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.805 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -62.64 -46.23 89.19 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 110.258 -0.275 . . . . 10.0 110.258 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 263' ' ' LYS . . . . . 0.542 ' O ' ' HG3' ' A' ' 267' ' ' GLU . 71.0 mttt -59.6 -45.57 91.52 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.089 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.513 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 14.1 mptt -65.8 -46.02 80.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.0 179.078 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 4.0 m0 -58.51 -41.14 84.76 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.39 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -59.86 -48.12 82.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.817 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 267' ' ' GLU . . . . . 0.542 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 31.3 mt-10 -64.12 -41.63 97.16 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 268' ' ' GLU . . . . . 0.601 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 30.9 mt-10 -60.9 -40.1 91.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.861 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 96.2 mmm -75.6 -39.25 58.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.742 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -62.05 -52.58 63.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.286 0.565 . . . . 10.0 109.612 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.54 -22.44 66.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.504 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 272' ' ' TYR . . . . . 0.601 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 1.0 OUTLIER -78.63 -46.44 19.24 Favored 'General case' 0 C--O 1.221 -0.406 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 178.305 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 43.0 mtt85 -62.98 -33.96 76.52 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.271 0.558 . . . . 10.0 109.78 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -70.63 -7.02 41.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.338 -0.846 . . . . 10.0 110.477 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.714 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 49.5 mttp -112.62 -36.38 5.23 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.493 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 276' ' ' VAL . . . . . 0.6 ' O ' ' HB2' ' A' ' 280' ' ' ARG . 53.5 t -48.96 -49.08 15.96 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.673 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 277' ' ' GLU . . . . . 0.74 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 65.3 mt-10 -62.7 -59.04 13.77 Favored Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 111.747 0.277 . . . . 10.0 111.747 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 278' ' ' PRO . . . . . 0.74 ' HD3' ' HB2' ' A' ' 277' ' ' GLU . 53.3 Cg_exo -56.26 -44.05 50.11 Favored 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 122.032 1.821 . . . . 10.0 111.932 178.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.719 ' HB3' ' HE3' ' C' ' 495' ' ' LYS . 34.8 mt -64.74 -40.06 94.69 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 116.578 -0.283 . . . . 10.0 110.304 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 280' ' ' ARG . . . . . 0.6 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 5.5 ttt180 -65.9 -35.36 80.42 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 109.214 -0.661 . . . . 10.0 109.214 178.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.94 -44.18 90.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.738 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -61.98 -48.24 81.24 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.9 -43.85 97.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.32 -0.855 . . . . 10.0 110.584 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -63.62 -50.55 68.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.745 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 285' ' ' GLU . . . . . 0.635 ' HA ' ' HD2' ' A' ' 288' ' ' ARG . 8.4 mm-40 -59.15 -45.86 89.87 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.899 0.38 . . . . 10.0 110.139 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.38 -44.64 96.54 Favored Glycine 0 N--CA 1.442 -0.921 0 N-CA-C 111.015 -0.834 . . . . 10.0 111.015 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -62.22 -38.29 88.62 Favored 'General case' 0 C--O 1.221 -0.441 0 N-CA-C 110.438 -0.208 . . . . 10.0 110.438 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 288' ' ' ARG . . . . . 0.635 ' HD2' ' HA ' ' A' ' 285' ' ' GLU . 75.5 mtt180 -58.24 -43.61 87.88 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -71.16 -49.98 38.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.144 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 59.9 mttt -57.48 -49.34 76.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.538 -0.756 . . . . 10.0 111.507 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 69.8 mt -66.46 -34.35 77.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.519 -0.31 . . . . 10.0 110.986 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 292' ' ' HIS . . . . . 0.473 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 0.2 OUTLIER -62.77 -53.25 57.14 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.682 -0.488 . . . . 10.0 109.682 179.194 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.4 -37.55 81.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.633 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 60.8 mt -64.57 -48.63 74.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.8 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -69.74 -33.36 72.35 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.84 0.353 . . . . 10.0 111.037 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.5 -11.2 60.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.148 178.618 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 297' ' ' LYS . . . . . 0.438 ' HE3' HD11 ' A' ' 301' ' ' LEU . 9.8 mttp -103.3 -38.64 7.14 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.94 -0.573 . . . . 10.0 109.84 177.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 298' ' ' LEU . . . . . 0.418 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 59.0 mt -63.73 -19.9 65.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.727 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 299' ' ' SER . . . . . 0.542 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 14.8 m -80.63 -64.7 0.29 Allowed Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 116.578 -0.283 . . . . 10.0 111.736 179.33 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 300' ' ' PRO . . . . . 0.542 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 40.7 Cg_endo -68.72 -51.3 0.51 Allowed 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.954 1.769 . . . . 10.0 111.964 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.616 HD13 ' HG2' ' C' ' 473' ' ' LYS . 93.0 mt -66.81 -25.09 66.28 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.938 0.399 . . . . 10.0 110.193 179.538 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 302' ' ' GLY . . . . . 0.418 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -72.88 -41.19 50.06 Favored Glycine 0 N--CA 1.444 -0.822 0 N-CA-C 109.075 -1.61 . . . . 10.0 109.075 177.392 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -64.41 -41.79 96.44 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 178.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -64.11 -31.87 73.23 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.156 -0.475 . . . . 10.0 109.851 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 11.0 tpt -67.68 -42.3 82.34 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.741 -0.837 . . . . 10.0 108.741 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 306' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 306' ' ' ARG . 61.6 mtt180 -69.82 -40.11 76.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.449 -0.796 . . . . 10.0 109.801 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 307' ' ' ASP . . . . . 0.518 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 7.1 t0 -62.37 -43.26 99.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.497 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 308' ' ' ARG . . . . . 1.128 ' HG3' HD11 ' C' ' 469' ' ' LEU . 23.1 mmt180 -70.06 -32.03 69.92 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.547 178.112 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -67.18 -38.65 85.77 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.738 -0.838 . . . . 10.0 108.738 178.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 310' ' ' ARG . . . . . 0.518 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 82.3 mtt180 -56.74 -54.68 43.47 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 108.993 -0.743 . . . . 10.0 108.993 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -64.13 -39.82 94.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.498 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 312' ' ' HIS . . . . . 0.408 ' HB2' ' O ' ' A' ' 308' ' ' ARG . 0.1 OUTLIER -57.37 -54.98 40.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.89 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 31.5 t -73.68 -36.2 46.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.636 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 314' ' ' ASP . . . . . 0.723 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 6.0 t70 -63.55 -44.52 93.92 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.874 -0.33 . . . . 10.0 110.553 179.38 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -63.95 -31.97 73.35 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.492 -0.929 . . . . 10.0 108.492 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 316' ' ' LEU . . . . . 0.847 ' HG ' ' HE3' ' C' ' 462' ' ' LYS . 7.3 mt -69.44 -37.36 77.33 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.276 -0.874 . . . . 10.0 109.044 178.125 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.723 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 70.2 mtt180 -62.11 -47.2 85.69 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.997 -0.372 . . . . 10.0 109.997 178.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 1.6 m -69.16 -9.24 51.91 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.148 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -104.21 -46.57 4.39 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.642 179.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 96.4 mt -64.17 -34.51 78.23 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.42 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.71 -60.67 8.65 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-O 119.668 -0.206 . . . . 10.0 111.422 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -66.76 -31.29 39.84 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 121.632 1.554 . . . . 10.0 111.494 178.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 323' ' ' TYR . . . . . 0.402 ' CE1' ' HG2' ' C' ' 451' ' ' LYS . 4.6 m-30 -64.84 -42.01 95.26 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.824 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 324' ' ' SER . . . . . 0.473 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 11.9 p -71.93 -38.54 69.83 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 178.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 325' ' ' ASP . . . . . 0.439 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 30.4 t0 -62.95 -44.27 96.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.192 0.52 . . . . 10.0 109.638 178.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -71.18 -31.23 67.39 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.42 -32.04 73.36 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.201 -0.666 . . . . 10.0 109.201 178.111 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 328' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' A' ' 324' ' ' SER . 80.9 mtt180 -64.62 -39.44 93.71 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.589 -0.893 . . . . 10.0 108.589 177.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -66.7 -40.43 88.47 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.956 -0.757 . . . . 10.0 108.956 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -63.83 -49.15 73.95 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.459 178.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 69.9 mt -58.81 -42.15 88.46 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.878 -0.601 . . . . 10.0 109.607 178.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -62.8 -50.42 71.07 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.591 178.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -56.28 -42.7 77.91 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.889 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 334' ' ' ARG . . . . . 0.451 ' HD3' ' HB3' ' C' ' 440' ' ' GLU . 35.9 mmt180 -71.34 -54.46 10.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.057 -0.52 . . . . 10.0 111.348 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 335' ' ' LEU . . . . . 0.547 ' O ' ' HG3' ' A' ' 339' ' ' LYS . 94.1 mt -63.22 -44.45 95.22 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.78 0.659 . . . . 10.0 112.78 -178.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -63.25 -42.24 99.15 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.543 0.211 . . . . 10.0 110.659 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.39 -38.77 91.0 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.778 -0.823 . . . . 10.0 108.778 178.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 39.5 mt -67.93 -18.85 64.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.955 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 339' ' ' LYS . . . . . 0.547 ' HG3' ' O ' ' A' ' 335' ' ' LEU . 82.5 mttt -75.84 -47.49 25.35 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.934 -0.765 . . . . 10.0 108.934 178.301 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -69.97 -50.35 42.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.545 -0.752 . . . . 10.0 109.3 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 341' ' ' ASN . . . . . 0.649 HD21 ' HA ' ' C' ' 433' ' ' GLU . 8.0 t-20 -61.85 -47.77 83.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.008 -0.996 . . . . 10.0 109.796 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -64.23 -41.25 98.37 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.961 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -58.46 -41.16 95.18 Favored Glycine 0 N--CA 1.45 -0.38 0 N-CA-C 111.05 -0.82 . . . . 10.0 111.05 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -70.36 -39.98 74.3 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 345' ' ' ARG . . . . . 0.518 ' O ' ' HB2' ' A' ' 349' ' ' TYR . 68.7 mtt180 -60.94 -44.24 97.52 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.368 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 66.6 mt -65.67 -44.0 87.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.502 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.65 -48.9 79.72 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 348' ' ' GLU . . . . . 0.423 ' HB3' ' NZ ' ' A' ' 352' ' ' LYS . 12.4 mt-10 -66.17 -33.24 75.33 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.399 -0.819 . . . . 10.0 110.75 179.21 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 349' ' ' TYR . . . . . 0.518 ' HB2' ' O ' ' A' ' 345' ' ' ARG . 1.3 t80 -62.94 -45.3 93.1 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.453 -0.573 . . . . 10.0 109.453 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 -69.33 -38.5 78.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.485 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.63 94.96 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.108 0.48 . . . . 10.0 110.083 178.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 352' ' ' LYS . . . . . 0.423 ' NZ ' ' HB3' ' A' ' 348' ' ' GLU . 14.4 mtmm -81.12 -18.36 46.74 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.117 178.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 353' ' ' ALA . . . . . 0.508 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -72.76 -42.29 64.16 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.259 -0.645 . . . . 10.0 109.259 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -62.39 -36.2 81.57 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.395 -0.595 . . . . 10.0 109.395 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -66.32 -34.57 78.29 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.941 -0.572 . . . . 10.0 109.465 178.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -69.1 -42.94 75.45 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.081 -1.081 . . . . 10.0 108.081 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 86.1 mt -65.15 -40.94 95.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.278 -0.873 . . . . 10.0 112.42 -179.026 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 1.7 p -61.74 -45.75 92.6 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.879 0.371 . . . . 10.0 110.844 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.4 p -70.97 -33.98 70.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.967 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 360' ' ' LEU . . . . . 0.426 HD11 H211 ' A' ' 2' ' ' PCW . 16.1 mt -66.35 -43.63 85.53 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.625 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 1.8 p -68.55 -28.87 67.35 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.101 0.477 . . . . 10.0 109.877 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -78.11 2.23 18.61 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-O 121.616 0.722 . . . . 10.0 110.034 178.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.451 ' O ' ' HB3' ' A' ' 367' ' ' ALA . 82.5 tttt -117.81 -36.83 3.55 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.401 -0.963 . . . . 10.0 108.401 177.322 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -72.1 -13.06 61.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.613 -0.722 . . . . 10.0 111.688 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.933 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 96.1 mttt -111.91 -70.1 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.552 0 C-N-CA 120.834 -0.346 . . . . 10.0 111.117 178.688 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.933 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 36.0 Cg_exo -60.04 -55.2 1.73 Allowed 'Trans proline' 0 C--N 1.355 0.868 0 C-N-CA 121.928 1.752 . . . . 10.0 112.302 -179.498 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 367' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -64.95 -41.07 95.81 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.304 0.483 . . . . 10.0 112.304 -179.28 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 368' ' ' LEU . . . . . 0.513 HD23 ' HA ' ' A' ' 368' ' ' LEU . 10.9 mt -66.01 -40.65 91.28 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.588 -0.445 . . . . 10.0 111.253 179.314 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -69.92 -32.34 70.59 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.886 -0.783 . . . . 10.0 108.886 178.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.78 -42.25 95.23 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.049 -1.093 . . . . 10.0 108.049 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 371' ' ' LEU . . . . . 0.434 HD12 HD23 ' A' ' 368' ' ' LEU . 51.6 mt -66.33 -34.4 77.9 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.154 -0.93 . . . . 10.0 109.936 178.274 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 368' ' ' LEU . 97.9 mtt180 -63.41 -44.87 93.4 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.05 -0.722 . . . . 10.0 109.05 178.164 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -73.03 -5.44 38.9 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.467 -0.788 . . . . 20.0 112.076 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -102.76 -41.15 2.36 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 109.748 -1.341 . . . . 10.0 109.748 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 375' ' ' LEU . . . . . 0.414 ' O ' HG12 ' A' ' 378' ' ' VAL . 89.1 mt -71.34 -37.99 71.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.463 -0.369 . . . . 10.0 111.439 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 58.5 mt -56.43 -59.64 11.49 Favored Pre-proline 0 CA--C 1.534 0.365 0 N-CA-C 112.212 0.449 . . . . 10.0 112.212 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -62.77 -35.37 68.88 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 121.84 1.693 . . . . 10.0 111.718 179.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 378' ' ' VAL . . . . . 0.414 HG12 ' O ' ' A' ' 375' ' ' LEU . 0.3 OUTLIER -67.16 -33.71 64.8 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 C-N-CA 120.652 -0.419 . . . . 10.0 110.643 179.646 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.73 -36.2 81.91 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 380' ' ' GLU . . . . . 0.433 ' O ' HG23 ' A' ' 384' ' ' VAL . 14.2 mt-10 -67.72 -44.17 78.25 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.92 -0.582 . . . . 10.0 109.74 178.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 13.7 m -62.25 -40.85 97.55 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.058 -0.719 . . . . 10.0 109.058 178.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -65.4 -43.01 91.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.247 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -57.78 -50.1 74.38 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.598 -0.274 . . . . 10.0 110.91 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 384' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 380' ' ' GLU . 81.7 t -59.07 -46.32 91.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.347 179.519 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 14.7 m -66.91 -40.67 87.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.914 -0.584 . . . . 10.0 111.682 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -68.44 -45.96 71.11 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.012 0.375 . . . . 10.0 112.012 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 37.4 mt -59.88 -43.29 94.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.034 0.445 . . . . 10.0 110.627 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 388' ' ' SER . . . . . 0.437 ' O ' ' HB2' ' A' ' 392' ' ' GLU . 34.0 p -75.95 -16.2 60.04 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.502 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -87.0 -48.63 7.95 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.985 -0.376 . . . . 10.0 109.985 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 77.9 mt -59.9 -42.45 93.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.051 0.453 . . . . 10.0 109.834 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -64.75 -36.35 84.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.639 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 392' ' ' GLU . . . . . 0.628 ' O ' ' HG2' ' A' ' 396' ' ' LYS . 0.0 OUTLIER -66.88 -49.56 65.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.533 -179.831 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -55.79 -50.03 71.57 Favored 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.743 0.652 . . . . 10.0 111.643 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 5.0 m -60.92 -32.73 72.22 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.589 -0.732 . . . . 10.0 111.089 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -77.4 -11.73 59.88 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-O 120.658 0.266 . . . . 10.0 111.209 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 396' ' ' LYS . . . . . 0.739 ' HE3' ' HA ' ' C' ' 587' ' ' ALA . 21.5 mmtm -87.34 -38.54 16.13 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.789 -0.364 . . . . 10.0 110.669 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 8.7 mp -100.08 -107.17 0.22 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.058 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 . . . . . 0 N--CA 1.463 0.212 0 O-C-N 123.527 0.517 . . . . 10.0 111.753 -179.329 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 399' ' ' LEU . . . . . 0.456 ' HG ' ' HG2' ' C' ' 400' ' ' LYS . 1.4 pt? . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 121.341 0.591 . . . . 10.0 110.425 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 400' ' ' LYS . . . . . 0.456 ' HG2' ' HG ' ' C' ' 399' ' ' LEU . 1.4 mmmp? -104.78 15.15 28.41 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.443 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 58.7 mt -62.28 -39.82 94.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.495 -0.775 . . . . 10.0 111.664 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -62.33 -23.84 67.0 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.061 0.457 . . . . 10.0 111.073 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -79.01 -50.07 11.69 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.118 -0.697 . . . . 10.0 109.118 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -58.79 -44.72 90.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.243 -0.89 . . . . 10.0 110.394 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 25.9 m0 -64.76 -32.58 74.32 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.953 -0.567 . . . . 10.0 111.419 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -61.67 -50.27 73.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.452 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -37.51 87.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.21 0.528 . . . . 10.0 110.602 179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 74.9 t -67.99 -41.86 84.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.964 178.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 81.9 m -62.71 -48.08 80.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.795 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 2.5 p -60.86 -46.2 91.55 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.683 0.278 . . . . 10.0 111.206 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 12.1 p -66.19 -39.01 89.36 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.906 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -66.24 -40.03 89.95 Favored 'General case' 0 CA--C 1.522 -0.106 0 CA-C-N 116.552 -0.295 . . . . 10.0 110.402 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 413' ' ' SER . . . . . 0.407 ' O ' ' HG3' ' C' ' 417' ' ' GLU . 30.8 m -63.15 -48.22 79.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.438 . . . . 10.0 110.012 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -66.62 -29.11 69.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.681 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 53.0 tp -67.31 -46.38 73.71 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 61.2 mtt180 -62.59 -40.49 97.07 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.669 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 417' ' ' GLU . . . . . 0.624 ' O ' ' HD2' ' C' ' 421' ' ' PRO . 27.6 mt-10 -61.77 -48.6 79.93 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.778 -0.646 . . . . 10.0 109.813 178.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -60.18 -42.67 95.49 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.768 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 49.0 mt -57.48 -26.77 61.76 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.612 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -56.57 -78.09 0.14 Allowed Glycine 0 CA--C 1.52 0.377 0 C-N-CA 120.957 -0.64 . . . . 10.0 111.613 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 421' ' ' PRO . . . . . 0.624 ' HD2' ' O ' ' C' ' 417' ' ' GLU . 12.4 Cg_endo -57.64 -33.4 96.6 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.901 2.401 . . . . 10.0 111.95 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 422' ' ' VAL . . . . . 0.401 HG22 ' HG2' ' A' ' 352' ' ' LYS . 21.9 t -61.72 -49.15 85.49 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 CA-C-N 116.717 -0.22 . . . . 10.0 111.004 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 19.7 m -69.78 -34.7 74.11 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 110.075 -0.342 . . . . 10.0 110.075 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -61.92 -49.99 73.94 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.221 -0.659 . . . . 10.0 109.221 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 425' ' ' GLU . . . . . 0.421 ' HB3' ' NZ ' ' A' ' 352' ' ' LYS . 59.4 mt-10 -63.63 -40.79 97.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.703 -0.68 . . . . 10.0 109.212 178.371 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -58.27 -43.07 87.8 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.937 179.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 28.5 m0 -67.87 -36.48 80.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.865 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 428' ' ' ASP . . . . . 0.418 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 15.1 t70 -70.53 -30.13 66.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.504 0.668 . . . . 10.0 109.429 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 429' ' ' ASN . . . . . 0.452 HD21 ' HA ' ' A' ' 345' ' ' ARG . 7.0 t-20 -73.46 -38.95 65.3 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.232 -1.025 . . . . 10.0 108.232 177.588 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 430' ' ' LEU . . . . . 0.447 ' HA ' ' HB2' ' C' ' 433' ' ' GLU . 42.0 mt -68.31 -24.02 64.8 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 177.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -67.01 -47.94 69.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.118 -1.438 . . . . 10.0 107.118 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 432' ' ' LYS . . . . . 0.418 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 49.6 mttp -65.65 -36.73 84.52 Favored 'General case' 0 C--N 1.333 -0.11 0 N-CA-C 108.576 -0.898 . . . . 10.0 108.576 178.597 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 433' ' ' GLU . . . . . 0.649 ' HA ' HD21 ' A' ' 341' ' ' ASN . 3.7 tm-20 -59.47 -57.67 11.94 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.105 -0.952 . . . . 10.0 109.454 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 33.8 m -63.48 -42.93 98.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.59 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -63.15 -41.2 99.23 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.782 0.325 . . . . 10.0 110.457 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -66.54 -48.56 61.94 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 110.013 -1.235 . . . . 10.0 110.013 178.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 14.9 mt -59.82 -33.63 72.0 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 120.499 0.19 . . . . 10.0 110.527 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 27.7 mtt180 -62.62 -38.91 92.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.464 -0.335 . . . . 10.0 110.769 179.059 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -67.64 -40.19 84.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.341 0.591 . . . . 10.0 109.697 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 440' ' ' GLU . . . . . 0.451 ' HB3' ' HD3' ' A' ' 334' ' ' ARG . 35.8 mt-10 -72.04 -50.08 31.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.301 -0.863 . . . . 10.0 110.91 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 92.1 mmm -63.49 -37.53 87.66 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.795 1.035 . . . . 10.0 113.795 -178.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 4.4 p -59.47 -45.65 91.04 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 443' ' ' LYS . . . . . 0.419 ' O ' ' HB2' ' C' ' 447' ' ' GLU . 80.6 mttt -70.46 -42.13 71.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.461 -0.79 . . . . 10.0 109.82 178.35 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -58.23 -48.17 81.22 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.739 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 78.2 mt -61.86 -50.11 73.54 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.678 0.251 . . . . 10.0 111.678 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -62.82 -42.94 99.93 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.822 0.344 . . . . 10.0 110.412 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 447' ' ' GLU . . . . . 0.594 ' O ' ' HB2' ' C' ' 451' ' ' LYS . 3.1 mt-10 -66.05 -43.13 88.4 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.31 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 2.8 p -66.76 -33.95 66.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 121.087 -0.245 . . . . 10.0 111.204 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -73.93 -43.58 57.85 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.996 0.426 . . . . 10.0 110.069 178.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -72.01 -11.8 60.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.915 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 451' ' ' LYS . . . . . 0.594 ' HB2' ' O ' ' C' ' 447' ' ' GLU . 0.2 OUTLIER -104.09 -30.41 10.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.975 179.399 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 5.4 p -69.76 -29.9 42.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.746 0.308 . . . . 10.0 110.567 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 453' ' ' GLN . . . . . 0.804 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 50.7 mt-30 -62.84 -59.6 12.1 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.198 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 454' ' ' PRO . . . . . 0.804 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 37.2 Cg_exo -63.58 -29.56 70.29 Favored 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 122.079 1.853 . . . . 10.0 110.952 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 455' ' ' TYR . . . . . 0.545 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.1 OUTLIER -69.3 -48.08 62.64 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.264 179.528 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 18.0 mt -64.77 -38.39 90.81 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 178.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -63.57 -50.24 70.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.903 -0.589 . . . . 10.0 109.816 178.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 458' ' ' ASP . . . . . 0.546 ' O ' ' HG3' ' C' ' 462' ' ' LYS . 19.0 t70 -62.07 -45.66 92.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.824 -0.626 . . . . 10.0 109.691 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -62.24 -41.24 98.25 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.841 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -64.09 -40.06 95.41 Favored 'General case' 0 C--O 1.225 -0.225 0 N-CA-C 109.562 -0.533 . . . . 10.0 109.562 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 43.0 mttp -61.08 -41.91 97.53 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 108.703 -0.851 . . . . 10.0 108.703 178.115 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 462' ' ' LYS . . . . . 0.847 ' HE3' ' HG ' ' A' ' 316' ' ' LEU . 35.1 mttm -66.6 -42.05 87.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.358 -0.837 . . . . 10.0 109.906 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 13.8 m0 -64.2 -35.18 79.95 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.043 178.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -67.49 -46.06 74.05 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 1.088 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 42.2 mt-10 -60.24 -44.25 95.4 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 121.191 0.52 . . . . 10.0 109.901 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -71.61 -48.09 50.31 Favored 'General case' 0 C--O 1.217 -0.652 0 CA-C-N 115.486 -0.779 . . . . 10.0 112.402 -179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 11.3 mmt -60.17 -43.94 95.43 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.802 -0.359 . . . . 10.0 110.582 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -65.33 -46.53 79.89 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.793 -0.817 . . . . 10.0 108.793 178.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 1.128 HD11 ' HG3' ' A' ' 308' ' ' ARG . 96.2 mt -59.64 -46.3 89.42 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 115.39 -0.823 . . . . 20.0 111.499 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 19.3 m-30 -63.87 -44.14 93.99 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.99 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 19.5 ttm105 -65.23 -47.06 78.15 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.621 0.248 . . . . 10.0 111.219 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -65.01 -9.2 19.96 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.274 -0.421 . . . . 10.0 112.055 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 473' ' ' LYS . . . . . 0.616 ' HG2' HD13 ' A' ' 301' ' ' LEU . 87.4 mttt -111.84 -43.67 3.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.648 -0.251 . . . . 10.0 111.188 179.108 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 42.4 t -64.95 -38.57 83.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.79 -0.186 . . . . 10.0 110.848 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -58.13 -59.7 12.47 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 120.879 -0.328 . . . . 10.0 111.311 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -65.32 -35.67 39.24 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 121.649 1.566 . . . . 10.0 111.384 178.319 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 477' ' ' LEU . . . . . 0.42 ' HB2' ' O ' ' C' ' 473' ' ' LYS . 10.2 mt -62.08 -41.95 98.7 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 109.82 -0.437 . . . . 10.0 109.82 179.069 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -63.16 -35.05 79.01 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 479' ' ' ALA . . . . . 0.606 ' O ' ' HG2' ' C' ' 483' ' ' GLU . . . -68.71 -51.33 42.74 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.767 -0.652 . . . . 10.0 109.298 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -62.93 -36.87 84.85 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.335 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 35.9 mt -66.09 -35.25 80.02 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -69.84 -36.71 75.8 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 483' ' ' GLU . . . . . 0.606 ' HG2' ' O ' ' C' ' 479' ' ' ALA . 61.1 mm-40 -63.57 -48.83 75.81 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 107.699 -1.223 . . . . 10.0 107.699 177.65 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -65.85 -33.37 85.6 Favored Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 114.999 -1.0 . . . . 10.0 111.319 178.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 485' ' ' ALA . . . . . 0.405 ' HB1' H281 ' A' ' 65' ' ' PCW . . . -68.63 -44.79 73.48 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 110.356 -0.239 . . . . 10.0 110.356 179.247 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -63.83 -39.57 94.53 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.125 -0.694 . . . . 10.0 109.125 178.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -65.33 -49.35 69.75 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.659 -0.867 . . . . 10.0 108.659 177.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -59.04 -38.99 80.62 Favored 'General case' 0 CA--C 1.522 -0.11 0 CA-C-N 115.943 -0.572 . . . . 10.0 110.613 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 39.3 mt -63.32 -44.23 95.54 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -69.61 -37.24 76.78 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.666 -0.494 . . . . 10.0 109.666 178.416 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -60.16 -43.84 95.48 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 177.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 58.2 mt -71.6 -37.56 70.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.569 179.05 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -61.6 -40.41 94.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.646 0.26 . . . . 10.0 110.305 179.059 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -75.66 9.59 2.19 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.081 -0.509 . . . . 10.0 111.009 178.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.719 ' HE3' ' HB3' ' A' ' 279' ' ' LEU . 56.8 mttp -123.2 -55.14 1.78 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.621 -0.718 . . . . 10.0 109.192 178.413 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 91.5 mt -61.23 -33.71 73.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.855 -0.612 . . . . 10.0 112.39 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 497' ' ' SER . . . . . 0.452 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 13.6 m -69.8 -61.04 3.25 Favored Pre-proline 0 CA--C 1.536 0.417 0 C-N-CA 120.734 -0.387 . . . . 10.0 111.668 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 498' ' ' PRO . . . . . 0.452 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 37.1 Cg_endo -65.17 -48.09 3.9 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 121.708 1.606 . . . . 10.0 111.801 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 499' ' ' LEU . . . . . 0.633 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 12.4 mt -66.26 -34.01 77.03 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-N 116.908 -0.133 . . . . 10.0 110.983 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.87 -50.94 55.74 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.524 -0.846 . . . . 10.0 111.002 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -67.0 -34.28 77.4 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.931 0.396 . . . . 10.0 110.337 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 502' ' ' GLU . . . . . 0.512 ' HG2' ' HE ' ' C' ' 506' ' ' ARG . 27.7 tt0 -69.2 -46.66 66.88 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 178.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 503' ' ' MET . . . . . 0.707 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 58.4 mmm -61.22 -32.26 72.03 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 178.584 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -64.97 -44.5 89.17 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 505' ' ' ASP . . . . . 0.505 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 1.1 t0 -68.15 -38.53 82.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.887 -0.597 . . . . 10.0 109.872 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.707 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 52.0 mtt180 -61.26 -45.28 95.18 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 107.963 -1.125 . . . . 10.0 107.963 177.582 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -62.25 -42.93 99.76 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.342 -0.844 . . . . 10.0 109.596 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 508' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' C' ' 512' ' ' ASP . 63.7 mtt180 -58.86 -49.44 77.74 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.596 -0.52 . . . . 10.0 109.596 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -61.41 -38.52 87.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.69 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 510' ' ' HIS . . . . . 0.497 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 5.7 m-70 -70.18 -51.41 31.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.778 179.784 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 66.7 t -65.29 -42.17 93.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.667 -179.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.531 ' HB2' ' O ' ' C' ' 508' ' ' ARG . 0.1 OUTLIER -64.62 -34.56 78.57 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.589 -0.523 . . . . 10.0 109.589 179.24 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -69.97 -39.82 75.75 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.548 -1.279 . . . . 10.0 107.548 177.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 514' ' ' LEU . . . . . 0.505 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 81.9 mt -64.61 -28.67 69.78 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.901 -0.591 . . . . 10.0 109.899 178.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 515' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' C' ' 512' ' ' ASP . 28.8 mtt180 -62.37 -30.93 71.54 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.568 -0.53 . . . . 10.0 109.568 178.297 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.13 2.23 24.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.691 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 517' ' ' HIS . . . . . 0.505 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 50.7 m170 -115.07 -16.4 11.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.505 -179.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 93.2 mt -111.95 -55.0 2.56 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.652 -0.249 . . . . 10.0 111.448 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -50.71 -60.19 5.94 Favored Pre-proline 0 N--CA 1.468 0.465 0 N-CA-C 113.134 0.79 . . . . 10.0 113.134 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -66.5 -29.22 44.96 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.44 1.426 . . . . 10.0 110.98 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 521' ' ' TYR . . . . . 0.438 ' HA ' ' OE1' ' C' ' 524' ' ' GLU . 63.9 t80 -66.19 -45.03 82.23 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.188 -0.46 . . . . 10.0 109.992 179.517 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 522' ' ' SER . . . . . 0.465 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 11.1 p -66.83 -29.22 69.1 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.882 -0.414 . . . . 10.0 109.882 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 523' ' ' ASP . . . . . 0.793 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 12.7 t70 -70.76 -41.02 72.31 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 178.56 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 524' ' ' GLU . . . . . 0.438 ' OE1' ' HA ' ' C' ' 521' ' ' TYR . 72.7 mt-10 -63.22 -39.54 94.91 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 107.704 -1.221 . . . . 10.0 107.704 177.219 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 32.9 mt -64.0 -36.25 83.35 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.151 -0.931 . . . . 10.0 109.426 177.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 526' ' ' ARG . . . . . 0.793 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 78.6 mtt180 -60.59 -38.78 85.78 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -65.28 -45.37 84.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.24 0.543 . . . . 10.0 109.694 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -68.25 -41.31 81.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.443 -0.799 . . . . 10.0 110.121 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 53.3 mt -65.21 -35.08 79.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.204 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 530' ' ' ALA . . . . . 0.537 ' O ' ' HG2' ' C' ' 534' ' ' GLU . . . -61.36 -46.4 90.37 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.38 -39.39 89.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.821 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 532' ' ' ARG . . . . . 0.634 HH21 ' HB3' ' A' ' 242' ' ' GLU . 4.4 ttm180 -60.79 -39.69 89.79 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 178.393 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 533' ' ' LEU . . . . . 0.404 ' O ' ' HG3' ' C' ' 537' ' ' LYS . 71.5 mt -72.05 -33.96 68.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.575 -0.738 . . . . 10.0 109.914 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 534' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' C' ' 530' ' ' ALA . 71.1 mm-40 -59.36 -43.91 92.76 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 178.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.61 -40.88 98.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.366 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 94.9 mt -69.66 -11.37 60.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.778 -0.646 . . . . 10.0 111.171 179.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 537' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' C' ' 533' ' ' LEU . 77.9 mttt -94.18 -51.87 4.63 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.924 -0.769 . . . . 10.0 108.924 178.303 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -59.28 -54.75 43.28 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.585 -0.734 . . . . 10.0 110.044 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -75.83 -23.97 55.81 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.725 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.22 -54.33 24.53 Favored Glycine 0 N--CA 1.449 -0.484 0 N-CA-C 111.176 -0.769 . . . . 10.0 111.176 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.7 -34.34 89.37 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 110.988 -0.845 . . . . 10.0 110.988 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -66.28 -53.21 39.4 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 55.2 mtt85 -59.57 -34.89 73.27 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.378 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 58.7 mt -63.27 -41.09 98.99 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.142 0.496 . . . . 10.0 109.775 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -72.83 -40.84 65.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.611 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 546' ' ' GLU . . . . . 0.468 ' HG2' ' HG2' ' A' ' 227' ' ' GLU . 44.2 mt-10 -60.65 -50.49 73.29 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.816 -0.629 . . . . 10.0 109.544 178.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -58.92 -38.61 79.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.062 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.55 -43.17 94.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.155 179.003 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 549' ' ' ALA . . . . . 0.45 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -66.15 -49.77 66.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.753 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 550' ' ' LYS . . . . . 0.404 ' HD2' ' O ' ' C' ' 546' ' ' GLU . 0.0 OUTLIER -61.4 -36.64 80.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.851 179.491 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.06 -40.84 95.28 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 71.0 m -62.54 -49.17 76.39 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.944 -0.761 . . . . 10.0 108.944 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 553' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 44.3 mt-10 -60.49 -38.71 85.19 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.175 178.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -66.45 -38.37 87.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.278 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 75.2 mt -67.44 -35.69 79.73 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 178.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 16.9 m -70.01 -37.69 75.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.259 0.552 . . . . 10.0 109.796 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 3.1 p -78.55 -5.0 51.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.519 0.676 . . . . 10.0 110.156 179.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 19.7 mt -98.88 -30.42 12.39 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.25 -0.886 . . . . 10.0 109.64 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.97 -30.33 69.59 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.027 0.441 . . . . 10.0 110.117 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -71.36 -5.76 34.96 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 121.505 0.669 . . . . 10.0 110.06 178.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 561' ' ' LYS . . . . . 0.479 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 11.3 mptt -113.12 -35.17 5.46 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.516 -0.766 . . . . 10.0 109.175 177.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -65.65 -24.91 67.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.248 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 563' ' ' LYS . . . . . 0.957 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 39.6 mtmt -102.89 -73.14 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.463 0 CA-C-O 119.208 -0.425 . . . . 10.0 111.969 179.167 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 564' ' ' PRO . . . . . 0.957 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 31.2 Cg_exo -58.95 -51.38 6.96 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 122.444 2.096 . . . . 10.0 113.735 -178.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 565' ' ' ALA . . . . . 0.479 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -64.13 -52.28 59.85 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.617 0.228 . . . . 10.0 111.617 -179.55 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 566' ' ' LEU . . . . . 0.599 HD23 HD12 ' C' ' 569' ' ' LEU . 16.5 mt -59.88 -40.73 89.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.864 -0.153 . . . . 10.0 111.4 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 567' ' ' GLU . . . . . 0.536 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 22.1 mm-40 -63.06 -45.43 92.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.719 0.295 . . . . 10.0 110.709 178.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -66.67 -32.57 73.96 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.732 -0.387 . . . . 10.0 110.382 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 569' ' ' LEU . . . . . 0.599 HD12 HD23 ' C' ' 566' ' ' LEU . 38.1 mt -63.2 -39.09 93.63 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 177.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 570' ' ' ARG . . . . . 0.434 ' HA ' ' HB2' ' C' ' 573' ' ' LEU . 84.4 mtt180 -71.95 -36.92 70.02 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.154 -0.684 . . . . 10.0 109.154 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 571' ' ' GLN . . . . . 0.536 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.7 mt-30 -64.01 -23.38 67.31 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.218 -0.901 . . . . 20.0 111.292 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -94.91 -33.0 6.84 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 109.317 -1.513 . . . . 10.0 109.317 178.034 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 573' ' ' LEU . . . . . 0.588 ' HA ' HG12 ' C' ' 576' ' ' VAL . 13.9 mt -62.46 -41.0 98.45 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.938 0.347 . . . . 10.0 111.938 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 574' ' ' LEU . . . . . 0.402 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 90.0 mt -58.26 -60.12 11.2 Favored Pre-proline 0 C--N 1.327 -0.389 0 C-N-CA 121.145 -0.222 . . . . 10.0 111.543 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 575' ' ' PRO . . . . . 0.402 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 30.0 Cg_endo -65.08 -31.42 54.99 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 122.052 1.835 . . . . 10.0 112.155 178.65 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 576' ' ' VAL . . . . . 0.588 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.8 OUTLIER -68.13 -36.51 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 C-N-CA 120.7 -0.4 . . . . 10.0 110.251 179.145 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 34.5 mt -71.26 -35.77 71.52 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 578' ' ' GLU . . . . . 0.456 ' O ' HG23 ' C' ' 582' ' ' VAL . 68.7 mt-10 -64.8 -50.35 67.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.125 178.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 2.7 p -64.6 -42.1 95.78 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.424 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 580' ' ' PHE . . . . . 0.519 ' HB2' ' O ' ' C' ' 576' ' ' VAL . 0.5 OUTLIER -60.48 -42.05 95.49 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 178.964 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 581' ' ' LYS . . . . . 0.442 ' O ' ' HG ' ' C' ' 585' ' ' LEU . 66.3 mttt -65.38 -38.86 91.3 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-N 115.932 -0.577 . . . . 10.0 110.679 178.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 582' ' ' VAL . . . . . 0.456 HG23 ' O ' ' C' ' 578' ' ' GLU . 49.0 t -59.38 -49.56 83.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 N-CA-C 109.437 -0.579 . . . . 10.0 109.437 178.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 4.6 m -62.78 -40.12 96.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.876 178.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 584' ' ' PHE . . . . . 0.462 ' O ' ' HG ' ' C' ' 588' ' ' LEU . 0.8 OUTLIER -63.59 -45.63 89.54 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.958 -0.565 . . . . 10.0 111.066 179.425 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 585' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' C' ' 581' ' ' LYS . 52.7 mt -59.97 -42.3 93.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.306 -0.407 . . . . 10.0 110.272 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 586' ' ' SER . . . . . 0.504 ' O ' ' HG3' ' C' ' 590' ' ' GLU . 20.8 m -67.56 -46.91 71.35 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.01 -0.737 . . . . 10.0 109.01 178.528 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 587' ' ' ALA . . . . . 0.739 ' HA ' ' HE3' ' A' ' 396' ' ' LYS . . . -55.9 -50.92 69.34 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.596 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 588' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' C' ' 584' ' ' PHE . 97.0 mt -55.41 -54.0 49.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.845 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 589' ' ' GLU . . . . . 0.407 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 18.4 mt-10 -65.07 -50.08 67.55 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.941 0.348 . . . . 10.0 111.941 -179.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 590' ' ' GLU . . . . . 0.504 ' HG3' ' O ' ' C' ' 586' ' ' SER . 35.7 mt-10 -60.38 -37.44 80.78 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -179.147 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -71.18 -39.85 71.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.536 0.207 . . . . 10.0 111.069 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 83.8 m -59.52 -33.81 71.84 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.963 0.411 . . . . 10.0 110.401 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 593' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 93.8 mttt -63.93 -22.36 66.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.833 -0.621 . . . . 10.0 111.583 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 594' ' ' LYS . . . . . 0.408 ' NZ ' ' HB2' ' A' ' 388' ' ' SER . 0.0 OUTLIER -101.67 -24.62 14.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.896 0.379 . . . . 10.0 110.699 179.093 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 81.3 mt -75.95 -31.19 58.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.326 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 . . . . . 0 C--O 1.245 0.823 0 CA-C-O 118.566 -0.731 . . . . 10.0 110.495 179.823 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 17.6 mmt . . . . . 0 C--O 1.233 0.235 0 CA-C-O 121.162 0.506 . . . . 10.0 110.597 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 2.7 m -99.1 -55.83 2.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.666 -0.697 . . . . 10.0 111.085 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -81.39 144.51 31.38 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.292 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -128.93 109.48 11.28 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.661 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 40.8 mmtt -93.41 106.07 18.07 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.356 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.536 ' HB3' HD23 ' B' ' 159' ' ' LEU . 8.7 mt -102.6 108.4 19.66 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.733 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 49.9 t -99.89 115.04 40.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.189 0.518 . . . . 10.0 110.61 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.495 HG22 HD12 ' B' ' 79' ' ' LEU . 39.3 t -87.73 112.35 23.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.594 HG21 HD11 ' B' ' 100' ' ' ILE . 17.6 m -108.95 160.16 7.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.826 0.346 . . . . 10.0 111.038 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 158.35 171.86 24.76 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.596 -0.812 . . . . 10.0 111.938 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.41 -176.82 3.31 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.156 0.503 . . . . 10.0 112.13 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -92.51 111.41 4.06 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.005 -0.617 . . . . 10.0 112.489 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 124.08 -20.28 7.16 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.905 -0.664 . . . . 10.0 111.959 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.446 HG23 ' HG3' ' B' ' 16' ' ' LYS . 24.8 m -53.38 -51.67 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 112.658 0.614 . . . . 10.0 112.658 -179.459 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.55 29.54 1.41 Allowed Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.461 -0.876 . . . . 10.0 113.944 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.446 ' HG3' HG23 ' B' ' 14' ' ' VAL . 49.8 mtmt -58.73 -51.21 70.92 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.258 0.551 . . . . 10.0 110.715 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.09 -44.66 91.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.325 -0.852 . . . . 10.0 111.484 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.32 -46.22 89.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.35 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 46.4 mt -62.6 -39.15 92.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.837 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 18.6 m -67.8 -45.86 73.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.791 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 67.5 mt -65.48 -31.67 54.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.173 0.511 . . . . 10.0 110.087 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.484 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 6.4 tp-100 -69.58 -20.53 63.65 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.332 179.002 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 6.8 tp -92.16 -46.74 7.6 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.415 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' ILE . . . . . 0.455 HD11 HD13 ' B' ' 55' ' ' ILE . 40.8 mm -75.73 -63.8 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 112.781 0.66 . . . . 10.0 112.781 -178.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -87.79 -15.86 35.73 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.025 0.38 . . . . 10.0 112.025 -178.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.484 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 64.6 t30 66.21 47.67 1.8 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.629 0.728 . . . . 10.0 110.046 -179.373 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 51.6 t60 -143.14 134.62 26.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.458 -0.792 . . . . 10.0 110.388 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -93.35 133.65 36.38 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.381 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 6.1 m -98.19 137.45 25.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.095 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -94.26 -18.15 21.95 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.359 0.599 . . . . 10.0 110.467 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -93.2 175.88 6.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.692 -0.686 . . . . 10.0 111.684 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.696 ' HA ' H5'1 ' B' ' 201' ' ' GNP . 70.5 t80 -94.95 133.99 38.1 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.872 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -101.31 95.81 5.35 Favored Pre-proline 0 C--O 1.235 0.298 0 N-CA-C 110.113 -0.328 . . . . 10.0 110.113 178.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 34' ' ' PRO . . . . . 0.615 ' HD3' ' O ' ' B' ' 32' ' ' TYR . 23.0 Cg_exo -66.31 103.97 0.7 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.545 2.163 . . . . 10.0 108.509 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 87.8 m -120.32 141.12 50.32 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 114.117 1.154 . . . . 10.0 114.117 -176.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.463 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 5.0 mp -113.82 -28.58 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 N-CA-C 106.583 -1.636 . . . . 10.0 106.583 176.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.434 ' HB3' HG23 ' D' ' 821' ' ' VAL . 30.1 tt0 -176.65 103.5 0.06 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 114.651 -1.159 . . . . 10.0 110.378 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 38' ' ' ASP . . . . . 1.034 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 52.6 m-20 -114.35 139.03 49.8 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.034 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 39' ' ' SER . . . . . 0.558 ' HB2' ' HB3' ' D' ' 818' ' ' GLN . 4.0 m -116.01 131.0 57.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.91 0.385 . . . . 10.0 111.8 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 40' ' ' TYR . . . . . 0.401 ' HB3' HG13 ' B' ' 24' ' ' ILE . 93.2 m-85 -129.81 150.06 51.27 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.111 -0.7 . . . . 10.0 109.111 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 41' ' ' ARG . . . . . 0.483 ' HB2' ' NE2' ' D' ' 818' ' ' GLN . 35.4 ttp180 -165.1 136.98 4.23 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.08 -0.248 . . . . 10.0 111.436 -178.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 7.4 tttm -150.58 162.9 39.75 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.376 -0.601 . . . . 10.0 109.376 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -103.09 118.15 36.16 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.886 -0.412 . . . . 10.0 109.886 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 9.1 m -139.36 166.99 20.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-O 121.056 0.455 . . . . 10.0 111.303 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.555 ' HA ' ' HA ' ' B' ' 50' ' ' THR . 10.9 t -96.93 129.23 47.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 109.122 -0.696 . . . . 10.0 109.122 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 46' ' ' ILE . . . . . 0.727 HD13 HG11 ' B' ' 160' ' ' VAL . 9.6 mt -113.29 94.38 3.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.752 0.311 . . . . 10.0 111.095 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 61.56 41.17 12.74 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.521 -0.763 . . . . 10.0 111.744 178.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.56 -33.19 6.04 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.532 -0.758 . . . . 10.0 112.284 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.505 ' OE1' ' H71' ' A' ' 30' ' ' PCW . 49.2 mt-10 -91.87 111.67 23.29 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.778 0.323 . . . . 10.0 110.928 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.555 ' HA ' ' HA ' ' B' ' 45' ' ' VAL . 3.8 m -76.74 132.3 39.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.782 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 73.5 m -148.75 175.64 11.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.749 0.309 . . . . 10.0 111.368 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 22.3 tp -106.56 126.27 52.05 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.596 -0.52 . . . . 10.0 109.596 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.462 HD22 HD11 ' B' ' 6' ' ' LEU . 66.7 mt -105.76 126.82 52.61 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.5 0.556 . . . . 10.0 112.5 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -106.56 117.04 33.0 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.129 -1.063 . . . . 10.0 108.129 178.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.455 HD13 HD11 ' B' ' 24' ' ' ILE . 4.0 mp -113.5 143.53 23.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 120.598 0.237 . . . . 10.0 111.125 -178.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 12.4 tp -128.1 122.71 32.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.895 0.378 . . . . 10.0 111.823 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 1.034 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 12.6 t0 -88.51 105.95 17.96 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 107.429 -1.323 . . . . 10.0 107.429 178.447 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 27.1 p -80.9 164.65 22.47 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.539 0.94 . . . . 10.0 113.539 -177.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.463 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -73.22 140.0 46.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.218 179.045 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.68 -9.78 60.95 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.607 -0.806 . . . . 10.0 112.413 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -141.13 79.21 1.68 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.198 0.523 . . . . 20.0 110.241 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -134.62 152.83 52.06 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.057 -179.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -103.42 -154.45 0.5 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.319 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -82.79 103.0 11.95 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.3 -0.56 . . . . 10.0 111.099 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -123.14 143.07 50.24 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.708 -0.678 . . . . 10.0 109.84 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.37 -30.98 71.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.949 0.404 . . . . 10.0 110.396 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 1.1 mmt -61.42 -45.95 92.15 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.561 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.446 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 14.4 ttm180 -64.21 -43.58 94.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.545 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.444 ' O ' ' HB2' ' B' ' 73' ' ' ARG . 0.1 OUTLIER -62.4 -19.2 63.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.761 -0.654 . . . . 10.0 111.357 179.921 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -97.03 -45.75 6.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.298 179.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 71' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' B' ' 68' ' ' ARG 0.282 0.6 OUTLIER -69.05 -25.44 64.47 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 113.124 0.787 . . . . 10.0 113.124 -179.077 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 34.0 mtp -93.72 2.25 56.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.237 0.541 . . . . 10.0 110.134 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 73' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' B' ' 69' ' ' ASP . 10.8 ttm180 -95.54 -25.86 16.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.731 -179.634 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.44 -4.17 58.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.7 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -83.81 156.53 33.08 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.752 -0.737 . . . . 10.0 112.687 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -113.88 -46.49 3.02 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.188 0.518 . . . . 10.0 109.693 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 77' ' ' GLY . . . . . 0.426 ' HA3' HD11 ' B' ' 163' ' ' ILE . . . -111.63 137.26 14.16 Favored Glycine 0 N--CA 1.444 -0.797 0 N-CA-C 110.161 -1.176 . . . . 10.0 110.161 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -122.02 124.11 43.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.26 0.552 . . . . 10.0 112.406 -178.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.929 ' HG ' HD22 ' B' ' 159' ' ' LEU . 70.2 mt -97.18 110.27 22.85 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.472 -0.785 . . . . 10.0 109.685 179.068 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 80' ' ' CYS . . . . . 0.54 ' HB3' HD12 ' B' ' 93' ' ' ILE . 26.3 m -85.94 92.81 8.78 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.491 HG22 ' HB ' ' B' ' 114' ' ' VAL . 47.1 t -91.36 121.96 42.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.847 -0.615 . . . . 10.0 112.203 -178.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.736 ' HB3' HD11 ' B' ' 93' ' ' ILE . 29.7 p90 -128.33 158.95 36.8 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.419 -0.81 . . . . 10.0 109.066 178.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -100.13 126.05 46.33 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 110.088 -0.338 . . . . 10.0 110.088 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 84' ' ' ILE . . . . . 0.769 HD11 ' HA ' ' B' ' 118' ' ' CYS . 32.0 pt -69.49 -9.98 12.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.394 0.616 . . . . 10.0 110.288 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 85' ' ' ASN . . . . . 0.415 ' HA ' ' O ' ' B' ' 122' ' ' SER . 0.0 OUTLIER -87.68 -11.83 47.18 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.095 -0.957 . . . . 10.0 110.353 179.298 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -133.08 106.86 7.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.028 -178.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.26 -31.67 70.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.698 -0.683 . . . . 10.0 112.357 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -61.42 -35.58 77.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.696 0.284 . . . . 10.0 110.493 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 15.6 m -66.5 -32.69 74.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.475 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 90' ' ' PHE . . . . . 0.439 ' CE1' ' HA ' ' B' ' 130' ' ' ALA . 51.5 t80 -68.64 -39.08 80.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.55 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -76.67 -25.76 54.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.259 0.552 . . . . 10.0 110.621 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -68.63 -17.64 64.15 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.841 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 93' ' ' ILE . . . . . 0.736 HD11 ' HB3' ' B' ' 82' ' ' PHE . 34.2 mm -57.92 -39.53 72.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.742 179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 67.0 t60 -67.5 -37.5 82.93 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.61 -0.515 . . . . 10.0 109.61 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -63.45 -36.09 82.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.577 -0.738 . . . . 10.0 110.022 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 96' ' ' TYR . . . . . 0.483 ' CD1' ' HB ' ' B' ' 9' ' ' VAL . 1.1 m-85 -80.01 -40.41 27.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.435 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 97' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' B' ' 97' ' ' ARG . 1.9 ttm180 -56.65 -45.25 81.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.558 -0.292 . . . . 10.0 111.177 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 63.1 mm-40 -64.35 -38.76 92.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.906 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -62.71 -42.49 99.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.0 -0.545 . . . . 10.0 109.718 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 100' ' ' ILE . . . . . 0.594 HD11 HG21 ' B' ' 9' ' ' VAL . 57.9 mt -66.26 -47.47 84.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.757 179.417 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 101' ' ' LYS . . . . . 0.886 ' HG2' ' HA ' ' B' ' 107' ' ' GLU . 49.6 mtpt -57.15 -41.38 79.02 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.86 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 55.4 ttp85 -68.45 -46.55 69.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.909 -0.587 . . . . 10.0 112.313 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 35.1 m -68.27 -30.78 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.177 0 N-CA-C 112.551 0.575 . . . . 10.0 112.551 -179.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -87.15 -9.34 55.51 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 121.152 -0.219 . . . . 10.0 111.14 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 5.9 t70 63.06 29.91 16.27 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 123.803 0.69 . . . . 10.0 111.25 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 53.1 m -163.48 145.08 9.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.486 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 107' ' ' GLU . . . . . 0.886 ' HA ' ' HG2' ' B' ' 101' ' ' LYS . 0.0 OUTLIER -90.29 -11.34 41.1 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.541 0.686 . . . . 10.0 109.271 178.574 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -91.24 72.63 6.22 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.794 -1.094 . . . . 10.0 109.532 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.455 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 58.6 t -123.09 133.43 24.51 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.361 -179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 110' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 26.8 Cg_exo -63.0 107.89 0.69 Allowed 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.819 2.346 . . . . 10.0 111.555 179.138 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 54.4 mtt -127.0 153.15 46.29 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.118 -0.492 . . . . 10.0 109.91 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 112' ' ' VAL . . . . . 0.705 ' HB ' HD23 ' B' ' 79' ' ' LEU . 92.6 t -134.11 132.57 55.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 109.307 -0.627 . . . . 10.0 109.307 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 20.1 tp -85.89 117.94 25.06 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 114' ' ' VAL . . . . . 0.491 ' HB ' HG22 ' B' ' 81' ' ' VAL . 23.2 t -114.52 117.88 56.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.972 0.415 . . . . 10.0 111.496 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -101.14 110.51 3.9 Favored Glycine 0 N--CA 1.45 -0.407 0 N-CA-C 110.517 -1.033 . . . . 10.0 110.517 178.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -97.75 166.38 11.51 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.031 0.382 . . . . 10.0 112.031 -178.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 36.8 mttm 72.55 35.05 1.17 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 123.702 0.801 . . . . 10.0 112.187 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 118' ' ' CYS . . . . . 0.769 ' HA ' HD11 ' B' ' 84' ' ' ILE . 31.7 p -71.47 -13.36 61.79 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.064 0.394 . . . . 10.0 112.064 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -88.99 2.53 53.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.967 0.413 . . . . 10.0 111.172 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 38.0 mt -98.07 137.51 20.86 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.044 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -74.73 -14.14 21.9 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.768 2.312 . . . . 10.0 111.899 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 122' ' ' SER . . . . . 0.415 ' O ' ' HA ' ' B' ' 85' ' ' ASN . 0.6 OUTLIER -79.25 37.25 0.32 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.295 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -71.21 110.43 5.86 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.378 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.58 -18.22 14.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.063 179.136 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 40.4 t -105.68 113.9 43.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 115.658 -0.701 . . . . 10.0 109.543 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -76.39 152.43 36.28 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.662 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.5 -44.05 93.19 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.768 -0.651 . . . . 10.0 112.401 -179.489 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 8.4 tmtm? -61.25 -40.1 92.8 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.946 0.403 . . . . 10.0 110.908 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -63.45 -44.48 94.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.683 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 130' ' ' ALA . . . . . 0.439 ' HA ' ' CE1' ' B' ' 90' ' ' PHE . . . -66.63 -44.93 80.68 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.236 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -62.35 -36.16 81.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.748 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.47 -47.87 80.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.778 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 18.9 tp -63.96 -41.84 97.45 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.501 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.69 -47.1 86.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.436 179.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -62.95 -34.96 78.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.977 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 14.7 m -66.55 -25.75 66.81 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.213 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 16.2 m-30 -99.69 -4.73 30.16 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.473 -0.331 . . . . 10.0 111.481 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 71.53 33.24 64.01 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 111.624 -0.59 . . . . 10.0 111.624 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 48.8 pt -123.54 147.71 53.69 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-O 120.574 0.226 . . . . 10.0 110.813 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 140' ' ' PRO . . . . . 0.437 ' HG2' HG22 ' B' ' 112' ' ' VAL . 59.2 Cg_endo -73.07 151.92 50.45 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.625 2.216 . . . . 10.0 111.714 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -114.2 127.16 55.77 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.766 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 34.4 mm -125.14 122.05 62.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.082 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -90.89 124.37 35.13 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.595 -0.891 . . . . 10.0 108.595 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 144' ' ' THR . . . . . 0.476 ' HA ' ' O ' ' B' ' 150' ' ' GLN . 44.6 p -130.34 172.66 11.6 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 122.105 0.955 . . . . 10.0 113.373 -177.094 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 145' ' ' SER . . . . . 0.431 ' HB2' ' SG ' ' B' ' 118' ' ' CYS . 6.0 t -160.99 117.08 2.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.045 -1.434 . . . . 10.0 107.341 178.086 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.57 -17.87 62.91 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.769 0.319 . . . . 10.0 111.244 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 70.5 tttt -84.0 -44.61 13.98 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.209 0.448 . . . . 10.0 112.209 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 36.6 p -93.8 -13.69 27.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.735 0.302 . . . . 10.0 111.317 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 18.6 ttt-85 67.49 44.98 1.64 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.078 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 150' ' ' GLN . . . . . 0.476 ' O ' ' HA ' ' B' ' 144' ' ' THR . 21.6 tt0 -85.33 103.24 14.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.486 -0.779 . . . . 10.0 111.592 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 58.9 37.23 90.62 Favored Glycine 0 CA--C 1.519 0.285 0 CA-C-N 115.889 -0.596 . . . . 10.0 114.306 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 70.4 t -66.25 -54.52 25.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.911 0.386 . . . . 10.0 110.711 -179.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.45 -32.38 71.28 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -58.17 -42.62 86.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.85 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.89 -48.19 82.29 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.966 0.412 . . . . 10.0 110.64 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -65.17 -43.15 92.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.808 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 16.0 m-30 -60.71 -41.89 96.15 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.419 179.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 32.8 m -58.93 -38.16 78.34 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.501 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.929 HD22 ' HG ' ' B' ' 79' ' ' LEU . 24.2 tp -62.4 -46.11 90.08 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.047 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 160' ' ' VAL . . . . . 0.727 HG11 HD13 ' B' ' 46' ' ' ILE . 43.2 t -64.04 -39.35 85.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.987 -0.552 . . . . 10.0 109.571 178.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -63.53 -29.96 71.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.705 -0.679 . . . . 10.0 110.683 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -77.97 -43.72 28.84 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.208 178.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 163' ' ' ILE . . . . . 0.426 HD11 ' HA3' ' B' ' 77' ' ' GLY . 93.2 mt -60.17 -45.32 96.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.475 179.24 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -59.48 -48.12 82.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.356 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -66.39 -36.13 82.07 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.966 0.412 . . . . 10.0 110.821 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -63.04 -44.19 96.58 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.524 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -71.77 -39.41 69.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.604 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -57.55 -40.75 79.58 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.259 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -59.93 -36.04 76.21 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.936 -0.574 . . . . 10.0 112.165 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 25.3 mmt -90.44 -22.96 21.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.87 0.367 . . . . 10.0 111.556 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 31.4 t -79.37 -39.04 33.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.968 -179.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -95.24 3.99 53.98 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.732 -179.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 173' ' ' ASP . . . . . 0.464 ' OD1' ' H81' ' A' ' 18' ' ' PCW . 27.8 t70 70.26 -56.05 0.6 Allowed 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.497 -0.774 . . . . 10.0 112.977 178.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 96.66 -75.68 0.72 Allowed Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 121.217 -0.515 . . . . 10.0 111.976 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 60.7 mmtt -114.15 100.5 8.42 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.981 -0.377 . . . . 10.0 109.981 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.68 130.3 42.44 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.646 -179.427 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -60.5 116.64 4.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.564 -0.744 . . . . 10.0 110.468 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -130.34 -30.48 1.92 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.253 -0.43 . . . . 10.0 111.347 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 95.7 mttt 70.0 121.99 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.43 0 O-C-N 123.684 0.615 . . . . 10.0 112.454 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 11.3 tptp -139.26 127.07 22.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.97 -179.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 23.3 m 70.41 155.36 0.14 Allowed 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 113.131 0.789 . . . . 10.0 113.131 179.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -153.12 -67.02 0.15 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.177 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 2.1 m -103.58 131.61 50.56 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.962 -0.563 . . . . 10.0 109.511 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 81.9 tttt 64.13 87.02 0.12 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.448 0.642 . . . . 10.0 111.186 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 4.9 t . . . . . 0 C--N 1.323 -0.557 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.903 -179.558 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.285 0 N-CA-C 111.503 -0.639 . . . . 10.0 111.503 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.01 136.73 52.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.737 0.303 . . . . 10.0 111.404 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 20.9 t -122.57 142.07 40.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.977 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 811' ' ' LYS . . . . . 0.656 ' HG2' HG22 ' D' ' 821' ' ' VAL . 70.1 mttt -93.92 125.78 38.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.033 0.444 . . . . 10.0 111.641 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 59.4 t -99.47 118.22 45.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.082 -0.71 . . . . 10.0 109.082 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 813' ' ' TYR . . . . . 0.437 ' HB2' HG22 ' D' ' 876' ' ' ILE . 83.9 m-85 -91.84 113.79 26.16 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.173 0.511 . . . . 10.0 111.185 -179.004 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 814' ' ' LEU . . . . . 0.68 HD13 ' HD2' ' D' ' 841' ' ' ARG . 23.6 mt -81.04 150.39 68.46 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.329 -0.851 . . . . 10.0 110.94 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 815' ' ' PRO . . . . . 0.721 ' HD3' ' HB ' ' D' ' 877' ' ' VAL . 37.3 Cg_endo -65.24 -7.41 15.6 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.178 2.585 . . . . 10.0 113.295 -179.267 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -90.28 17.22 7.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.986 0.422 . . . . 10.0 110.618 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 53.8 tttt 66.23 45.03 2.38 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 115.429 -0.805 . . . . 10.0 111.72 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 818' ' ' GLN . . . . . 0.558 ' HB3' ' HB2' ' B' ' 39' ' ' SER . 54.5 mt-30 -146.33 175.48 10.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.608 179.248 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.33 167.76 23.51 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.894 0.702 . . . . 10.0 112.894 -178.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 2.6 t -147.63 145.26 28.9 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.101 -0.954 . . . . 10.0 108.833 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 821' ' ' VAL . . . . . 0.656 HG22 ' HG2' ' D' ' 811' ' ' LYS . 21.9 t -101.1 115.25 42.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.963 0.411 . . . . 10.0 111.328 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 24.1 t -110.66 141.54 25.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.449 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 1.2 m -80.84 128.13 33.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 42.5 t -66.28 127.86 28.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.735 0.302 . . . . 10.0 110.477 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 825' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' D' ' 825' ' ' ARG . 0.6 OUTLIER -118.91 127.4 53.45 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.983 0.42 . . . . 10.0 110.881 179.909 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -77.05 74.6 3.63 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.675 -0.693 . . . . 10.0 112.349 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 165.41 -40.18 0.28 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.506 -0.854 . . . . 10.0 112.769 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 10.5 ptm -75.22 154.85 37.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.041 0.448 . . . . 10.0 111.738 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 829' ' ' SER . . . . . 0.58 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.5 OUTLIER -98.81 169.4 9.49 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.164 -179.473 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 87.6 t -57.95 -42.92 83.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.515 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 831' ' ' TYR . . . . . 0.732 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 83.0 t80 -56.03 -34.72 66.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.828 -0.624 . . . . 10.0 111.321 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -77.27 -49.39 15.16 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.306 -0.406 . . . . 10.0 111.133 -179.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 3.4 m -63.39 -40.79 98.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.396 -0.366 . . . . 10.0 111.626 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -71.58 -24.11 61.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.536 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -63.8 -32.55 74.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.037 0.446 . . . . 10.0 110.274 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 14.0 tttm -72.47 -6.42 43.62 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.552 -0.749 . . . . 10.0 111.282 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 837' ' ' ALA . . . . . 0.439 ' HB1' HD21 ' D' ' 814' ' ' LEU . . . -117.73 -46.77 2.64 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.967 0.413 . . . . 10.0 111.49 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 838' ' ' LEU . . . . . 0.427 HD12 ' HG3' ' D' ' 845' ' ' GLN . 74.8 mt -65.73 -43.92 87.56 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.819 0.674 . . . . 10.0 112.819 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -67.75 -21.24 65.28 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.131 0.419 . . . . 10.0 112.131 -179.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 50.5 t -75.54 -23.67 16.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.042 0.449 . . . . 10.0 110.583 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 841' ' ' ARG . . . . . 0.68 ' HD2' HD13 ' D' ' 814' ' ' LEU . 5.6 mtt-85 -106.55 -6.9 17.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.628 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 85.1 40.22 8.11 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.786 -0.721 . . . . 10.0 112.633 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 76.1 mt -114.68 129.04 56.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.791 0.329 . . . . 10.0 110.65 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -90.53 134.61 34.25 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.052 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 845' ' ' GLN . . . . . 0.427 ' HG3' HD12 ' D' ' 838' ' ' LEU . 14.7 mp0 -57.61 -34.25 69.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.965 -0.562 . . . . 10.0 112.096 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -72.01 -5.6 36.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.137 0.494 . . . . 10.0 111.565 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 3.6 m -126.04 25.43 6.75 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.081 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 64.3 m -145.31 165.22 29.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.01 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 11.4 p -143.66 145.86 21.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.886 -0.412 . . . . 10.0 109.886 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 850' ' ' VAL . . . . . 0.45 HG22 HG22 ' D' ' 877' ' ' VAL . 60.2 t -114.43 135.75 53.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.9 0.381 . . . . 10.0 110.944 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 851' ' ' TYR . . . . . 0.725 ' HB2' HG13 ' D' ' 876' ' ' ILE . 78.4 m-85 -118.69 141.35 48.69 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.194 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 852' ' ' ARG . . . . . 0.539 ' HD3' HD11 ' D' ' 870' ' ' LEU . 34.3 mtm180 -94.08 121.9 36.04 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.136 -0.69 . . . . 10.0 109.136 178.503 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 853' ' ' LEU . . . . . 0.959 ' HG ' ' H41' ' A' ' 24' ' ' PCW . 1.1 tm? -84.19 113.67 21.25 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.113 -179.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 15.9 mt -111.07 72.96 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.685 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 96.1 mttt 66.43 9.09 6.22 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.998 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 147.28 -42.44 0.9 Allowed Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 121.109 -0.567 . . . . 10.0 111.848 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 857' ' ' ARG . . . . . 0.792 HH12 ' H39' ' A' ' 24' ' ' PCW . 7.3 mmt180 -69.74 139.94 53.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.737 0.303 . . . . 10.0 111.27 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -108.86 120.75 43.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.366 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 6.9 m -115.31 132.0 56.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.864 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 860' ' ' VAL . . . . . 0.575 HG22 ' HE1' ' D' ' 851' ' ' TYR . 11.5 t -65.73 137.78 24.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.646 -0.252 . . . . 10.0 111.052 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -124.5 149.3 47.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.528 -0.306 . . . . 10.0 110.268 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -92.74 163.99 13.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.83 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 863' ' ' TRP . . . . . 0.732 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 88.2 m95 -80.35 -34.44 36.52 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.237 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -72.36 -10.66 60.07 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.677 0.621 . . . . 10.0 112.677 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 2.7 m -68.01 148.61 50.79 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 110.032 -0.358 . . . . 10.0 110.032 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 866' ' ' ALA . . . . . 0.58 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -80.22 152.46 29.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.506 0.193 . . . . 10.0 110.7 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 6.0 tp -89.76 -4.92 10.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.241 0.543 . . . . 10.0 110.871 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -56.99 -50.99 85.03 Favored Pre-proline 0 CA--C 1.539 0.543 0 N-CA-C 113.342 0.867 . . . . 10.0 113.342 -179.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -76.61 6.02 4.37 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 121.912 1.741 . . . . 10.0 113.171 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 870' ' ' LEU . . . . . 0.539 HD11 ' HD3' ' D' ' 852' ' ' ARG . 3.4 mm? -90.75 47.03 1.37 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.218 0.532 . . . . 10.0 111.151 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -93.33 108.35 20.02 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.464 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 90.83 -0.23 76.17 Favored Glycine 0 CA--C 1.517 0.193 0 C-N-CA 121.069 -0.586 . . . . 10.0 113.617 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 873' ' ' GLU . . . . . 0.464 ' OE1' ' HD2' ' D' ' 852' ' ' ARG . 5.4 mt-10 -98.73 134.88 41.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.861 0.331 . . . . 10.0 111.286 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 874' ' ' GLU . . . . . 0.502 ' HB2' ' HB3' ' D' ' 853' ' ' LEU . 51.7 mt-10 -83.85 139.92 32.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 10.0 109.937 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 96.1 mt -114.13 118.2 33.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.109 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 876' ' ' ILE . . . . . 0.725 HG13 ' HB2' ' D' ' 851' ' ' TYR . 1.3 pt -111.69 120.36 61.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.385 179.42 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 877' ' ' VAL . . . . . 0.721 ' HB ' ' HD3' ' D' ' 815' ' ' PRO . 6.1 t -97.64 142.8 13.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.333 -178.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 878' ' ' GLU . . . . . 0.499 ' OE1' ' H61' ' A' ' 7' ' ' PCW . 9.8 mm-40 -125.26 160.04 30.22 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.547 178.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 879' ' ' VAL . . . . . 0.884 ' HB ' ' H72' ' A' ' 7' ' ' PCW . 80.8 t -93.79 132.46 37.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 116.258 -0.428 . . . . 10.0 109.999 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 880' ' ' LEU . . . . . 0.4 ' C ' ' H52' ' A' ' 4' ' ' PCW . 44.6 mt . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.377 -0.82 . . . . 10.0 109.589 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PCW . . . . . 0.877 H152 ' H33' ' A' ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PCW . . . . . 0.479 H361 H421 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PCW . . . . . 0.628 H221 H182 ' A' ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PCW . . . . . 0.663 H332 H132 ' A' ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PCW . . . . . 0.699 ' H39' ' H83' ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PCW . . . . . 0.632 H272 H481 ' A' ' 24' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PCW . . . . . 0.884 ' H72' ' HB ' ' D' ' 879' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PCW . . . . . 0.565 H211 H261 ' A' ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PCW . . . . . 0.611 H451 H342 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PCW . . . . . 0.558 ' H62' ' H40' ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PCW . . . . . 0.765 H322 ' H62' ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PCW . . . . . 0.597 H411 H12A ' A' ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PCW . . . . . 0.735 H181 H162 ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PCW . . . . . 0.635 ' H42' H371 ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PCW . . . . . 0.874 ' H71' ' H2 ' ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PCW . . . . . 0.715 H152 ' H19' ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PCW . . . . . 0.699 ' H83' ' H39' ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PCW . . . . . 0.735 H162 H181 ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PCW . . . . . 0.628 H182 H221 ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PCW . . . . . 0.646 H462 H411 ' A' ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PCW . . . . . 0.676 H152 H272 ' A' ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PCW . . . . . 0.558 ' H40' ' H62' ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PCW . . . . . 0.635 H371 ' H42' ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PCW . . . . . 0.959 ' H41' ' HG ' ' D' ' 853' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PCW . . . . . 0.611 H342 H451 ' A' ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PCW . . . . . 0.721 H472 H261 ' A' ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PCW . . . . . 0.578 H411 H151 ' A' ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PCW . . . . . 0.765 ' H62' H322 ' A' ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PCW . . . . . 0.658 ' H32' ' HN1' ' A' ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PCW . . . . . 0.646 H411 H462 ' A' ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PCW . . . . . 0.544 H161 H262 ' A' ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' 17F . . . . . 0.676 H11A H11A ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' 17F . . . . . 0.853 ' H9 ' ' H63' ' A' ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' 17F . . . . . 0.676 H11A H11A ' A' ' 33' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' 17F . . . . . 0.597 H12A H411 ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' 17F . . . . . 0.709 ' H10' ' H31' ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' 17F . . . . . 0.877 ' H33' H152 ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' 17F . . . . . 0.874 ' H2 ' ' H71' ' A' ' 15' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' 17F . . . . . 0.853 ' H63' ' H9 ' ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PCW . . . . . 0.551 ' H31' H351 ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PCW . . . . . 0.619 ' H31' H151 ' A' ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PCW . . . . . 0.977 ' H82' HN1A ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PCW . . . . . 0.561 ' O11' ' H82' ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PCW . . . . . 0.674 H362 H152 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PCW . . . . . 0.622 ' H61' ' O1 ' ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PCW . . . . . 0.635 ' H61' H422 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PCW . . . . . 0.788 ' H32' ' H62' ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PCW . . . . . 0.757 ' H31' ' H4 ' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PCW . . . . . 0.676 H272 H152 ' A' ' 21' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PCW . . . . . 0.551 H351 ' H31' ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PCW . . . . . 0.645 H371 H411 ' A' ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PCW . . . . . 0.603 H131 H331 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PCW . . . . . 0.605 H441 H242 ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PCW . . . . . 0.413 H411 H381 ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PCW . . . . . 0.788 ' H62' ' H32' ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PCW . . . . . 0.701 ' H12' H431 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PCW . . . . . 0.582 ' H2 ' ' H9A' ' A' ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' PCW . . . . . 0.848 H151 H442 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PCW . . . . . 0.848 H442 H151 ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PCW . . . . . 0.744 ' H31' ' H2 ' ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PCW . . . . . 0.702 H462 H483 ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PCW . . . . . 0.605 H242 H441 ' A' ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PCW . . . . . 0.405 H281 ' HB1' ' C' ' 485' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PCW . . . . . 0.671 H451 ' H29' ' A' ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PCW . . . . . 0.747 H142 H371 ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PCW . . . . . 0.721 H261 H472 ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PCW . . . . . 0.619 H151 ' H31' ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PCW . . . . . 0.406 H321 ' O1P' ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PCW . . . . . 0.675 ' H19' ' H81' ' A' ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PCW . . . . . 0.744 ' H2 ' ' H31' ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' 17F . . . . . 0.622 ' O1 ' ' H61' ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' 17F . . . . . 0.977 HN1A ' H82' ' A' ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' 17F . . . . . 0.406 ' H2 ' ' C8 ' ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' 17F . . . . . 0.523 ' H38' ' H59' ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' 17F . . . . . 0.582 ' H9A' ' H2 ' ' A' ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' 17F . . . . . 0.757 ' H4 ' ' H31' ' A' ' 50' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' 17F . . . . . 0.671 ' H29' H451 ' A' ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' 17F . . . . . 0.605 ' H36' H461 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 201' ' ' GNP . . . . . 0.696 H5'1 ' HA ' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 90.3 mt . . . . . 0 N--CA 1.457 -0.102 0 CA-C-O 120.982 0.42 . . . . 10.0 110.69 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -63.35 -34.26 77.32 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.562 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 88.1 mt -67.73 -37.79 82.66 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.324 179.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 66.9 mt -69.86 -40.79 75.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.786 -0.643 . . . . 10.0 111.376 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -63.12 -44.44 95.61 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.296 0.57 . . . . 10.0 109.764 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 206' ' ' ASN . . . . . 0.458 ' O ' HG23 ' A' ' 210' ' ' VAL . 50.1 t30 -64.65 -42.97 95.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.674 178.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -58.26 -41.81 85.1 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.43 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -61.92 -36.33 81.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.998 0.428 . . . . 10.0 110.8 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 41.6 m -72.0 -22.59 61.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.399 179.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 210' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 206' ' ' ASN . 77.0 t -80.45 -39.46 18.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 7.5 m -61.49 -44.1 97.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.133 179.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.38 -43.41 94.56 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.013 -0.54 . . . . 10.0 111.443 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.3 -44.33 91.95 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.753 0.311 . . . . 10.0 110.283 179.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -62.7 -35.2 78.96 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.909 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 9.9 m -72.65 -44.26 62.09 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.526 -0.306 . . . . 10.0 110.542 178.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -61.38 -43.8 98.25 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.724 -0.472 . . . . 10.0 109.724 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 67.8 mt -62.44 -40.74 97.56 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.619 -0.718 . . . . 10.0 110.284 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 52.0 mtm180 -66.31 -41.26 89.98 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.322 179.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.472 ' O ' ' HD2' ' A' ' 223' ' ' PRO . 19.7 mt-10 -64.35 -36.69 84.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.092 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.05 -33.99 61.8 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.653 178.318 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 221' ' ' LEU . . . . . 0.51 ' HA ' ' HB ' ' A' ' 224' ' ' VAL . 18.3 mt -60.64 -26.17 66.85 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.645 179.034 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -56.71 -71.68 0.7 Allowed Glycine 0 N--CA 1.452 -0.285 0 N-CA-C 110.595 -1.002 . . . . 10.0 110.595 178.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 223' ' ' PRO . . . . . 0.472 ' HD2' ' O ' ' A' ' 219' ' ' GLU . 11.9 Cg_endo -58.8 -30.42 92.68 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.392 2.061 . . . . 10.0 111.092 177.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 224' ' ' VAL . . . . . 0.51 ' HB ' ' HA ' ' A' ' 221' ' ' LEU . 5.0 t -61.56 -51.71 69.65 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.065 0 CA-C-N 116.882 -0.145 . . . . 10.0 110.791 179.155 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 12.6 p -67.22 -34.3 77.18 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.141 -0.318 . . . . 10.0 110.141 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -64.96 -48.47 73.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.327 178.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -64.6 -39.58 93.98 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -63.87 -48.4 76.83 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.077 178.551 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 229' ' ' TRP . . . . . 0.465 ' CE3' ' HA ' ' A' ' 229' ' ' TRP . 0.6 OUTLIER -59.59 -42.26 92.15 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.319 179.141 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -63.66 -48.88 75.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.539 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -64.22 -46.88 81.92 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.406 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 57.3 mt -61.0 -40.2 92.64 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.605 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -63.53 -44.27 94.72 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 109.685 -0.487 . . . . 10.0 109.685 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -64.43 -36.49 84.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.493 -0.321 . . . . 10.0 110.517 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -68.56 -45.44 72.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.543 178.028 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 236' ' ' THR . . . . . 0.579 ' HA ' ' HB2' ' A' ' 239' ' ' LEU . 4.3 p -68.6 -31.07 69.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.161 179.53 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -59.92 -47.4 85.91 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 108.323 -0.992 . . . . 10.0 108.323 177.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -68.99 -43.86 70.65 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 110.263 -1.135 . . . . 10.0 110.263 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 239' ' ' LEU . . . . . 0.579 ' HB2' ' HA ' ' A' ' 236' ' ' THR . 20.8 mt -57.02 -42.57 80.63 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 115.735 -0.233 . . . . 10.0 110.845 178.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -70.69 -39.9 73.23 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.962 -0.384 . . . . 10.0 109.962 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -59.6 -40.8 88.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.623 179.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 242' ' ' GLU . . . . . 0.492 ' HB3' HH21 ' C' ' 532' ' ' ARG . 35.2 mt-10 -81.67 -30.83 32.54 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.327 -0.851 . . . . 10.0 110.236 179.018 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 49.7 ttm -64.6 -44.87 89.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.489 -0.323 . . . . 10.0 110.868 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 13.1 p -62.87 -45.27 93.33 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.863 -0.792 . . . . 10.0 108.863 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 245' ' ' LYS . . . . . 0.404 ' O ' ' HG3' ' A' ' 249' ' ' GLU . 15.1 mttm -60.43 -55.19 36.52 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.487 -0.779 . . . . 10.0 109.881 178.623 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -56.43 -45.96 80.51 Favored 'General case' 0 C--O 1.225 -0.222 0 O-C-N 123.652 0.595 . . . . 10.0 110.753 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 24.2 mt -60.35 -45.34 93.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.766 -0.197 . . . . 10.0 111.029 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 71.1 mt-10 -66.16 -41.8 89.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.63 0.252 . . . . 10.0 110.433 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 249' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 245' ' ' LYS . 88.2 mt-10 -64.39 -43.76 93.44 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.67 -0.493 . . . . 10.0 109.67 178.664 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 250' ' ' VAL . . . . . 0.562 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 35.5 t -65.31 -44.16 94.9 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.641 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.256 179.102 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.472 ' O ' ' HG3' ' A' ' 255' ' ' GLN . 92.3 mttt -62.49 -48.21 80.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.041 0.448 . . . . 10.0 111.062 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.58 -41.87 98.33 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.178 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -77.18 -28.26 53.95 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 111.676 0.25 . . . . 10.0 111.676 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.587 HG22 ' HG ' ' A' ' 258' ' ' LEU . 0.4 OUTLIER -71.43 -20.14 20.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 C-N-CA 121.186 -0.206 . . . . 10.0 110.73 179.778 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 255' ' ' GLN . . . . . 0.472 ' HG3' ' O ' ' A' ' 251' ' ' LYS . 97.4 mt-30 -59.36 -61.07 8.59 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.505 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -65.23 -28.62 55.72 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.515 1.477 . . . . 10.0 111.059 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 257' ' ' TYR . . . . . 0.44 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 7.9 m-30 -64.04 -58.25 7.25 Favored 'General case' 0 C--O 1.231 0.091 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 258' ' ' LEU . . . . . 0.587 ' HG ' HG22 ' A' ' 254' ' ' VAL . 80.8 mt -65.45 -37.51 87.11 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.731 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -62.47 -44.89 95.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.917 0.389 . . . . 10.0 110.192 179.343 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 260' ' ' ASP . . . . . 0.898 ' HA ' ' HE2' ' A' ' 263' ' ' LYS . 10.9 t0 -64.3 -52.21 59.63 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.077 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 261' ' ' PHE . . . . . 0.529 ' HZ ' ' HG ' ' C' ' 514' ' ' LEU . 18.5 m-85 -62.02 -29.05 70.02 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.81 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 262' ' ' GLN . . . . . 0.513 ' HB2' ' O ' ' A' ' 258' ' ' LEU . 44.4 tt0 -66.44 -49.13 67.74 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.506 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 263' ' ' LYS . . . . . 0.898 ' HE2' ' HA ' ' A' ' 260' ' ' ASP . 23.9 mtmt -63.05 -44.94 94.48 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.824 -0.626 . . . . 10.0 109.336 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.453 ' CE ' ' HB1' ' C' ' 509' ' ' ALA . 13.9 mptt -58.26 -50.16 74.57 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.604 -0.726 . . . . 10.0 109.724 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 265' ' ' TRP . . . . . 0.497 ' HB2' ' O ' ' A' ' 261' ' ' PHE . 0.0 OUTLIER -61.41 -39.35 90.44 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.618 179.714 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -60.8 -47.62 85.49 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -63.88 -42.07 97.58 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 268' ' ' GLU . . . . . 0.456 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 35.8 mt-10 -58.99 -49.2 78.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.393 178.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 99.7 mmm -67.23 -40.08 86.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.464 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -60.7 -49.68 76.55 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 110.003 -0.369 . . . . 10.0 110.003 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 66.1 mt -64.84 -35.49 81.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.844 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 272' ' ' TYR . . . . . 0.702 ' HD2' HH22 ' C' ' 506' ' ' ARG . 0.3 OUTLIER -64.73 -42.52 95.17 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.206 178.978 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 273' ' ' ARG . . . . . 0.648 ' HA ' HG12 ' A' ' 276' ' ' VAL . 15.1 mtt85 -74.25 -38.66 63.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.84 0.352 . . . . 10.0 110.788 179.577 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -65.83 -26.23 67.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.367 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.796 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 93.6 mttt -95.2 -37.51 11.01 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.862 179.145 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 276' ' ' VAL . . . . . 0.648 HG12 ' HA ' ' A' ' 273' ' ' ARG . 2.2 p -62.22 -24.86 36.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 C-N-CA 121.31 -0.156 . . . . 10.0 111.355 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 277' ' ' GLU . . . . . 0.508 ' HB3' ' CD ' ' A' ' 278' ' ' PRO . 5.0 tp10 -62.93 -62.47 5.6 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 178.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 278' ' ' PRO . . . . . 0.508 ' CD ' ' HB3' ' A' ' 277' ' ' GLU . 18.5 Cg_endo -63.86 -31.54 67.54 Favored 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 121.694 1.596 . . . . 10.0 111.068 177.549 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.796 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 40.8 mt -65.09 -37.05 86.25 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 18.9 mtt180 -67.81 -34.88 77.61 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 178.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -67.74 -40.39 84.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.346 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 282' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 85.9 mt-10 -61.43 -47.93 83.47 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 108.89 -0.781 . . . . 10.0 108.89 178.325 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 48.6 mt -65.1 -38.71 91.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.335 -0.848 . . . . 10.0 110.537 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -66.57 -59.44 3.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.327 -0.397 . . . . 10.0 111.099 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -61.49 -37.85 85.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.048 0.451 . . . . 10.0 110.223 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -64.59 -49.0 66.98 Favored Glycine 0 N--CA 1.441 -0.996 0 N-CA-C 110.755 -0.938 . . . . 10.0 110.755 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.33 -35.11 79.81 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 110.249 -0.278 . . . . 10.0 110.249 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 288' ' ' ARG . . . . . 0.595 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 54.8 mtt180 -57.37 -45.7 84.14 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.794 -0.447 . . . . 10.0 109.794 178.639 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -71.04 -49.04 49.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.09 178.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -55.4 -43.2 75.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.724 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 64.0 mt -74.0 -39.28 63.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.891 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 292' ' ' HIS . . . . . 0.595 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 2.1 t-80 -60.99 -47.87 84.45 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 120.936 0.398 . . . . 10.0 109.936 179.38 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.87 -39.32 94.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.623 -0.717 . . . . 10.0 109.959 179.07 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 26.7 mt -67.37 -42.77 82.89 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.751 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -64.54 -43.73 93.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.763 0.316 . . . . 10.0 110.48 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.7 -3.94 21.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.257 0.551 . . . . 10.0 110.702 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -108.08 -34.67 6.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.484 -0.78 . . . . 10.0 109.125 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 57.7 mt -64.3 -31.34 72.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.22 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 299' ' ' SER . . . . . 0.498 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 2.6 m -68.27 -62.41 3.14 Favored Pre-proline 0 CA--C 1.54 0.564 0 CA-C-N 116.602 -0.272 . . . . 10.0 111.431 179.208 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 300' ' ' PRO . . . . . 0.498 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 35.1 Cg_endo -65.04 -50.98 1.79 Allowed 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 121.853 1.702 . . . . 10.0 112.229 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.688 ' HB3' ' HE2' ' C' ' 473' ' ' LYS . 92.0 mt -65.85 -25.55 67.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.767 0.318 . . . . 10.0 110.87 -179.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -76.74 -48.55 8.69 Favored Glycine 0 N--CA 1.443 -0.848 0 N-CA-C 110.49 -1.044 . . . . 10.0 110.49 178.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -64.06 -42.3 97.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.394 0.14 . . . . 10.0 110.776 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 304' ' ' GLU . . . . . 0.44 ' O ' ' HG2' ' A' ' 308' ' ' ARG . 15.9 mt-10 -64.09 -35.59 81.26 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.977 0.418 . . . . 10.0 110.158 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 27.0 ttt -68.11 -39.41 82.81 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 306' ' ' ARG . . . . . 0.463 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 66.4 mtt180 -67.32 -36.74 82.08 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 178.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 307' ' ' ASP . . . . . 0.553 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 7.9 t0 -65.05 -44.44 89.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.841 -0.618 . . . . 10.0 109.391 178.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 308' ' ' ARG . . . . . 0.997 ' HG3' HD21 ' C' ' 469' ' ' LEU . 13.4 mmt180 -66.28 -37.92 86.58 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 177.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -62.85 -35.02 78.59 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 115.488 -0.778 . . . . 10.0 109.649 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 310' ' ' ARG . . . . . 0.553 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 77.9 mtt180 -59.85 -45.64 91.79 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.771 -0.826 . . . . 10.0 108.771 178.061 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -69.59 -42.45 74.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.853 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 312' ' ' HIS . . . . . 0.659 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 2.8 m-70 -54.39 -53.23 56.78 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.826 -0.624 . . . . 10.0 109.723 179.082 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 95.6 t -70.37 -41.7 78.48 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.36 0 CA-C-N 115.389 -0.823 . . . . 10.0 111.538 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -58.61 -53.89 53.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.625 0.25 . . . . 10.0 111.17 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -60.32 -33.83 72.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.265 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 8.9 mt -72.89 -40.71 65.34 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.928 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.7 ttm105 -62.7 -51.55 66.75 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.548 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 3.6 m -67.15 -13.4 61.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.237 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -96.15 -43.63 7.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.85 0.357 . . . . 10.0 110.127 178.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 320' ' ' LEU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 57.6 mt -64.63 -33.56 76.21 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.21 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 321' ' ' ALA . . . . . 0.428 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -54.52 -60.96 6.39 Favored Pre-proline 0 CA--C 1.534 0.328 0 O-C-N 123.149 0.281 . . . . 10.0 111.352 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.428 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 36.6 Cg_endo -68.62 -34.84 18.4 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 121.599 1.532 . . . . 10.0 110.69 178.254 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 323' ' ' TYR . . . . . 0.477 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 4.0 m-30 -57.31 -50.05 74.17 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.227 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 8.4 p -64.69 -36.71 85.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.529 -0.305 . . . . 10.0 110.801 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 325' ' ' ASP . . . . . 0.602 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 1.0 OUTLIER -68.89 -39.96 79.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.139 0.495 . . . . 10.0 109.977 179.117 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 326' ' ' GLU . . . . . 0.418 ' O ' ' HB3' ' A' ' 329' ' ' GLN . 35.8 mt-10 -67.27 -34.4 77.35 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.032 -0.729 . . . . 10.0 109.032 177.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 63.8 mt -68.09 -33.02 73.75 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 108.708 -0.849 . . . . 10.0 108.708 177.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 328' ' ' ARG . . . . . 0.602 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 84.7 mtt180 -67.4 -39.31 85.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.167 -1.049 . . . . 10.0 108.167 177.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 329' ' ' GLN . . . . . 0.418 ' HB3' ' O ' ' A' ' 326' ' ' GLU . 42.6 tt0 -61.04 -42.15 97.93 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.895 -1.15 . . . . 10.0 107.895 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 330' ' ' ARG . . . . . 0.649 HH12 HG23 ' C' ' 448' ' ' VAL . 57.8 mtt180 -63.07 -53.95 45.66 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.391 -0.822 . . . . 10.0 109.08 178.039 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 98.3 mt -53.3 -42.74 66.94 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.851 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 332' ' ' ALA . . . . . 0.643 ' O ' ' HB2' ' A' ' 336' ' ' GLU . . . -60.69 -45.32 94.64 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.239 -0.437 . . . . 10.0 109.949 178.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -68.99 -46.58 67.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.37 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 334' ' ' ARG . . . . . 0.633 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 4.3 mmt85 -60.92 -52.73 63.8 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.505 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 335' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 339' ' ' LYS . 83.9 mt -63.15 -34.92 78.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.993 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 336' ' ' GLU . . . . . 0.643 ' HB2' ' O ' ' A' ' 332' ' ' ALA . 0.3 OUTLIER -64.82 -44.32 90.23 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.221 -0.659 . . . . 10.0 109.221 178.83 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.12 -39.78 94.77 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.401 -0.963 . . . . 10.0 108.401 178.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 70.2 mt -66.68 -22.55 66.08 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.971 178.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 339' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 335' ' ' LEU . 91.2 mttt -75.38 -48.13 24.37 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.017 -0.734 . . . . 10.0 109.017 178.147 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -68.93 -47.75 64.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.637 -0.71 . . . . 10.0 109.829 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -65.85 -49.76 67.0 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.627 179.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.85 -37.76 94.86 Favored Glycine 0 C--N 1.33 0.227 0 CA-C-N 115.929 -0.578 . . . . 10.0 112.445 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.38 -46.21 94.75 Favored Glycine 0 N--CA 1.449 -0.457 0 N-CA-C 110.829 -0.908 . . . . 10.0 110.829 178.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -70.3 -37.33 74.76 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 345' ' ' ARG . . . . . 0.665 ' HA ' HD21 ' C' ' 429' ' ' ASN . 19.0 mtt180 -57.46 -58.72 7.05 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.269 179.292 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 346' ' ' LEU . . . . . 0.563 ' O ' ' HB2' ' A' ' 350' ' ' HIS . 92.7 mt -58.3 -39.82 80.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.565 -179.318 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -64.9 -49.21 71.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.768 0.318 . . . . 10.0 110.323 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -64.94 -43.73 91.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.182 -0.463 . . . . 10.0 111.209 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 22.7 m-30 -63.53 -39.69 95.09 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.922 -0.399 . . . . 10.0 109.922 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 350' ' ' HIS . . . . . 0.563 ' HB2' ' O ' ' A' ' 346' ' ' LEU . 0.6 OUTLIER -64.92 -44.17 90.42 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.705 178.921 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -59.25 -44.73 92.38 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.256 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 352' ' ' LYS . . . . . 0.452 ' HD3' ' HA ' ' C' ' 422' ' ' VAL . 16.4 mtmm -68.33 -27.14 66.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.525 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.23 -43.48 73.95 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 178.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.47 -45.19 94.62 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -63.36 -38.46 91.25 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.888 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 356' ' ' HIS . . . . . 0.425 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 5.2 m-70 -66.91 -35.61 80.39 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.142 178.641 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 78.4 mt -71.21 -39.87 71.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.192 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 68.7 m -62.78 -44.55 95.89 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 178.286 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 4.4 p -76.16 -16.57 59.84 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.417 179.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 360' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 356' ' ' HIS . 0.5 OUTLIER -76.18 -35.41 59.15 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 107.488 -1.301 . . . . 10.0 107.488 177.411 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 29.1 m -67.71 -25.32 65.6 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -72.36 -2.4 19.12 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.21 -0.904 . . . . 10.0 109.923 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.416 ' O ' ' HB3' ' A' ' 367' ' ' ALA . 31.2 mttp -123.16 -42.31 2.27 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 178.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -63.28 -22.25 66.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.535 -0.757 . . . . 10.0 111.429 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.899 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 96.6 mttt -102.12 -67.91 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.454 0 C-N-CA 120.819 -0.352 . . . . 10.0 111.544 179.013 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.899 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 21.9 Cg_exo -65.52 -55.36 0.45 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 122.268 1.979 . . . . 10.0 113.316 -178.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 367' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -60.89 -38.85 87.11 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.285 0.476 . . . . 10.0 112.285 -179.075 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 368' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 368' ' ' LEU . 3.0 mt -67.03 -42.25 85.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.776 0.322 . . . . 10.0 110.478 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 369' ' ' GLU . . . . . 1.059 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 2.7 mt-10 -69.19 -29.85 67.92 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.746 -0.464 . . . . 10.0 109.746 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -69.98 -44.42 69.47 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 178.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.72 -46.85 88.8 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.385 -0.825 . . . . 10.0 109.634 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 52.5 mtt85 -65.62 -36.69 84.44 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 1.059 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.7 mt-30 -63.08 -30.52 71.66 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.546 -0.752 . . . . 20.0 111.297 179.237 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -86.44 -36.09 9.99 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 109.149 -1.58 . . . . 10.0 109.149 178.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 17.6 mt -58.09 -40.31 80.82 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.011 0.374 . . . . 10.0 112.011 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 83.4 mt -55.4 -62.92 3.63 Favored Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 112.069 0.396 . . . . 10.0 112.069 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -63.19 -32.49 73.98 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 121.969 1.78 . . . . 10.0 111.564 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 6.5 t -63.45 -44.79 99.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 N-CA-C 109.916 -0.401 . . . . 10.0 109.916 178.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 33.7 mt -60.92 -35.63 77.19 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.438 -0.578 . . . . 10.0 109.438 178.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -62.86 -52.03 64.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.874 178.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.2 -38.11 85.38 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.611 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -67.97 -43.12 79.73 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.707 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -62.0 -48.42 80.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.486 -0.325 . . . . 10.0 110.538 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 75.8 t -57.51 -42.77 81.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.467 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 5.3 p -74.82 -55.03 6.24 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.174 0.435 . . . . 10.0 112.174 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -60.53 -44.53 95.97 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.311 0.856 . . . . 10.0 113.311 -178.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.484 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 56.8 mt -61.29 -41.98 97.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.689 0.281 . . . . 10.0 111.335 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 93.5 p -79.12 -26.12 42.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.329 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -65.92 -39.99 91.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 95.4 mt -61.85 -35.14 77.4 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.945 -0.571 . . . . 10.0 109.953 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 391' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 37.9 mt-10 -68.1 -42.4 80.37 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.55 -0.907 . . . . 10.0 108.55 178.547 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 392' ' ' GLU . . . . . 0.601 ' HA ' ' HD2' ' A' ' 395' ' ' LYS . 0.4 OUTLIER -61.7 -40.37 94.78 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.545 -0.752 . . . . 10.0 111.085 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -63.63 -51.82 63.54 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.493 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 4.8 m -58.63 -30.58 67.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.725 -0.671 . . . . 10.0 111.452 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 395' ' ' LYS . . . . . 0.601 ' HD2' ' HA ' ' A' ' 392' ' ' GLU . 93.1 mttt -58.66 -37.47 76.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.601 -0.272 . . . . 10.0 111.684 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -90.13 -24.05 21.19 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.071 0.397 . . . . 10.0 112.071 -179.328 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 93.7 mt -71.74 -74.47 0.15 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.814 0.34 . . . . 10.0 110.915 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 . . . . . 0 C--N 1.326 -0.44 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.392 -179.447 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 6.6 tt . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.819 0.342 . . . . 10.0 110.147 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 62.2 mttt -75.09 -43.71 51.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.649 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 55.9 mt -62.34 -28.16 69.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.185 0.517 . . . . 10.0 111.515 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.12 -37.99 84.83 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.011 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.87 -38.83 61.82 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.387 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 404' ' ' ASN . . . . . 0.453 ' O ' HG23 ' C' ' 408' ' ' VAL . 14.7 t-20 -57.56 -41.63 81.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.318 -0.856 . . . . 10.0 109.013 178.296 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -64.67 -33.99 77.23 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 115.415 -0.811 . . . . 10.0 111.847 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.68 -50.06 75.3 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.893 0.378 . . . . 10.0 110.21 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 1.2 m -63.79 -34.79 78.7 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.579 -0.526 . . . . 10.0 109.579 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 408' ' ' VAL . . . . . 0.453 HG23 ' O ' ' C' ' 404' ' ' ASN . 50.6 t -64.82 -41.38 92.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.003 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 2.8 m -61.05 -46.55 90.23 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 42.3 m -60.55 -38.33 84.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.86 178.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 91.5 m -63.15 -44.99 93.99 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.093 -0.503 . . . . 10.0 109.889 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 412' ' ' PHE . . . . . 0.453 ' O ' ' HG3' ' C' ' 416' ' ' ARG . 4.0 m-85 -64.72 -41.41 96.0 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.389 178.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 15.0 m -62.84 -44.34 96.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.019 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -66.88 -26.72 67.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.231 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 30.5 mt -70.86 -38.05 73.12 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 178.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 416' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' C' ' 412' ' ' PHE . 86.9 mtt180 -66.96 -40.11 87.41 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 108.751 -0.833 . . . . 10.0 108.751 178.297 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -65.16 -23.52 67.14 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 115.421 -0.809 . . . . 10.0 110.379 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -82.57 -48.25 11.2 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.57 -0.9 . . . . 10.0 108.57 177.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 84.6 mt -52.88 -35.05 57.33 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.203 -0.908 . . . . 10.0 112.151 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 420' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' C' ' 424' ' ' GLN . . . -52.94 -77.67 0.13 Allowed Glycine 0 CA--C 1.52 0.352 0 N-CA-C 111.84 -0.504 . . . . 10.0 111.84 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -56.94 -32.6 93.16 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.807 2.338 . . . . 10.0 111.742 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 422' ' ' VAL . . . . . 0.452 ' HA ' ' HD3' ' A' ' 352' ' ' LYS . 5.6 t -60.0 -50.21 81.02 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.226 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.925 179.273 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 21.4 p -70.78 -36.43 73.04 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.499 0.19 . . . . 10.0 110.901 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 424' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' C' ' 420' ' ' GLY . 78.2 mt-30 -57.82 -48.78 78.74 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.566 -0.531 . . . . 10.0 109.566 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 425' ' ' GLU . . . . . 0.422 ' OE1' ' HG3' ' A' ' 352' ' ' LYS . 97.2 mt-10 -76.33 -29.73 57.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.669 -0.696 . . . . 10.0 110.543 179.428 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 426' ' ' PHE . . . . . 0.44 ' HB2' ' O ' ' C' ' 422' ' ' VAL . 32.7 t80 -66.3 -46.99 75.05 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.824 0.345 . . . . 10.0 110.14 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 427' ' ' TRP . . . . . 0.531 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 47.3 m0 -64.86 -37.5 87.82 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 179.009 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.39 -34.19 75.6 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.574 178.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 429' ' ' ASN . . . . . 0.665 HD21 ' HA ' ' A' ' 345' ' ' ARG . 20.0 t-20 -68.95 -39.35 79.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.761 -1.2 . . . . 10.0 107.761 177.518 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 430' ' ' LEU . . . . . 0.65 ' HA ' ' HB2' ' C' ' 433' ' ' GLU . 69.1 mt -66.33 -25.9 67.05 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.251 -0.886 . . . . 10.0 110.287 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 431' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 35.5 mm-40 -63.0 -53.33 55.61 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.874 -0.787 . . . . 10.0 108.874 178.327 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -66.87 -31.52 72.17 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 433' ' ' GLU . . . . . 0.65 ' HB2' ' HA ' ' C' ' 430' ' ' LEU . 0.8 OUTLIER -64.0 -53.81 44.16 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.56 -0.745 . . . . 10.0 110.614 179.148 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 9.5 p -69.87 -40.27 75.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.855 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -67.0 -44.54 80.1 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.639 0.257 . . . . 10.0 110.726 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -61.8 -48.6 82.93 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 110.117 -1.193 . . . . 10.0 110.117 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 16.9 mt -61.16 -34.51 75.15 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 110.017 -0.364 . . . . 10.0 110.017 178.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 20.9 mtt85 -65.97 -43.28 88.31 Favored 'General case' 0 C--O 1.22 -0.454 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 178.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 439' ' ' GLN . . . . . 0.487 ' O ' ' HE2' ' C' ' 443' ' ' LYS . 74.8 mt-30 -62.92 -33.82 76.13 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-O 121.328 0.585 . . . . 10.0 109.678 178.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 440' ' ' GLU . . . . . 0.633 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 52.4 mt-10 -74.43 -59.6 2.65 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.09 178.844 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 75.1 mtm -62.36 -27.9 69.39 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 114.538 1.31 . . . . 10.0 114.538 -177.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 25.4 p -57.52 -59.07 5.72 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.259 0.552 . . . . 10.0 110.144 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 443' ' ' LYS . . . . . 0.487 ' HE2' ' O ' ' C' ' 439' ' ' GLN . 21.6 pttt -74.04 -31.27 62.82 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.334 179.151 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 444' ' ' ASP . . . . . 0.579 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 0.4 OUTLIER -61.38 -43.28 99.13 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.286 -0.415 . . . . 10.0 110.577 179.759 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 445' ' ' LEU . . . . . 0.441 ' HA ' ' HB ' ' C' ' 448' ' ' VAL . 81.2 mt -76.46 -42.23 44.5 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.418 -0.355 . . . . 10.0 111.311 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -62.62 -40.6 97.47 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.095 0.474 . . . . 10.0 110.055 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.11 -30.43 62.32 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.961 -0.755 . . . . 10.0 108.961 178.379 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 448' ' ' VAL . . . . . 0.649 HG23 HH12 ' A' ' 330' ' ' ARG . 1.2 t -57.83 -43.89 85.16 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 CA-C-N 116.068 -0.514 . . . . 10.0 109.819 178.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -67.35 -40.51 85.85 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -69.69 -10.19 57.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.099 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 451' ' ' LYS . . . . . 0.603 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 0.0 OUTLIER -104.62 -39.72 6.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.15 179.14 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 50.4 t -70.13 -36.4 67.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.797 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -55.08 -61.5 5.8 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 116.778 -0.192 . . . . 10.0 111.429 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.51 -26.37 40.42 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 121.823 1.682 . . . . 10.0 111.502 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 455' ' ' TYR . . . . . 0.603 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.1 OUTLIER -69.33 -47.93 62.93 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.796 -0.446 . . . . 10.0 109.796 179.342 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 456' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' C' ' 456' ' ' LEU . 17.5 mt -67.42 -32.22 72.96 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.29 -0.633 . . . . 10.0 109.29 178.687 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -67.11 -47.88 69.82 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.114 -0.699 . . . . 10.0 109.114 178.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 458' ' ' ASP . . . . . 0.584 ' HA ' ' HE2' ' C' ' 461' ' ' LYS . 41.3 t0 -66.81 -41.11 88.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.962 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -64.9 -40.09 94.54 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.931 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -62.94 -43.51 98.6 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 461' ' ' LYS . . . . . 0.584 ' HE2' ' HA ' ' C' ' 458' ' ' ASP . 27.5 mtmt -63.13 -46.39 87.47 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 15.5 mtmm -64.65 -36.97 85.98 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.221 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 36.1 t90 -66.33 -37.23 84.87 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.899 -0.778 . . . . 10.0 108.899 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -64.68 -45.17 87.8 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.536 -0.912 . . . . 10.0 108.536 177.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 0.804 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 45.6 mt-10 -61.2 -42.76 99.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.653 178.666 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 466' ' ' GLU . . . . . 0.861 ' OE1' HD12 ' C' ' 469' ' ' LEU . 0.4 OUTLIER -67.19 -39.51 86.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.968 -0.56 . . . . 10.0 109.877 178.942 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.11 -43.46 98.36 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 108.989 -0.745 . . . . 10.0 108.989 178.625 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -63.71 -45.11 91.47 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.133 -1.062 . . . . 10.0 108.133 177.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 0.997 HD21 ' HG3' ' A' ' 308' ' ' ARG . 96.5 mt -56.09 -45.11 79.53 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 115.35 -0.841 . . . . 20.0 109.782 177.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 15.4 m-30 -64.89 -41.82 95.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.521 179.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 59.6 mtt180 -66.57 -44.67 81.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.977 0.418 . . . . 10.0 111.174 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -78.0 -2.94 39.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.043 -0.526 . . . . 10.0 112.188 -179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 473' ' ' LYS . . . . . 0.688 ' HE2' ' HB3' ' A' ' 301' ' ' LEU . 62.5 mttt -116.08 -63.2 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.518 0.199 . . . . 10.0 111.29 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 66.1 t -57.54 -43.23 82.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.292 0.849 . . . . 10.0 113.292 -178.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.26 -59.74 12.84 Favored Pre-proline 0 CA--C 1.533 0.308 0 N-CA-C 112.34 0.496 . . . . 10.0 112.34 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -65.38 -29.99 53.69 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 121.835 1.69 . . . . 10.0 111.264 178.255 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 12.5 mt -67.44 -40.75 85.46 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 478' ' ' ARG . . . . . 0.553 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 67.3 ttt180 -63.48 -34.78 78.53 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 109.222 -0.658 . . . . 10.0 109.222 178.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -68.49 -47.29 67.42 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.22 -45.17 94.53 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.857 -0.611 . . . . 10.0 109.589 178.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 62.9 mt -67.39 -33.08 74.46 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.633 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 482' ' ' GLN . . . . . 0.553 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 30.4 tt0 -66.25 -47.12 74.79 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 178.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 483' ' ' GLU . . . . . 0.444 ' O ' ' HG3' ' C' ' 487' ' ' GLN . 42.1 mm-40 -66.67 -41.91 87.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.615 178.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.22 -39.24 97.67 Favored Glycine 0 N--CA 1.447 -0.586 0 N-CA-C 110.842 -0.903 . . . . 10.0 110.842 178.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.04 -36.74 78.04 Favored 'General case' 0 C--O 1.219 -0.507 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 178.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 64.3 mtt180 -64.52 -39.67 94.21 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.34 -0.615 . . . . 10.0 109.34 178.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 487' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' C' ' 483' ' ' GLU . 45.7 mt-30 -67.67 -43.85 79.25 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 488' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' C' ' 491' ' ' GLU . 78.9 tttt -65.64 -31.87 73.13 Favored 'General case' 0 C--O 1.226 -0.149 0 CA-C-N 115.725 -0.67 . . . . 10.0 109.599 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 21.1 mt -66.66 -41.32 88.39 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 108.626 -0.879 . . . . 10.0 108.626 177.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 490' ' ' HIS . . . . . 0.522 ' HA ' ' OE1' ' C' ' 493' ' ' GLN . 17.1 m-70 -64.12 -39.48 94.12 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 108.298 -1.001 . . . . 10.0 108.298 178.206 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 491' ' ' GLU . . . . . 0.558 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 39.9 mt-10 -60.9 -53.6 55.32 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.248 -1.019 . . . . 10.0 108.248 177.374 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 82.3 mt -57.81 -38.4 75.47 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 115.358 -0.837 . . . . 10.0 111.466 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 493' ' ' GLN . . . . . 0.522 ' OE1' ' HA ' ' C' ' 490' ' ' HIS . 69.2 mt-30 -61.07 -37.53 83.01 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.886 0.374 . . . . 10.0 110.298 179.263 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -81.56 -17.06 49.68 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.603 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.611 ' HG2' HD22 ' A' ' 279' ' ' LEU . 10.5 mtmm -103.64 6.37 37.06 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.685 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 32.6 mt -124.93 -44.08 1.95 Allowed 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 112.093 0.405 . . . . 10.0 112.093 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 497' ' ' SER . . . . . 0.803 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 10.3 m -66.93 -62.32 3.92 Favored Pre-proline 0 CA--C 1.539 0.534 0 N-CA-C 112.215 0.45 . . . . 10.0 112.215 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 498' ' ' PRO . . . . . 0.803 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 21.8 Cg_exo -67.18 -21.36 48.57 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 122.158 1.905 . . . . 10.0 111.89 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 499' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' C' ' 499' ' ' LEU . 12.6 mt -87.1 -41.75 13.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.939 179.45 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.49 -45.09 94.15 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 111.446 -0.662 . . . . 10.0 111.446 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -64.48 -32.56 74.24 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 121.239 0.543 . . . . 10.0 109.846 178.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 502' ' ' GLU . . . . . 0.458 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 38.6 tt0 -73.02 -40.24 65.34 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.443 178.253 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 503' ' ' MET . . . . . 0.59 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 87.2 mmm -60.46 -34.69 74.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 10.0 109.652 178.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -70.76 -34.3 71.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.1 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -71.38 -36.81 71.55 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.025 -1.102 . . . . 10.0 108.025 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.702 HH22 ' HD2' ' A' ' 272' ' ' TYR . 54.8 mtt180 -62.53 -38.38 89.75 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 107.836 -1.172 . . . . 10.0 107.836 177.244 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -64.05 -35.48 80.88 Favored 'General case' 0 C--O 1.226 -0.138 0 CA-C-N 115.65 -0.704 . . . . 10.0 109.994 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 508' ' ' ARG . . . . . 0.513 ' O ' ' HB3' ' C' ' 512' ' ' ASP . 75.2 mtt180 -64.16 -32.8 74.51 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.715 -0.846 . . . . 10.0 108.715 178.159 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 509' ' ' ALA . . . . . 0.453 ' HB1' ' CE ' ' A' ' 264' ' ' LYS . . . -96.57 13.12 29.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.118 -0.946 . . . . 10.0 110.909 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -128.74 -67.56 0.79 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.29 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 47.7 t -69.01 -49.76 59.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.626 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.582 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 12.0 t70 -66.75 -34.18 77.26 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.919 0.39 . . . . 10.0 110.36 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -68.31 -39.31 82.04 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.116 -1.068 . . . . 10.0 108.116 177.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 514' ' ' LEU . . . . . 0.529 ' HG ' ' HZ ' ' A' ' 261' ' ' PHE . 11.3 mt -67.48 -24.69 65.62 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.452 -0.794 . . . . 10.0 110.366 178.324 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 515' ' ' ARG . . . . . 0.582 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 89.8 mtt180 -58.75 -51.59 69.3 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.05 -0.722 . . . . 10.0 109.05 178.396 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.3 9.87 4.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.417 0.627 . . . . 10.0 110.901 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 517' ' ' HIS . . . . . 0.497 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 49.7 m170 -113.89 -39.16 4.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.146 -0.479 . . . . 10.0 109.874 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 95.0 mt -89.39 -30.75 18.13 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.582 -0.736 . . . . 10.0 111.714 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 519' ' ' ALA . . . . . 0.427 ' N ' ' HD2' ' C' ' 520' ' ' PRO . . . -58.11 -54.63 53.68 Favored Pre-proline 0 CA--C 1.531 0.222 0 C-N-CA 121.235 -0.186 . . . . 10.0 110.739 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 520' ' ' PRO . . . . . 0.427 ' HD2' ' N ' ' C' ' 519' ' ' ALA . 33.3 Cg_endo -67.47 -32.03 32.75 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 121.31 1.34 . . . . 10.0 110.048 177.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -62.8 -46.08 89.63 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.933 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 522' ' ' SER . . . . . 0.409 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 3.8 p -68.33 -33.52 74.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.015 0.436 . . . . 10.0 110.084 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -66.18 -45.5 80.63 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 178.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -65.84 -36.4 83.35 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 178.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 19.0 mt -60.81 -39.39 88.79 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.405 178.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 526' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' C' ' 522' ' ' SER . 54.7 mtt85 -63.54 -38.46 91.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.179 178.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -62.78 -46.7 86.81 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.449 -0.945 . . . . 10.0 108.449 178.062 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 48.2 mtt180 -63.16 -41.89 99.34 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 114.896 -1.047 . . . . 10.0 109.77 178.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 76.7 mt -65.24 -41.69 94.09 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.456 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -59.26 -49.63 77.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.227 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -61.7 -47.92 83.13 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.723 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 532' ' ' ARG . . . . . 0.492 HH21 ' HB3' ' A' ' 242' ' ' GLU . 1.5 mtt180 -64.6 -42.19 95.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.484 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 26.3 mt -64.36 -43.11 95.58 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 120.64 0.257 . . . . 10.0 110.34 179.154 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -63.42 -40.32 96.87 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.949 -0.389 . . . . 10.0 109.949 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.17 -41.21 99.19 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.955 -0.757 . . . . 10.0 108.955 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 536' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 96.1 mt -69.97 -19.63 63.35 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.681 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -87.46 -41.0 13.85 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 178.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.99 -51.64 52.52 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.722 -0.844 . . . . 10.0 108.722 178.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -70.66 -34.06 71.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.393 -0.821 . . . . 10.0 108.822 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.18 -45.66 85.22 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.956 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.02 -41.11 99.65 Favored Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 110.237 -1.145 . . . . 10.0 110.237 178.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.45 92.58 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 109.327 -0.62 . . . . 10.0 109.327 178.329 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 74.4 mtt180 -64.72 -38.52 91.27 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.952 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 85.9 mt -61.12 -41.7 97.18 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.555 -0.535 . . . . 10.0 109.555 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -68.34 -43.36 77.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.419 178.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -61.0 -47.53 86.04 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.052 179.019 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 15.7 m-30 -61.28 -43.56 98.67 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.399 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -59.67 -46.82 87.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.508 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -63.01 -54.86 31.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.564 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -58.63 -39.62 81.01 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.973 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.18 -41.4 90.34 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 116.491 -0.322 . . . . 10.0 110.466 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 47.2 m -62.39 -45.29 93.82 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -64.21 -29.7 70.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.317 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -79.48 -46.68 16.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.33 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 56.2 mt -60.04 -40.7 90.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.52 -0.309 . . . . 10.0 111.144 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 4.8 p -65.6 -47.79 74.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.867 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 12.3 p -68.83 -32.21 71.74 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.881 -0.328 . . . . 10.0 110.808 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 25.4 mt -63.84 -44.87 91.88 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.576 -0.527 . . . . 10.0 109.576 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 559' ' ' SER . . . . . 0.475 ' O ' ' HG3' ' C' ' 563' ' ' LYS . 2.4 p -71.84 -34.82 69.6 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.777 -0.453 . . . . 10.0 109.777 178.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 74.4 mt-10 -63.74 -24.16 67.66 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.686 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 48.1 mttp -97.91 -31.39 12.21 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.141 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -63.84 -39.01 93.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.696 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 563' ' ' LYS . . . . . 0.475 ' HG3' ' O ' ' C' ' 559' ' ' SER . 91.8 mttt -56.03 -61.86 5.72 Favored Pre-proline 0 CA--C 1.534 0.327 0 CA-C-N 116.42 -0.354 . . . . 10.0 111.44 179.268 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 564' ' ' PRO . . . . . 0.467 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 30.7 Cg_endo -65.65 -35.48 37.28 Favored 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 121.822 1.681 . . . . 10.0 111.736 179.037 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.8 82.69 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 121.145 -0.222 . . . . 10.0 110.814 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 57.3 mt -64.82 -41.61 95.63 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.204 -0.295 . . . . 10.0 110.204 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 567' ' ' GLU . . . . . 0.958 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 88.1 mt-10 -64.17 -44.14 92.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.662 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -67.88 -41.1 83.34 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.374 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 33.5 mt -58.79 -49.46 77.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.238 -0.437 . . . . 10.0 109.826 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 570' ' ' ARG . . . . . 0.427 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 59.2 mtt180 -65.85 -38.89 90.06 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.731 -0.47 . . . . 10.0 109.731 178.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 571' ' ' GLN . . . . . 0.958 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.5 mt-30 -61.51 -40.21 93.8 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.665 -0.698 . . . . 20.0 111.974 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -78.44 -37.31 27.89 Favored Glycine 0 CA--C 1.521 0.445 0 N-CA-C 109.927 -1.269 . . . . 10.0 109.927 179.106 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 18.8 mt -54.87 -37.21 65.99 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 112.021 0.378 . . . . 10.0 112.021 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 574' ' ' LEU . . . . . 0.551 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 53.4 mt -56.27 -66.02 1.32 Allowed Pre-proline 0 CA--C 1.538 0.484 0 N-CA-C 112.419 0.526 . . . . 10.0 112.419 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 575' ' ' PRO . . . . . 0.551 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 43.1 Cg_endo -68.72 -32.82 22.75 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 121.578 1.519 . . . . 10.0 112.11 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 15.4 t -65.27 -49.18 80.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.751 -0.204 . . . . 10.0 111.034 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 46.1 mt -65.2 -36.87 85.53 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 110.14 -0.319 . . . . 10.0 110.14 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 578' ' ' GLU . . . . . 0.523 ' O ' HG23 ' C' ' 582' ' ' VAL . 55.0 mm-40 -66.24 -46.37 77.38 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 110.091 -0.337 . . . . 10.0 110.091 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 44.0 m -62.15 -43.12 99.54 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.968 0.414 . . . . 10.0 109.986 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 580' ' ' PHE . . . . . 0.42 ' HD1' ' HA ' ' C' ' 580' ' ' PHE . 5.3 m-30 -65.51 -37.37 86.58 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.903 -0.59 . . . . 10.0 109.564 178.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -60.82 -41.21 95.26 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 582' ' ' VAL . . . . . 0.523 HG23 ' O ' ' C' ' 578' ' ' GLU . 95.2 t -61.65 -39.9 84.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.115 -0.698 . . . . 10.0 109.115 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 13.4 m -68.92 -36.94 78.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.238 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -70.32 -43.2 70.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.733 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 98.6 mt -61.55 -45.94 92.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.12 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 2.9 p -65.63 -40.94 93.09 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.69 -0.485 . . . . 10.0 109.69 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -60.46 -53.11 61.49 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 115.76 -0.655 . . . . 10.0 110.632 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.3 mt -56.09 -45.13 79.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.868 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -68.91 -39.63 79.57 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.665 0.617 . . . . 10.0 112.665 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -70.93 -41.1 71.61 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.993 0.425 . . . . 10.0 110.814 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 591' ' ' TYR . . . . . 0.438 ' HE1' ' HB3' ' A' ' 392' ' ' GLU . 22.3 m-30 -64.52 -39.66 94.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.759 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.38 -25.9 67.77 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.947 0.351 . . . . 10.0 111.947 -179.623 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -72.95 -39.21 66.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.12 0.486 . . . . 10.0 110.191 179.047 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -77.03 -26.48 53.74 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.872 -0.604 . . . . 10.0 110.634 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 83.4 mt -95.82 46.8 1.09 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.05 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.428 -0.796 . . . . 10.0 109.665 -179.968 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.3 ptt? . . . . . 0 C--O 1.23 0.053 0 CA-C-O 120.976 0.417 . . . . 10.0 110.503 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 7.1 t -142.98 22.38 1.92 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.716 0.769 . . . . 10.0 110.295 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -108.87 137.53 46.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.341 -0.845 . . . . 10.0 109.639 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -125.84 157.33 37.87 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.809 0.338 . . . . 10.0 111.386 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 mmtm -114.77 112.57 23.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.707 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.635 HD22 HD23 ' B' ' 159' ' ' LEU . 25.8 mt -108.65 117.28 33.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.971 0.415 . . . . 10.0 110.841 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 39.8 t -107.42 119.34 56.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.131 0.491 . . . . 10.0 110.724 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 21.6 t -90.63 121.1 40.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.545 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 18.3 m -114.91 165.27 10.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.917 0.389 . . . . 10.0 110.952 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 144.92 163.82 10.28 Favored Glycine 0 N--CA 1.445 -0.7 0 N-CA-C 110.8 -0.92 . . . . 10.0 110.8 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.53 176.1 7.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.293 0.568 . . . . 10.0 111.893 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.64 123.61 6.16 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.915 -0.659 . . . . 10.0 111.963 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 121.23 -20.06 8.54 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.627 -0.797 . . . . 10.0 112.12 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 34.2 m -65.2 -36.43 77.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.795 0.331 . . . . 10.0 111.58 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 104.7 39.26 2.39 Favored Glycine 0 CA--C 1.518 0.257 0 C-N-CA 120.598 -0.811 . . . . 10.0 113.596 179.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -59.73 -51.98 67.45 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.943 0.401 . . . . 10.0 111.267 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -60.04 -36.3 76.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.895 -0.593 . . . . 10.0 111.895 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.92 -50.99 68.65 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.691 0.282 . . . . 10.0 110.745 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 72.0 mt -59.72 -36.83 77.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.456 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' THR . . . . . 0.495 HG23 HG21 ' B' ' 55' ' ' ILE . 29.2 m -68.79 -51.05 45.13 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.291 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 97.6 mt -63.11 -32.0 54.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-O 120.816 0.341 . . . . 10.0 110.977 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.454 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 38.0 tp60 -64.45 -30.34 71.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.533 179.149 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 23.8 tp -85.35 -30.71 23.46 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.114 0.483 . . . . 10.0 110.474 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 43.2 mm -73.13 -59.36 3.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.954 -0.567 . . . . 10.0 112.086 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -125.1 4.92 7.9 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 113.179 0.807 . . . . 10.0 113.179 -178.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.454 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 54.6 t30 58.27 51.43 8.45 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.293 0.568 . . . . 10.0 111.198 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 40.6 t60 -129.39 120.9 26.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.839 -0.618 . . . . 10.0 110.089 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -84.29 118.26 24.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.414 -0.357 . . . . 10.0 110.64 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 10.1 m -77.39 141.57 15.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.541 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -105.74 -24.02 12.6 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.258 0.551 . . . . 10.0 109.948 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 3.4 pm0 -86.43 140.36 30.06 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.28 -0.873 . . . . 10.0 111.054 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.541 ' HA ' H5'2 ' B' ' 201' ' ' GNP . 48.2 t80 -85.49 68.73 10.54 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.395 0.617 . . . . 10.0 109.814 178.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 33' ' ' ASP . . . . . 0.517 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 0.7 OUTLIER -71.3 138.02 84.12 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.724 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 34' ' ' PRO . . . . . 0.517 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 13.4 Cg_exo -72.25 -178.37 3.22 Favored 'Trans proline' 0 N--CA 1.463 -0.303 0 C-N-CA 123.158 2.572 . . . . 10.0 111.706 179.405 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.2 m -166.71 137.39 3.26 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.443 -0.344 . . . . 10.0 110.711 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 76.8 mt -123.01 -52.91 2.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 107.817 -1.179 . . . . 10.0 107.817 177.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -148.1 115.06 6.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.079 -0.964 . . . . 10.0 109.001 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 38' ' ' ASP . . . . . 0.716 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 23.9 m-20 -132.66 133.61 43.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.093 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 2.0 p -120.96 122.27 39.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.987 0.423 . . . . 10.0 111.796 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 40' ' ' TYR . . . . . 0.405 ' CE2' ' HB3' ' B' ' 38' ' ' ASP . 71.3 m-85 -122.49 155.52 36.02 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 41' ' ' ARG . . . . . 0.454 ' HB2' ' NE2' ' D' ' 818' ' ' GLN . 2.5 ttt180 -153.97 141.05 19.39 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.814 0.34 . . . . 10.0 111.21 -178.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -158.48 155.98 29.47 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.726 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -105.24 131.28 52.91 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.529 -0.545 . . . . 10.0 109.529 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 15.7 m -139.02 158.22 29.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.685 0.279 . . . . 10.0 111.104 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 54.6 t -92.43 100.62 11.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.047 -0.723 . . . . 10.0 109.047 178.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 39.1 mt -88.86 104.67 15.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.683 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 58.67 12.77 2.32 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.95 1.093 . . . . 10.0 113.95 178.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 132.45 -33.13 2.71 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.414 -0.898 . . . . 10.0 113.087 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -101.38 134.87 43.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.639 0.257 . . . . 10.0 110.703 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 5.6 t -81.61 140.86 34.19 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 71.3 m -147.09 158.59 43.99 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.833 0.349 . . . . 10.0 111.328 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.04 122.46 40.06 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 82.9 mt -111.87 120.98 43.78 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.541 0.571 . . . . 10.0 112.541 -178.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.88 113.19 24.79 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 107.697 -1.224 . . . . 10.0 107.697 177.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.495 HG21 HG23 ' B' ' 20' ' ' THR . 12.4 mt -101.5 127.05 55.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 120.811 0.338 . . . . 10.0 110.934 -178.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.6 tp -109.04 113.87 27.12 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.861 -0.609 . . . . 10.0 111.737 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.716 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 10.0 t70 -90.85 101.56 14.32 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.89 -0.781 . . . . 10.0 108.89 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 38.0 p -80.95 165.05 22.11 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 112.912 0.708 . . . . 10.0 112.912 -178.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.36 156.83 33.42 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.473 -0.785 . . . . 10.0 111.392 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -79.83 -55.82 3.48 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.786 -0.721 . . . . 10.0 111.969 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -120.32 127.82 52.7 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.762 -0.458 . . . . 20.0 109.762 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.565 ' OE1' ' HD2' ' B' ' 68' ' ' ARG . 27.7 tt0 -163.02 168.33 21.18 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.697 -0.483 . . . . 10.0 109.697 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 63' ' ' GLU . . . . . 0.537 ' HB3' ' H ' ' B' ' 64' ' ' TYR . 3.6 mm-40 -105.37 -136.96 0.36 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.586 -0.279 . . . . 10.0 110.943 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 64' ' ' TYR . . . . . 0.537 ' H ' ' HB3' ' B' ' 63' ' ' GLU . 48.1 t80 -103.47 90.11 3.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.1 0.476 . . . . 10.0 110.97 -179.343 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 3.1 m -101.4 139.39 37.13 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.702 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.11 -37.78 88.55 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.006 0.431 . . . . 10.0 111.183 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 39.4 ttp -64.76 -35.77 82.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.036 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.61 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 22.6 ttt85 -66.5 -51.53 55.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.545 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.33 -38.99 72.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.876 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 3.0 tp60 -58.53 -56.09 26.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.64 -0.709 . . . . 10.0 112.255 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 71' ' ' TYR . . . . . 0.61 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 1.7 p90 -67.28 -15.74 63.87 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 113.594 0.961 . . . . 10.0 113.594 -178.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 72' ' ' MET . . . . . 0.559 ' HB3' HG21 ' B' ' 103' ' ' VAL . 86.2 mtp -80.16 -18.31 50.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.773 0.321 . . . . 10.0 111.197 179.676 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 73' ' ' ARG . . . . . 0.578 ' HD2' ' O2P' ' A' ' 23' ' ' PCW . 4.1 mtt-85 -75.15 -29.75 60.57 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.864 0.364 . . . . 10.0 110.715 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.59 -0.39 37.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.853 -0.612 . . . . 10.0 112.468 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -84.92 127.56 8.24 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.331 -0.937 . . . . 10.0 112.44 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -86.93 -42.28 13.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.218 0.532 . . . . 10.0 109.823 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -130.32 144.45 15.75 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 110.538 -1.025 . . . . 10.0 110.538 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -122.64 129.26 51.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.046 0.451 . . . . 10.0 111.861 -178.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.855 ' HG ' HD22 ' B' ' 159' ' ' LEU . 78.7 mt -96.88 108.82 21.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.549 -0.751 . . . . 10.0 109.886 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 19.3 m -85.47 91.08 8.12 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.027 -0.36 . . . . 10.0 110.027 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 47.4 t -89.6 121.61 39.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.542 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.639 ' HB3' HD11 ' B' ' 93' ' ' ILE . 20.1 p90 -130.51 152.1 50.26 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.661 -0.7 . . . . 10.0 109.882 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -91.67 125.97 36.59 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.976 -0.379 . . . . 10.0 109.976 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 84' ' ' ILE . . . . . 0.848 HD11 ' HA ' ' B' ' 118' ' ' CYS . 43.8 pt -70.44 -8.06 10.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.2 0.524 . . . . 10.0 111.16 -179.578 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 85' ' ' ASN . . . . . 0.499 HD21 ' HB3' ' B' ' 117' ' ' LYS . 0.0 OUTLIER -101.43 5.56 42.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.104 179.572 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -132.07 106.81 8.24 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.402 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 87' ' ' THR . . . . . 0.484 ' O ' ' HG3' ' B' ' 91' ' ' GLU . 0.2 OUTLIER -59.2 -39.52 82.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.906 -0.588 . . . . 10.0 112.479 -179.085 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -59.1 -36.06 74.5 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.778 0.288 . . . . 10.0 111.778 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 21.1 m -64.71 -36.53 84.59 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.001 0.429 . . . . 10.0 110.6 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -70.94 -34.43 71.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.682 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 91' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' B' ' 87' ' ' THR . 30.5 mt-10 -79.31 -25.78 42.34 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.97 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 92' ' ' ASP . . . . . 0.472 ' O ' ' HB3' ' B' ' 95' ' ' HIS . 0.3 OUTLIER -80.75 -2.64 47.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.495 -179.22 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 93' ' ' ILE . . . . . 0.639 HD11 ' HB3' ' B' ' 82' ' ' PHE . 29.5 mm -58.58 -42.36 84.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.728 0.299 . . . . 10.0 111.104 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 17.2 t60 -68.4 -26.62 65.64 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.986 0.422 . . . . 10.0 110.366 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 95' ' ' HIS . . . . . 0.472 ' HB3' ' O ' ' B' ' 92' ' ' ASP . 9.9 t-160 -66.08 -40.8 91.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.685 -0.689 . . . . 10.0 109.803 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -71.7 -44.27 64.48 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.408 -0.96 . . . . 10.0 108.408 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -51.84 -53.47 39.95 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.967 -1.015 . . . . 10.0 111.691 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -64.76 -37.18 86.72 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.126 0.417 . . . . 10.0 112.126 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 99' ' ' GLN . . . . . 0.411 ' O ' HG13 ' B' ' 103' ' ' VAL . 35.2 tt0 -61.97 -49.72 74.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.019 -0.363 . . . . 10.0 110.019 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 100' ' ' ILE . . . . . 0.555 ' HA ' HG22 ' B' ' 103' ' ' VAL . 42.1 mt -62.81 -42.15 95.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 10.0 111.018 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 101' ' ' LYS . . . . . 0.714 ' HE2' ' HG3' ' B' ' 107' ' ' GLU . 9.1 mtpm? -60.29 -32.86 71.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.545 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 49.2 ttp85 -80.69 -40.14 25.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.938 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.559 HG21 ' HB3' ' B' ' 72' ' ' MET . 18.8 m -69.16 -26.34 31.73 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 112.469 0.544 . . . . 10.0 112.469 -179.186 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -98.86 -14.09 19.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.761 0.315 . . . . 10.0 110.868 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 11.4 t70 59.47 39.48 21.8 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.146 -178.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 19.6 m -155.16 139.37 16.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.458 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 107' ' ' GLU . . . . . 0.714 ' HG3' ' HE2' ' B' ' 101' ' ' LYS . 7.2 mp0 -85.74 -13.07 49.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.651 0.739 . . . . 10.0 109.46 178.586 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -102.06 86.03 2.79 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.934 -1.03 . . . . 10.0 110.177 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 55.9 t -130.82 131.84 23.53 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.014 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -64.24 112.13 1.81 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.866 2.378 . . . . 10.0 111.824 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 111' ' ' MET . . . . . 0.432 ' HB2' HG21 ' B' ' 139' ' ' ILE . 57.5 mtt -130.54 149.61 52.13 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.126 -0.488 . . . . 10.0 109.746 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 112' ' ' VAL . . . . . 0.526 ' HB ' HD23 ' B' ' 79' ' ' LEU . 99.4 t -130.97 128.03 61.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.772 -0.455 . . . . 10.0 109.772 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 17.1 tp -82.91 119.56 24.57 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.557 -0.535 . . . . 10.0 109.557 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 51.2 t -117.26 117.03 53.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 120.963 0.411 . . . . 10.0 111.48 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -98.79 115.14 5.22 Favored Glycine 0 N--CA 1.45 -0.388 0 N-CA-C 110.304 -1.118 . . . . 10.0 110.304 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -103.04 164.18 11.77 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 117.204 0.502 . . . . 10.0 112.147 -178.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 117' ' ' LYS . . . . . 0.499 ' HB3' HD21 ' B' ' 85' ' ' ASN . 13.6 mtmt 69.44 41.68 1.26 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.108 -0.951 . . . . 10.0 113.112 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 118' ' ' CYS . . . . . 0.848 ' HA ' HD11 ' B' ' 84' ' ' ILE . 15.4 p -81.04 -12.49 59.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.21 0.529 . . . . 10.0 110.266 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -76.47 -12.19 60.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.388 -0.824 . . . . 10.0 110.945 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 31.6 mt -95.17 136.86 22.35 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.143 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -72.84 3.54 4.33 Favored 'Trans proline' 0 CA--C 1.53 0.295 0 C-N-CA 122.623 2.216 . . . . 10.0 112.904 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.26 32.56 0.69 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.858 0.361 . . . . 10.0 111.147 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 123' ' ' ARG . . . . . 0.643 ' HG3' HD12 ' B' ' 84' ' ' ILE . 24.6 ttm-85 -64.4 105.1 0.87 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.899 0.381 . . . . 10.0 111.557 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.5 m -94.12 -40.86 9.83 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.297 0.57 . . . . 10.0 109.661 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 45.7 t -86.7 122.84 39.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.566 -0.743 . . . . 10.0 109.577 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.9 150.14 42.85 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.986 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.38 -35.99 77.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.444 -179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -69.47 -33.99 73.71 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.62 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -62.43 -47.53 83.65 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.046 0.45 . . . . 10.0 110.151 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.33 94.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.741 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -63.2 -44.49 95.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.439 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -62.96 -42.22 99.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.987 0.422 . . . . 10.0 111.221 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 37.1 tp -66.2 -43.88 85.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.046 0.451 . . . . 10.0 110.276 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.22 -43.54 97.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.618 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -61.34 -35.53 77.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.683 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.0 m -67.27 -33.95 76.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.875 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -83.41 -19.84 35.25 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.231 0.539 . . . . 10.0 110.194 178.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.21 30.46 25.25 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 111.03 -0.828 . . . . 10.0 111.03 -179.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 139' ' ' ILE . . . . . 0.432 HG21 ' HB2' ' B' ' 111' ' ' MET . 48.7 pt -123.37 151.63 63.09 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.763 -0.218 . . . . 10.0 110.74 -179.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.36 156.96 33.07 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.384 2.056 . . . . 10.0 112.059 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -122.73 129.84 52.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.512 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 33.2 mm -125.97 125.59 68.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.142 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -87.32 124.41 33.33 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.208 -1.034 . . . . 10.0 108.208 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 144' ' ' THR . . . . . 0.599 ' HA ' ' O ' ' B' ' 150' ' ' GLN . 40.2 p -126.82 172.94 9.95 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.577 0.955 . . . . 10.0 113.577 -177.128 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 26.5 t -159.79 125.16 4.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.245 -1.343 . . . . 10.0 107.615 178.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.47 -27.2 65.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.946 0.403 . . . . 10.0 111.828 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -73.79 -55.74 5.85 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.603 0.594 . . . . 10.0 112.603 -179.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 44.4 p -83.22 -14.81 52.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.641 -0.254 . . . . 10.0 111.591 -178.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 27.0 ttt180 68.32 22.88 7.86 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.622 0.725 . . . . 10.0 109.834 -178.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 150' ' ' GLN . . . . . 0.599 ' O ' ' HA ' ' B' ' 144' ' ' THR . 10.1 tt0 -62.05 111.45 1.94 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.907 -1.042 . . . . 10.0 111.833 -179.566 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 67.89 9.38 56.32 Favored Glycine 0 C--O 1.227 -0.303 0 N-CA-C 114.658 0.623 . . . . 10.0 114.658 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.68 -53.34 48.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 117.511 0.655 . . . . 10.0 111.17 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -62.01 -45.1 95.07 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.118 0.485 . . . . 10.0 110.373 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -63.48 -36.13 82.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.852 -0.613 . . . . 10.0 112.53 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.0 -47.85 81.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.908 0.385 . . . . 10.0 110.196 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -66.91 -42.02 86.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.686 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -62.99 -42.34 99.82 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.18 -0.463 . . . . 10.0 110.598 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.551 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 66.1 m -60.09 -41.4 92.4 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.807 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.855 HD22 ' HG ' ' B' ' 79' ' ' LEU . 41.0 tp -57.8 -43.65 85.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.495 -0.321 . . . . 10.0 110.222 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 46.4 t -64.78 -36.72 78.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.117 -0.492 . . . . 10.0 109.929 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 161' ' ' ARG . . . . . 0.551 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 67.3 mtt180 -63.25 -44.63 94.62 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.126 179.291 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 162' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' B' ' 158' ' ' THR . 17.0 mm-40 -64.39 -38.07 89.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.095 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 163' ' ' ILE . . . . . 0.509 ' O ' ' HG2' ' B' ' 167' ' ' LYS . 96.1 mt -65.02 -43.64 96.05 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.201 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -63.16 -40.33 97.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.534 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -65.5 -31.62 72.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.241 0.543 . . . . 10.0 109.653 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 20.8 t-80 -67.23 -35.65 80.03 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.913 178.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 167' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' B' ' 163' ' ' ILE . 55.1 mmtt -63.26 -48.93 76.09 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.789 -0.641 . . . . 10.0 109.623 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -61.37 -42.81 99.31 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.243 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -58.47 -46.39 86.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.943 -0.572 . . . . 10.0 110.474 179.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 16.8 ttm -67.01 -24.39 66.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.625 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 17.0 m -77.94 -12.76 60.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.018 0.437 . . . . 10.0 110.977 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -111.61 -40.46 4.33 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.244 -0.434 . . . . 10.0 111.619 -179.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -98.23 3.94 48.87 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.418 0.525 . . . . 10.0 112.418 -178.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . -109.47 31.38 7.65 Favored Glycine 0 N--CA 1.453 -0.183 0 N-CA-C 111.037 -0.825 . . . . 10.0 111.037 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 175' ' ' LYS . . . . . 0.864 ' HE2' HN1A ' A' ' 40' ' ' 17F . 19.9 tptt -155.03 131.56 10.52 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 -179.176 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 176' ' ' LYS . . . . . 0.409 ' O ' ' HE3' ' B' ' 175' ' ' LYS . 26.8 mmtp -82.93 119.87 24.97 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.995 -0.743 . . . . 10.0 108.995 179.031 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 16.0 ttmm 75.29 95.15 0.07 Allowed 'General case' 0 C--O 1.234 0.268 0 O-C-N 123.934 0.771 . . . . 10.0 111.301 -178.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 178' ' ' LYS . . . . . 0.607 ' NZ ' ' HN1' ' A' ' 40' ' ' 17F . 10.0 mmtt -116.97 144.92 44.01 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.657 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 179' ' ' LYS . . . . . 0.874 ' NZ ' ' HN1' ' A' ' 36' ' ' 17F . 0.1 OUTLIER -82.55 -14.94 54.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.806 179.82 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt 72.37 -60.59 0.52 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.76 -0.654 . . . . 10.0 111.693 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 11.6 m -80.49 164.77 22.75 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.505 -0.316 . . . . 10.0 110.252 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -100.19 -53.54 3.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.717 0.294 . . . . 10.0 111.597 -179.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.74 148.73 31.69 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.056 0.455 . . . . 10.0 111.704 -179.055 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 10.8 ptmm? -82.59 170.84 14.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.538 179.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 60.2 m . . . . . 0 C--N 1.32 -0.693 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.721 179.345 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 N-CA-C 111.946 -0.462 . . . . 10.0 111.946 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 1.6 p -126.15 130.11 50.38 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.618 0.247 . . . . 10.0 110.944 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 45.7 t -117.81 128.7 74.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.154 -0.476 . . . . 10.0 109.804 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 13.3 pttp -93.34 119.35 32.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.163 0.506 . . . . 10.0 111.395 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 812' ' ' VAL . . . . . 0.572 HG11 HD11 ' D' ' 834' ' ' LEU . 35.0 t -96.62 129.11 47.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.868 -0.605 . . . . 10.0 109.465 179.674 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -90.71 139.25 30.9 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.062 0.458 . . . . 10.0 111.194 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 814' ' ' LEU . . . . . 0.463 HD13 ' HG3' ' D' ' 841' ' ' ARG . 68.4 mt -112.4 154.94 44.37 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.507 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.91 55.13 1.71 Allowed 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.038 2.492 . . . . 10.0 112.649 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -151.3 19.65 0.75 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.164 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 817' ' ' LYS . . . . . 0.427 ' O ' ' H41' ' A' ' 25' ' ' PCW . 67.0 mttm 62.12 31.97 17.59 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.715 -0.675 . . . . 10.0 111.22 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 818' ' ' GLN . . . . . 0.454 ' NE2' ' HB2' ' B' ' 41' ' ' ARG . 95.2 mt-30 -141.91 173.47 11.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.254 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.48 171.02 18.73 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.793 0.33 . . . . 10.0 111.708 -179.149 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 9.7 t -138.12 141.49 40.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.725 -0.671 . . . . 10.0 109.357 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 47.2 t -92.33 110.84 23.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.973 0.416 . . . . 10.0 111.333 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 17.3 t -102.07 141.5 18.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.247 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.99 135.77 35.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.46 -0.337 . . . . 10.0 110.095 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 824' ' ' VAL . . . . . 0.701 HG11 ' HB2' ' D' ' 871' ' ' ASP . 57.3 t -75.14 116.3 17.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 110.231 -0.285 . . . . 10.0 110.231 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 23.6 mtp180 -129.26 109.5 11.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.995 0.426 . . . . 10.0 111.196 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -70.21 114.54 8.46 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.477 0.656 . . . . 10.0 110.186 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 147.71 -34.75 1.23 Allowed Glycine 0 N--CA 1.446 -0.65 0 N-CA-C 110.118 -1.193 . . . . 10.0 110.118 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 828' ' ' MET . . . . . 0.433 ' HB2' ' HB2' ' D' ' 832' ' ' ASP . 10.7 ptm -98.0 150.29 21.53 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.447 -0.377 . . . . 10.0 110.132 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 829' ' ' SER . . . . . 0.67 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.3 OUTLIER -94.36 176.73 6.19 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.301 -179.065 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 92.3 t -59.05 -37.29 67.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 831' ' ' TYR . . . . . 0.498 ' HA ' ' HE3' ' D' ' 863' ' ' TRP . 52.9 t80 -58.09 -49.7 76.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.497 -0.774 . . . . 10.0 110.912 179.488 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 832' ' ' ASP . . . . . 0.433 ' HB2' ' HB2' ' D' ' 828' ' ' MET . 3.3 m-20 -68.42 -38.36 81.15 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.08 -0.509 . . . . 10.0 112.05 -179.064 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 5.4 m -73.02 -43.45 62.06 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.814 0.672 . . . . 10.0 112.814 -178.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 834' ' ' LEU . . . . . 0.572 HD11 HG11 ' D' ' 812' ' ' VAL . 0.6 OUTLIER -79.22 -15.02 58.67 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.454 0.539 . . . . 10.0 112.454 -178.896 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -56.3 -52.44 64.52 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.056 0.391 . . . . 10.0 112.056 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 5.2 mmmm -59.55 -36.39 76.07 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.062 0.393 . . . . 10.0 112.062 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -71.34 -38.3 71.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.915 0.388 . . . . 10.0 111.294 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 838' ' ' LEU . . . . . 0.421 HD21 HG11 ' D' ' 877' ' ' VAL . 90.4 mt -75.03 -45.22 43.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.275 -0.42 . . . . 10.0 111.184 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -58.91 -37.97 77.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.019 -0.537 . . . . 10.0 112.224 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 3.2 p -71.12 -12.75 16.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 121.073 0.463 . . . . 10.0 111.407 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 841' ' ' ARG . . . . . 0.463 ' HG3' HD13 ' D' ' 814' ' ' LEU . 11.8 mmt180 -110.65 -2.0 16.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.838 0.351 . . . . 10.0 111.061 179.696 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 77.65 24.4 65.13 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.999 -0.62 . . . . 10.0 112.443 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 843' ' ' LEU . . . . . 0.478 ' HB3' ' SG ' ' D' ' 848' ' ' CYS . 93.3 mt -106.52 143.93 33.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.545 0.212 . . . . 10.0 110.481 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -109.32 159.34 17.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.259 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -78.15 62.57 2.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.791 0.329 . . . . 10.0 110.995 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -134.32 -67.16 0.59 Allowed 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.123 -0.489 . . . . 10.0 112.046 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 1.7 p -87.78 -17.05 32.47 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.229 0.537 . . . . 10.0 110.707 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 848' ' ' CYS . . . . . 0.478 ' SG ' ' HB3' ' D' ' 843' ' ' LEU . 4.6 m -83.43 128.59 34.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.982 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 5.0 p -121.35 137.94 53.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.3 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 850' ' ' VAL . . . . . 0.438 HG22 HG22 ' D' ' 877' ' ' VAL . 20.7 t -98.62 127.31 51.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.779 -179.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -108.04 135.92 48.59 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.19 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 852' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' D' ' 858' ' ' LYS . 71.6 mtp180 -87.2 169.88 11.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.002 -0.544 . . . . 10.0 109.564 178.718 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 853' ' ' LEU . . . . . 0.856 ' HG ' ' H71' ' A' ' 31' ' ' PCW . 0.6 OUTLIER -121.42 78.65 1.45 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.461 0.648 . . . . 10.0 111.049 -179.697 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 65.8 mt -91.66 94.24 4.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.227 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 855' ' ' LYS . . . . . 0.496 ' HA ' ' HD3' ' D' ' 855' ' ' LYS . 31.5 mmtt 58.58 28.39 17.02 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.51 -0.768 . . . . 10.0 112.157 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 102.25 -19.85 47.13 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 121.042 -0.599 . . . . 10.0 112.13 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 857' ' ' ARG . . . . . 0.445 ' HE ' ' C19' ' A' ' 31' ' ' PCW . 0.0 OUTLIER -83.48 111.61 19.21 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.925 0.393 . . . . 10.0 111.3 -179.648 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D ' 858' ' ' LYS . . . . . 0.652 ' HE2' HD13 ' D' ' 876' ' ' ILE . 86.6 mttt -69.95 112.9 6.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.892 178.797 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -110.35 134.49 52.24 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.792 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 46.1 t -68.81 123.68 22.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.661 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 861' ' ' THR . . . . . 0.463 ' HB ' ' HG3' ' D' ' 852' ' ' ARG . 1.8 t -105.22 172.8 6.6 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.184 -0.302 . . . . 10.0 110.184 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -114.34 163.59 15.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.985 0.421 . . . . 10.0 110.817 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 863' ' ' TRP . . . . . 0.498 ' HE3' ' HA ' ' D' ' 831' ' ' TYR . 78.7 m95 -82.6 -21.44 35.17 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.539 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.91 -16.58 58.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.668 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 2.9 m -69.49 138.81 53.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.647 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 866' ' ' ALA . . . . . 0.67 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -76.43 151.55 36.48 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.671 -0.492 . . . . 10.0 109.671 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 867' ' ' ILE . . . . . 0.464 ' HA ' HD23 ' D' ' 870' ' ' LEU . 7.3 tp -82.93 0.59 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 121.104 0.478 . . . . 10.0 112.155 -179.129 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -61.29 -56.05 37.67 Favored Pre-proline 0 CA--C 1.543 0.707 0 N-CA-C 113.67 0.989 . . . . 10.0 113.67 -179.012 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.44 3.77 5.03 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 121.984 1.789 . . . . 10.0 113.001 -179.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 870' ' ' LEU . . . . . 0.464 HD23 ' HA ' ' D' ' 867' ' ' ILE . 2.9 mm? -85.76 -11.99 52.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.007 0.432 . . . . 10.0 111.402 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 871' ' ' ASP . . . . . 0.701 ' HB2' HG11 ' D' ' 824' ' ' VAL . 2.9 t70 -64.09 114.97 4.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.362 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 133.77 -30.18 3.01 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.76 -0.733 . . . . 10.0 112.508 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -119.78 -167.62 1.46 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.59 0.233 . . . . 10.0 110.937 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -131.7 153.71 49.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.114 -0.493 . . . . 10.0 110.286 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 70.6 mt -114.51 144.82 42.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.716 0.294 . . . . 10.0 111.622 -178.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 876' ' ' ILE . . . . . 0.652 HD13 ' HE2' ' D' ' 858' ' ' LYS . 3.2 mp -123.7 123.7 67.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 877' ' ' VAL . . . . . 0.438 HG22 HG22 ' D' ' 850' ' ' VAL . 17.3 t -103.44 135.77 39.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 120.649 0.261 . . . . 10.0 111.009 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 878' ' ' GLU . . . . . 0.496 ' OE2' ' H81' ' A' ' 24' ' ' PCW . 0.0 OUTLIER -138.79 164.89 28.43 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.023 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D ' 879' ' ' VAL . . . . . 0.794 ' HB ' ' H62' ' A' ' 20' ' ' PCW . 45.0 t -106.21 127.06 61.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 120.67 0.271 . . . . 10.0 110.57 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 94.7 mt . . . . . 0 C--O 1.252 1.207 0 CA-C-O 118.392 -0.813 . . . . 10.0 111.088 -179.998 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PCW . . . . . 0.796 H181 ' H18' ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PCW . . . . . 0.434 H481 H441 ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PCW . . . . . 0.674 H362 H321 ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PCW . . . . . 0.532 ' O2P' ' H82' ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PCW . . . . . 0.7 H382 ' H18' ' A' ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PCW . . . . . 0.922 H122 H352 ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PCW . . . . . 0.467 H261 H442 ' A' ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PCW . . . . . 0.676 H321 H331 ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PCW . . . . . 0.703 H332 H341 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PCW . . . . . 0.705 ' H61' ' H2 ' ' A' ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PCW . . . . . 0.623 H281 H451 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PCW . . . . . 0.793 H152 H352 ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PCW . . . . . 0.524 H182 H331 ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PCW . . . . . 0.833 H451 H19A ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PCW . . . . . 0.898 H321 ' H19' ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PCW . . . . . 0.922 H352 H122 ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PCW . . . . . 0.556 ' H81' H352 ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PCW . . . . . 0.674 H321 H362 ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PCW . . . . . 0.559 H132 H141 ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PCW . . . . . 0.794 ' H62' ' HB ' ' D' ' 879' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PCW . . . . . 0.545 H472 H221 ' A' ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PCW . . . . . 0.793 H352 H152 ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PCW . . . . . 0.578 ' O2P' ' HD2' ' B' ' 73' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PCW . . . . . 0.754 H331 ' H32' ' A' ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PCW . . . . . 0.716 H131 ' H42' ' A' ' 24' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PCW . . . . . 0.644 H471 H152 ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PCW . . . . . 0.58 ' H41' ' O2 ' ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PCW . . . . . 0.644 H242 H481 ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PCW . . . . . 0.455 H252 ' H20' ' A' ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PCW . . . . . 0.632 H181 H362 ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PCW . . . . . 0.856 ' H71' ' HG ' ' D' ' 853' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PCW . . . . . 0.658 H331 ' H11' ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' 17F . . . . . 0.548 ' H33' H151 ' A' ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' 17F . . . . . 0.833 H19A H451 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' 17F . . . . . 0.796 ' H18' H181 ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' 17F . . . . . 0.874 ' HN1' ' NZ ' ' B' ' 179' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' 17F . . . . . 0.686 HN1A ' H61' ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' 17F . . . . . 0.7 ' H18' H382 ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' 17F . . . . . 0.463 ' H46' H222 ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' 17F . . . . . 0.864 HN1A ' HE2' ' B' ' 175' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PCW . . . . . 0.578 ' H71' ' O1P' ' A' ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PCW . . . . . 0.746 ' H40' H482 ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PCW . . . . . 0.586 H211 H431 ' A' ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PCW . . . . . 0.64 H262 ' H19' ' A' ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PCW . . . . . 0.64 H141 ' HN1' ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PCW . . . . . 0.785 H182 H252 ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PCW . . . . . 0.642 ' H31' ' H4A' ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PCW . . . . . 0.607 ' H82' H411 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PCW . . . . . 0.606 H442 H261 ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PCW . . . . . 0.759 ' H31' ' H4 ' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PCW . . . . . 0.731 H361 H341 ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PCW . . . . . 0.746 H482 ' H40' ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PCW . . . . . 0.623 H152 H171 ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PCW . . . . . 0.832 H352 ' H11' ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PCW . . . . . 0.64 ' H19' H262 ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PCW . . . . . 0.434 H441 H481 ' A' ' 2' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PCW . . . . . 0.525 ' H61' ' H39' ' A' ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PCW . . . . . 0.456 H352 H171 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PCW . . . . . 0.579 H472 H231 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' PCW . . . . . 0.665 H461 H432 ' A' ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PCW . . . . . 0.607 H411 ' H82' ' A' ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PCW . . . . . 0.573 H171 H161 ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PCW . . . . . 0.665 H432 H461 ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PCW . . . . . 0.657 H352 H162 ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PCW . . . . . 0.566 H181 ' H56' ' A' ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PCW . . . . . 0.738 H452 ' H59' ' A' ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PCW . . . . . 0.888 ' H81' ' H37' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PCW . . . . . 0.603 H462 ' H40' ' A' ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PCW . . . . . 0.614 H132 H332 ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PCW . . . . . 0.731 H341 H361 ' A' ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PCW . . . . . 0.645 H212 H361 ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PCW . . . . . 0.832 ' H11' H352 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' 17F . . . . . 0.642 ' H4A' ' H31' ' A' ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' 17F . . . . . 0.669 ' H12' ' H44' ' A' ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' 17F . . . . . 0.808 ' H60' H141 ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' 17F . . . . . 0.507 ' H42' ' H10' ' A' ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' 17F . . . . . 0.618 HN1A ' H32' ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' 17F . . . . . 0.888 ' H37' ' H81' ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' 17F . . . . . 0.738 ' H59' H452 ' A' ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' 17F . . . . . 0.566 ' H56' H181 ' A' ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 201' ' ' GNP . . . . . 0.541 H5'2 ' HA ' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 76.7 mt . . . . . 0 C--O 1.222 -0.35 0 N-CA-C 110.031 -0.359 . . . . 10.0 110.031 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -66.27 -50.33 64.06 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -58.29 -45.3 88.21 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.444 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . 0.585 ' HB3' ' NH2' ' C' ' 532' ' ' ARG . 31.2 mm-40 -63.87 -44.84 91.88 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.978 -1.01 . . . . 10.0 110.479 179.054 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . 0.458 ' HG3' ' HG ' ' A' ' 247' ' ' LEU . 0.1 OUTLIER -65.15 -27.48 68.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.908 179.336 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 24.8 m -63.03 -49.16 75.72 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 108.411 -0.959 . . . . 10.0 108.411 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -70.55 -42.42 71.17 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.142 -0.688 . . . . 10.0 109.142 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . 0.449 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.6 OUTLIER -53.29 -65.02 0.64 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.277 -0.874 . . . . 10.0 110.934 179.911 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.458 ' HG ' ' HG3' ' A' ' 243' ' ' MET . 45.2 mt -58.5 -45.97 87.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.817 -0.629 . . . . 10.0 111.972 -179.114 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -61.03 -48.25 82.62 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.947 0.351 . . . . 10.0 111.947 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -65.19 -40.83 94.75 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.116 -0.328 . . . . 10.0 110.116 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . 0.627 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 24.8 t -63.51 -42.85 97.63 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.441 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.547 179.054 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . 0.454 ' O ' HG12 ' A' ' 254' ' ' VAL . 89.6 mttt -72.38 -43.43 63.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.829 0.347 . . . . 10.0 111.398 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.94 -34.73 78.1 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.321 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 45.4 mtpt -88.57 -25.49 22.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.398 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.627 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.5 OUTLIER -65.84 -26.22 38.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.739 0.304 . . . . 10.0 110.548 179.51 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -60.93 9.04 Favored Pre-proline 0 CA--C 1.535 0.388 0 CA-C-N 116.188 -0.46 . . . . 10.0 109.809 178.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . 0.421 ' HA ' ' HB3' ' A' ' 259' ' ' ASP . 20.1 Cg_endo -65.39 -24.41 57.34 Favored 'Trans proline' 0 C--N 1.36 1.176 0 C-N-CA 121.725 1.617 . . . . 10.0 111.059 177.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . 0.517 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 6.7 m-30 -65.53 -52.97 48.6 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 177.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 83.8 mt -66.44 -41.21 89.48 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.556 -0.747 . . . . 10.0 110.007 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . 0.447 ' O ' ' HB2' ' A' ' 263' ' ' LYS . 5.6 t70 -60.18 -43.91 95.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.065 0.459 . . . . 10.0 110.391 178.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -65.55 -47.24 76.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.278 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -65.92 -45.94 80.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.782 -0.644 . . . . 10.0 111.646 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 23.1 tt0 -64.9 -34.71 79.05 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-O 120.497 0.189 . . . . 10.0 110.537 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 259' ' ' ASP . 2.8 ttmp? -60.83 -49.57 76.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.507 0.67 . . . . 10.0 109.283 178.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.437 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 41.7 mttt -70.64 -35.11 72.74 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.342 -0.844 . . . . 10.0 110.199 179.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 9.2 t90 -62.44 -35.73 80.19 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.746 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -62.02 -46.05 90.88 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 108.827 -0.805 . . . . 10.0 108.827 178.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -62.74 -43.55 98.51 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 46.3 mt-10 -56.81 -48.9 76.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.68 179.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 81.3 mmm -71.64 -43.17 66.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.754 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -61.51 -49.94 74.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.902 -0.135 . . . . 10.0 111.113 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 86.8 mt -64.58 -36.27 83.68 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.867 -0.42 . . . . 10.0 109.867 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . 0.474 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 40.6 t80 -61.67 -50.03 74.14 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.479 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' A' ' 273' ' ' ARG . 50.3 mtt85 -67.05 -36.03 81.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.706 0.288 . . . . 10.0 110.588 179.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -61.2 -45.34 94.99 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.797 -0.638 . . . . 10.0 109.923 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.793 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 63.1 mttt -80.52 -31.65 37.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.428 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 1.4 t -53.95 -37.64 34.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 O-C-N 123.123 0.264 . . . . 10.0 111.42 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -58.96 -63.37 4.23 Favored Pre-proline 0 CA--C 1.533 0.296 0 N-CA-C 112.332 0.493 . . . . 10.0 112.332 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . 0.472 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 15.5 Cg_endo -60.68 -35.69 88.3 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 122.11 1.873 . . . . 10.0 111.601 178.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.979 HD22 ' HG2' ' C' ' 495' ' ' LYS . 16.6 mt -65.19 -41.61 94.38 Favored 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 109.931 -0.396 . . . . 10.0 109.931 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 20.4 ttm180 -67.55 -35.07 78.34 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -65.82 -44.17 86.43 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.261 178.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 83.8 mt-10 -60.46 -45.08 95.01 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 108.953 -0.758 . . . . 10.0 108.953 178.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 84.3 mt -62.71 -47.14 84.89 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.459 -0.791 . . . . 10.0 109.884 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -62.98 -56.71 14.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.91 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -61.92 -43.97 97.74 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.884 0.374 . . . . 10.0 110.576 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -61.98 -47.2 91.6 Favored Glycine 0 N--CA 1.444 -0.819 0 N-CA-C 110.857 -0.897 . . . . 10.0 110.857 178.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.61 -34.5 78.41 Favored 'General case' 0 C--O 1.218 -0.595 0 N-CA-C 110.187 -0.301 . . . . 10.0 110.187 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . 0.417 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 88.4 mtt180 -57.81 -44.92 86.7 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -68.83 -53.2 22.83 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.655 -0.498 . . . . 10.0 109.655 178.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 53.6 mttt -52.82 -49.74 65.07 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.668 -0.696 . . . . 10.0 111.515 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 84.1 mt -68.11 -45.48 73.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.487 -0.324 . . . . 10.0 111.355 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . 0.464 ' O ' ' HG3' ' A' ' 296' ' ' GLU . 43.8 t60 -59.84 -47.72 84.61 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.686 -0.234 . . . . 10.0 110.683 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 297' ' ' LYS . 44.3 mt-10 -63.03 -35.27 79.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.689 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 36.6 mt -70.94 -38.6 72.87 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.066 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -63.57 -35.39 80.34 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 108.65 -0.87 . . . . 10.0 108.65 177.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 292' ' ' HIS . 56.7 mt-10 -73.2 -7.44 51.45 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.081 -0.963 . . . . 10.0 110.349 178.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 293' ' ' GLU . 2.6 mmpp? -100.87 -44.28 5.82 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.757 -0.831 . . . . 10.0 108.757 178.059 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 90.7 mt -60.82 -22.85 64.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.598 -0.728 . . . . 10.0 111.267 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . 0.518 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 18.5 m -73.77 -67.09 0.45 Allowed Pre-proline 0 CA--C 1.542 0.642 0 C-N-CA 120.841 -0.344 . . . . 10.0 111.41 178.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . 0.518 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 37.3 Cg_endo -65.84 -44.59 7.61 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.04 1.827 . . . . 10.0 112.25 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.542 HD13 ' HG2' ' C' ' 473' ' ' LYS . 85.0 mt -69.89 -22.01 63.27 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.024 0.44 . . . . 10.0 110.007 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -77.99 -45.22 10.62 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 109.169 -1.573 . . . . 10.0 109.169 177.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -61.57 -41.95 98.13 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.6 -0.889 . . . . 10.0 108.6 177.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.07 -36.88 85.07 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.272 -0.876 . . . . 10.0 109.448 178.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 11.2 tpt -64.81 -46.13 83.31 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.511 -0.551 . . . . 10.0 109.511 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 27.8 mtt180 -63.52 -43.55 96.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.419 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . 0.918 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 5.1 t0 -64.19 -40.04 95.26 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.253 -0.431 . . . . 10.0 110.348 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . 1.57 ' CD ' HD11 ' C' ' 469' ' ' LEU . 5.1 mmp_? -69.55 -36.72 76.62 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.912 -0.774 . . . . 10.0 108.912 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . 0.529 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -65.39 -35.07 79.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.739 -0.664 . . . . 10.0 109.783 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . 0.918 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 86.2 mtt180 -58.37 -55.22 37.86 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 109.026 -0.731 . . . . 10.0 109.026 178.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -62.28 -39.89 94.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.613 178.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . 0.592 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 0.2 OUTLIER -56.29 -54.45 45.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.738 179.246 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . 0.449 ' O ' ' HG3' ' A' ' 317' ' ' ARG . 57.7 t -73.75 -41.77 54.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.813 -0.63 . . . . 10.0 112.24 -178.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.1 -39.15 93.84 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.998 -0.281 . . . . 10.0 111.309 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -68.21 -28.73 67.5 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 108.569 -0.9 . . . . 10.0 108.569 177.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 16.5 mt -73.86 -37.17 64.84 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-N 115.428 -0.806 . . . . 10.0 108.889 178.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . 0.449 ' HG3' ' O ' ' A' ' 313' ' ' VAL . 74.9 mtt180 -61.58 -49.37 76.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.933 0.397 . . . . 10.0 110.163 179.23 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -69.18 -10.35 57.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.818 -0.628 . . . . 10.0 112.063 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 17.5 m80 -106.31 -50.49 3.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.652 -0.249 . . . . 10.0 111.372 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 82.8 mt -63.12 -38.57 91.71 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.539 0.57 . . . . 10.0 112.539 -179.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.19 -60.24 9.54 Favored Pre-proline 0 CA--C 1.534 0.345 0 C-N-CA 121.206 -0.198 . . . . 10.0 111.292 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -66.43 -32.73 39.72 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 121.444 1.429 . . . . 10.0 111.239 178.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . 0.418 ' O ' ' HB2' ' A' ' 327' ' ' LEU . 5.2 m-30 -60.6 -48.66 80.78 Favored 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 110.333 -0.247 . . . . 10.0 110.333 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . 0.49 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 25.4 p -69.97 -35.05 74.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.859 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . 0.643 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 37.0 t70 -67.04 -46.83 73.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.935 0.398 . . . . 10.0 110.161 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -67.77 -30.21 69.61 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.066 -0.716 . . . . 10.0 109.066 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 323' ' ' TYR . 1.0 OUTLIER -67.66 -29.61 68.95 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 108.952 -0.759 . . . . 10.0 108.952 178.01 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . 0.643 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 75.8 mtt180 -64.96 -38.45 91.02 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 108.611 -0.885 . . . . 10.0 108.611 178.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -69.12 -40.76 78.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.111 178.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . 0.53 ' NH2' ' HB3' ' C' ' 447' ' ' GLU . 13.5 ttm180 -65.17 -44.99 86.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.652 -0.704 . . . . 10.0 109.391 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 48.5 mt -65.12 -34.32 78.12 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.826 -0.624 . . . . 10.0 109.572 178.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -63.93 -43.07 96.99 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -64.2 -42.73 96.52 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.076 -0.713 . . . . 10.0 109.076 178.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . 0.558 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 6.7 mmt180 -61.28 -52.35 65.1 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.593 -0.73 . . . . 10.0 109.285 178.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 43.7 mt -61.51 -37.74 84.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.543 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -61.17 -48.86 79.61 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.42 -43.12 95.34 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.929 -0.578 . . . . 10.0 109.916 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 334' ' ' ARG . 69.5 mt -63.09 -32.61 74.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 10.0 111.274 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -76.46 -46.39 27.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.662 0.268 . . . . 10.0 110.507 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -65.48 -48.99 70.71 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.128 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . 0.427 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 3.8 m-20 -65.68 -38.04 88.16 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . 0.576 ' HA2' ' HD2' ' A' ' 345' ' ' ARG . . . -60.34 -42.98 99.06 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.472 -0.785 . . . . 10.0 111.544 179.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.75 -37.88 93.08 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 110.731 -0.948 . . . . 10.0 110.731 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -73.16 -44.82 59.41 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.446 -0.576 . . . . 10.0 109.446 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . 0.576 ' HD2' ' HA2' ' A' ' 342' ' ' GLY . 98.0 mtt180 -53.92 -49.33 68.9 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.969 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 95.3 mt -63.67 -40.56 97.14 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.325 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -64.29 -47.32 79.94 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.157 0.503 . . . . 10.0 109.839 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . 0.472 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 22.0 mt-10 -66.67 -41.38 88.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.788 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . 0.429 ' HD1' ' HA ' ' A' ' 349' ' ' TYR . 1.8 m-30 -61.22 -39.33 89.86 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.937 -0.394 . . . . 10.0 109.937 178.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -65.64 -39.92 91.96 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.395 -0.594 . . . . 10.0 109.395 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -65.7 -50.82 63.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.676 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 16.4 mttm -60.72 -37.57 82.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.575 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -64.89 -44.59 89.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.023 178.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 32.4 m -61.04 -41.79 97.25 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.832 -0.433 . . . . 10.0 109.832 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -63.19 -40.02 96.31 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . 0.554 ' HA ' ' OE1' ' C' ' 418' ' ' GLN . 17.7 m80 -65.79 -45.18 83.37 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.484 -0.78 . . . . 10.0 109.852 179.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.406 HD23 HD12 ' A' ' 360' ' ' LEU . 96.5 mt -59.49 -34.98 73.26 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.649 179.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . 0.5 ' O ' ' HG3' ' A' ' 362' ' ' GLU . 29.7 m -63.26 -49.19 75.06 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.057 -0.519 . . . . 10.0 110.258 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 21.0 p -72.63 -28.22 62.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.084 0.468 . . . . 10.0 109.942 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 356' ' ' HIS . 28.9 mt -64.45 -47.65 78.24 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.164 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 1.4 p -64.69 -34.87 79.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.817 0.341 . . . . 10.0 110.591 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 358' ' ' SER . 25.5 mt-10 -68.48 -9.02 46.19 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.426 179.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.578 ' HD3' HG23 ' C' ' 411' ' ' THR . 7.5 mtmp? -116.88 -29.81 5.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.604 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -73.5 -14.69 61.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.281 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.72 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 95.4 mttt -117.09 -68.86 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 112.401 0.519 . . . . 10.0 112.401 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.72 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 50.2 Cg_exo -57.42 -56.07 2.06 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.141 1.894 . . . . 10.0 112.445 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -64.07 -42.62 96.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.207 -0.452 . . . . 10.0 111.367 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 368' ' ' LEU . 9.2 mt -65.68 -37.57 86.86 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 120.908 -0.317 . . . . 10.0 111.248 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . 0.837 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 9.6 mt-10 -68.77 -32.75 72.72 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.998 -0.371 . . . . 10.0 109.998 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.22 -45.0 78.13 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.413 -0.958 . . . . 10.0 108.413 177.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.51 -47.95 79.61 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.171 -0.922 . . . . 10.0 109.908 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -65.13 -39.9 93.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.933 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.837 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.8 mt-30 -64.32 -34.58 78.47 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.15 -0.477 . . . . 20.0 110.704 178.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -77.43 -34.65 39.61 Favored Glycine 0 C--N 1.332 0.336 0 N-CA-C 109.698 -1.361 . . . . 10.0 109.698 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 18.0 mt -61.26 -28.39 69.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.758 -0.221 . . . . 10.0 111.186 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . 0.491 ' HB2' ' HD3' ' A' ' 377' ' ' PRO . 56.3 mt -59.47 -65.07 2.27 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 121.083 -0.247 . . . . 10.0 111.089 179.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . 0.491 ' HD3' ' HB2' ' A' ' 376' ' ' LEU . 30.6 Cg_endo -65.09 -34.07 47.92 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 121.819 1.68 . . . . 10.0 111.212 178.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 16.0 t -62.3 -53.36 48.48 Favored 'Isoleucine or valine' 0 C--O 1.231 0.095 0 CA-C-N 116.702 -0.226 . . . . 10.0 110.433 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . 0.4 ' O ' ' HG3' ' A' ' 383' ' ' LYS . 40.4 mt -62.09 -41.47 98.23 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 109.957 -0.386 . . . . 10.0 109.957 179.327 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . 0.485 ' O ' HG23 ' A' ' 384' ' ' VAL . 73.8 mt-10 -61.78 -46.65 88.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.765 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 30.0 p -64.45 -34.11 77.43 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.867 0.365 . . . . 10.0 110.346 178.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . 0.434 ' HD1' ' HA ' ' A' ' 382' ' ' PHE . 3.3 m-30 -68.55 -41.4 79.88 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.06 -0.718 . . . . 10.0 109.06 178.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 379' ' ' LEU . 83.0 mttt -63.22 -40.28 97.01 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 178.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 380' ' ' GLU . 54.5 t -59.98 -45.86 94.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-N 116.057 -0.52 . . . . 10.0 109.927 178.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.26 -43.06 71.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.522 -0.308 . . . . 10.0 111.491 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -63.68 -48.31 77.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.767 0.318 . . . . 10.0 111.38 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 99.2 mt -63.07 -39.76 95.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.432 -0.349 . . . . 10.0 111.363 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . 0.414 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 31.4 p -72.52 -39.31 67.66 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.856 -0.338 . . . . 10.0 110.896 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -66.01 -31.07 71.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.261 0.553 . . . . 10.0 110.318 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 27.6 mt -61.4 -22.0 64.6 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.752 -0.658 . . . . 10.0 111.113 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -64.02 -50.36 68.81 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.902 -0.777 . . . . 10.0 108.902 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . 0.643 ' HA ' ' HG2' ' A' ' 395' ' ' LYS . 20.5 mp0 -61.56 -44.05 97.75 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.32 -0.855 . . . . 10.0 111.658 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -54.04 -42.52 69.27 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 123.683 0.614 . . . . 10.0 112.169 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 30.2 m -82.88 -38.88 22.3 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.396 0.517 . . . . 10.0 112.396 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . 0.643 ' HG2' ' HA ' ' A' ' 392' ' ' GLU . 2.1 ptpt . . . . . 0 N--CA 1.466 0.34 0 N-CA-C 112.808 0.67 . . . . 10.0 112.808 -178.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 1.7 mt . . . . . 0 N--CA 1.452 -0.328 0 CA-C-O 120.835 0.35 . . . . 10.0 111.003 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 56.9 mt -64.6 -38.06 89.71 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.156 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.84 -43.55 75.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.617 0.722 . . . . 10.0 109.484 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -66.91 -44.73 80.03 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.391 -0.822 . . . . 10.0 110.667 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -29.19 69.81 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.224 -0.444 . . . . 10.0 111.176 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.23 -37.16 79.49 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 109.406 -0.59 . . . . 10.0 109.406 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 69.6 m -69.8 -28.63 65.89 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.408 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . 0.439 ' O ' ' HB ' ' C' ' 411' ' ' THR . 57.6 t -69.93 -38.16 74.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.479 -0.782 . . . . 10.0 108.89 178.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 1.6 m -62.54 -41.82 99.13 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.5 -0.926 . . . . 10.0 108.5 177.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 3.8 m -63.82 -33.18 75.09 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.044 -0.725 . . . . 10.0 109.044 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . 0.578 HG23 ' HD3' ' A' ' 363' ' ' LYS . 95.7 m -65.93 -41.83 90.88 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 108.847 -0.797 . . . . 10.0 108.847 178.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -61.87 -42.3 98.89 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.291 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' C' ' 417' ' ' GLU . 8.5 m -61.17 -44.73 96.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.012 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' C' ' 414' ' ' LYS . 35.0 mmtt -61.71 -37.58 84.7 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.127 0.489 . . . . 10.0 110.007 178.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' C' ' 411' ' ' THR . 83.9 mt -68.83 -38.24 79.7 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.663 178.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -65.0 -31.74 73.13 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.431 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' C' ' 413' ' ' SER . 13.7 mt-10 -65.25 -35.54 81.34 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . 0.744 ' O ' ' HB ' ' C' ' 422' ' ' VAL . 26.0 mt-30 -80.56 -33.49 36.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.723 -0.672 . . . . 10.0 109.972 178.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 53.2 mt -63.94 -15.88 60.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.636 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -89.0 -95.76 1.05 Allowed Glycine 0 N--CA 1.444 -0.803 0 C-N-CA 120.801 -0.714 . . . . 10.0 111.969 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . 0.466 ' O ' ' HB2' ' C' ' 425' ' ' GLU . 12.3 Cg_endo -54.05 -39.96 83.34 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.553 2.835 . . . . 10.0 114.345 -178.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . 0.744 ' HB ' ' O ' ' C' ' 418' ' ' GLN . 76.0 t -63.61 -48.18 87.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 117.953 0.342 . . . . 10.0 111.062 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 4.9 m -68.59 -39.16 81.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.817 0.342 . . . . 10.0 110.096 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -61.97 -42.28 98.95 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.276 -0.639 . . . . 10.0 109.276 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' C' ' 421' ' ' PRO . 14.6 tt0 -64.8 -39.74 94.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.205 -0.907 . . . . 10.0 108.676 178.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.37 -38.86 88.52 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.048 -0.723 . . . . 10.0 109.048 178.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -66.98 -38.16 85.55 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.602 178.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -64.7 -36.92 85.83 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . 0.472 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 7.2 t30 -68.2 -39.94 82.3 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 177.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 43.2 mt -61.21 -34.12 74.59 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.518 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -63.76 -35.61 81.16 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -72.89 -36.83 67.41 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.567 -0.901 . . . . 10.0 108.567 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -63.59 -48.62 76.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.039 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.75 -42.85 97.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.91 -0.587 . . . . 10.0 110.227 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -63.03 -40.92 99.19 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.92 -44.94 96.66 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 110.405 -1.078 . . . . 10.0 110.405 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 98.1 mt -63.39 -31.32 72.44 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' C' ' 438' ' ' ARG . 50.1 mtt180 -77.07 -3.45 39.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.089 0.471 . . . . 10.0 110.453 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -111.41 -23.68 10.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.684 -0.858 . . . . 10.0 108.684 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . 0.558 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 42.1 mt-10 -91.93 -61.0 1.72 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.927 -1.033 . . . . 10.0 110.494 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 97.4 mmm -62.66 -30.83 71.67 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.952 -0.567 . . . . 10.0 112.459 -178.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.5 p -60.17 -46.04 91.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.127 0.489 . . . . 10.0 109.725 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . 0.445 ' O ' ' HB2' ' C' ' 447' ' ' GLU . 88.2 mttt -78.83 -40.79 31.78 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.432 -0.804 . . . . 10.0 109.653 179.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . 0.493 ' CG ' ' HD3' ' A' ' 330' ' ' ARG . 1.0 OUTLIER -58.15 -52.91 63.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.739 -179.398 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 62.2 mt -58.85 -44.16 90.92 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -68.15 -38.17 81.83 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.7 -0.481 . . . . 10.0 109.7 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . 0.53 ' HB3' ' NH2' ' A' ' 330' ' ' ARG . 2.4 mm-40 -61.99 -38.68 89.53 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 178.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 32.2 t -66.4 -51.2 60.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-N 115.24 -0.891 . . . . 10.0 109.354 178.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -58.09 -48.53 79.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.767 0.318 . . . . 10.0 111.413 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -67.27 -11.78 58.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.184 -0.462 . . . . 10.0 112.031 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . 0.488 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 43.3 mttp -108.19 -33.1 7.24 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.025 0.38 . . . . 10.0 112.025 179.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 18.9 t -66.21 -37.93 80.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 O-C-N 123.158 0.286 . . . . 10.0 110.653 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -57.38 -60.57 9.33 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 121.011 -0.275 . . . . 10.0 110.742 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . 0.4 ' HA ' ' HB3' ' C' ' 457' ' ' ASP . 29.4 Cg_endo -67.06 -24.37 45.13 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 121.679 1.586 . . . . 10.0 111.674 178.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . 0.553 ' O ' ' HB2' ' C' ' 459' ' ' PHE . 46.3 t80 -69.02 -48.08 63.85 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 109.35 -0.611 . . . . 10.0 109.35 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 24.6 mt -69.41 -27.18 65.06 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.755 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . 0.4 ' HB3' ' HA ' ' C' ' 454' ' ' PRO . 6.2 t70 -71.78 -48.89 43.57 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . 0.596 ' HA ' ' HD2' ' C' ' 461' ' ' LYS . 12.2 t70 -65.5 -37.42 86.74 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . 0.553 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 0.3 OUTLIER -67.19 -36.56 82.0 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.371 -0.831 . . . . 10.0 109.348 178.256 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . 0.402 HE21 ' HB3' ' C' ' 460' ' ' GLN . 2.1 mt-30 -64.8 -39.42 93.56 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.031 -0.729 . . . . 10.0 109.031 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . 0.596 ' HD2' ' HA ' ' C' ' 458' ' ' ASP . 40.6 mttp -60.88 -48.39 82.01 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.699 -0.852 . . . . 10.0 108.699 178.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 16.1 mtmm -64.95 -39.24 93.2 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.512 -0.767 . . . . 10.0 110.665 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . 0.452 ' HA ' ' CE3' ' C' ' 463' ' ' TRP . 1.3 m95 -62.8 -41.02 99.11 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.102 -0.703 . . . . 10.0 109.102 178.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -49.89 73.55 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.061 -0.718 . . . . 10.0 109.061 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 0.932 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 42.4 mt-10 -55.96 -44.89 78.9 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.356 179.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -66.11 -52.78 45.46 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.88 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 88.3 mmm -59.63 -48.07 83.13 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.049 0.388 . . . . 10.0 112.049 -179.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -63.96 -46.14 86.0 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.554 -0.536 . . . . 10.0 109.554 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 1.57 HD11 ' CD ' ' A' ' 308' ' ' ARG . 96.4 mt -59.89 -43.23 94.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.623 -0.717 . . . . 20.0 110.659 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 13.0 m-30 -68.49 -36.75 79.38 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.049 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 -63.83 -39.37 94.06 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.329 -0.619 . . . . 10.0 109.329 178.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -81.47 10.44 5.8 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.629 -0.714 . . . . 10.0 111.244 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . 0.542 ' HG2' HD13 ' A' ' 301' ' ' LEU . 76.8 mttt -124.58 -54.2 1.66 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.281 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . 0.437 ' O ' ' HB2' ' C' ' 478' ' ' ARG . 79.2 t -58.15 -43.24 85.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.524 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . 0.46 ' HB2' ' CD ' ' C' ' 476' ' ' PRO . 83.1 mt-10 -60.7 -62.18 6.47 Favored Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 120.966 -0.294 . . . . 10.0 111.75 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . 0.46 ' CD ' ' HB2' ' C' ' 475' ' ' GLU . 18.2 Cg_endo -60.11 -40.1 63.61 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 121.985 1.79 . . . . 10.0 112.057 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' C' ' 477' ' ' LEU . 26.0 mt -65.31 -43.91 89.53 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.45 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . 0.437 ' HB2' ' O ' ' C' ' 474' ' ' VAL . 38.6 mtt180 -62.38 -39.84 94.5 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 109.665 -0.495 . . . . 10.0 109.665 179.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -63.92 -48.54 76.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.039 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -66.53 -39.83 88.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.489 179.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 23.1 mt -67.47 -32.03 72.59 Favored 'General case' 0 C--O 1.219 -0.552 0 N-CA-C 109.585 -0.524 . . . . 10.0 109.585 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 0.7 OUTLIER -67.72 -46.95 70.72 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.55 -0.537 . . . . 10.0 109.55 178.711 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -65.32 -40.51 93.81 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -66.64 -35.58 90.08 Favored Glycine 0 N--CA 1.445 -0.714 0 N-CA-C 110.646 -0.982 . . . . 10.0 110.646 178.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . 0.427 ' O ' ' HG ' ' C' ' 489' ' ' LEU . . . -71.77 -36.78 70.47 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 109.071 -0.715 . . . . 10.0 109.071 178.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -66.35 -37.4 85.23 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . 0.411 HE21 ' HB3' ' C' ' 487' ' ' GLN . 11.9 mt-30 -66.06 -42.65 89.17 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 107.91 -1.144 . . . . 10.0 107.91 176.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . 0.471 ' HE2' HD11 ' C' ' 492' ' ' LEU . 76.5 tttt -65.11 -39.43 93.11 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.596 178.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' C' ' 485' ' ' ALA . 58.5 mt -63.38 -46.63 85.59 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.164 -0.68 . . . . 10.0 109.164 178.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -60.92 -41.39 96.09 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 108.968 -0.753 . . . . 10.0 108.968 178.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . 0.694 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 30.8 mt-10 -59.65 -53.2 60.8 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 177.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . 0.471 HD11 ' HE2' ' C' ' 488' ' ' LYS . 84.2 mt -56.27 -43.63 78.97 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.908 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -61.96 -51.47 67.96 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.95 -0.389 . . . . 10.0 109.95 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -70.66 -8.64 53.4 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.949 0.722 . . . . 10.0 112.949 -178.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.979 ' HG2' HD22 ' A' ' 279' ' ' LEU . 13.2 mttm -102.13 -49.97 3.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.96 0.409 . . . . 10.0 110.047 178.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 85.3 mt -71.3 -19.75 62.29 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.972 0.73 . . . . 10.0 112.972 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 68.4 m -71.73 -60.9 2.25 Favored Pre-proline 0 C--N 1.329 -0.29 0 C-N-CA 120.563 -0.455 . . . . 10.0 111.113 178.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -63.38 -37.54 48.85 Favored 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 121.835 1.69 . . . . 10.0 110.851 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 40.8 mt -72.04 -29.73 64.45 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 116.345 -0.389 . . . . 10.0 109.994 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -69.71 -46.82 52.17 Favored Glycine 0 N--CA 1.449 -0.47 0 N-CA-C 110.212 -1.155 . . . . 10.0 110.212 178.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -61.45 -42.2 98.4 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.312 -0.996 . . . . 10.0 108.312 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.64 -44.91 92.47 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 114.955 -1.021 . . . . 10.0 109.882 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . 0.438 ' SD ' ' HD2' ' C' ' 506' ' ' ARG . 47.4 mmm -61.79 -34.31 75.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.706 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -68.97 -38.33 79.32 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.693 -0.484 . . . . 10.0 109.693 178.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.0 -30.14 61.07 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.932 -0.766 . . . . 10.0 108.932 178.027 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.438 ' HD2' ' SD ' ' C' ' 503' ' ' MET . 38.8 mtt180 -64.64 -46.02 84.35 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 107.056 -1.461 . . . . 10.0 107.056 176.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -62.18 -39.07 91.46 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 114.812 -1.085 . . . . 10.0 108.989 178.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' C' ' 512' ' ' ASP . 43.0 mtt180 -61.78 -54.16 46.18 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.849 -0.797 . . . . 10.0 108.849 178.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . 0.403 ' HB1' ' CD ' ' A' ' 264' ' ' LYS . . . -61.81 -22.42 65.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.349 -0.841 . . . . 10.0 112.766 -179.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -95.24 -52.12 4.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.58 0.229 . . . . 10.0 111.389 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 96.6 t -67.18 -44.26 87.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.46 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.521 ' HB2' ' O ' ' C' ' 508' ' ' ARG . 7.3 m-20 -64.87 -33.59 76.37 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.18 -47.29 77.47 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 107.136 -1.431 . . . . 10.0 107.136 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . 0.523 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 75.8 mt -61.15 -36.62 80.29 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.177 178.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -62.12 -23.35 66.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.963 0.411 . . . . 10.0 109.965 178.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 1.6 m -113.24 8.31 18.1 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.454 0.645 . . . . 10.0 110.236 179.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . 0.532 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 44.3 m170 -118.15 -47.2 2.58 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.207 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 76.2 mt -82.45 -29.43 30.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.886 -0.597 . . . . 10.0 111.247 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -60.1 -57.86 23.61 Favored Pre-proline 0 C--N 1.331 -0.216 0 C-N-CA 121.094 -0.243 . . . . 10.0 111.009 179.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -66.83 -27.7 43.69 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 121.242 1.294 . . . . 10.0 110.367 178.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . 0.532 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 34.7 t80 -65.51 -45.25 84.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.226 179.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 4.4 p -70.25 -34.54 72.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.859 0.361 . . . . 10.0 110.06 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . 0.421 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 0.4 OUTLIER -67.33 -45.53 76.14 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 178.752 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -61.41 -45.54 93.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.442 -0.947 . . . . 10.0 108.442 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 16.2 mt -61.58 -32.81 72.93 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.506 -0.77 . . . . 10.0 110.726 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . 0.421 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 37.7 mtt180 -64.1 -43.06 96.52 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 110.135 -0.32 . . . . 10.0 110.135 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -67.74 -44.35 77.75 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.994 -0.743 . . . . 10.0 108.994 178.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . 0.645 ' HB3' ' NH2' ' C' ' 532' ' ' ARG . 77.9 mtt180 -61.61 -43.17 99.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.924 -1.034 . . . . 10.0 110.739 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 57.2 mt -69.03 -35.48 76.67 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 116.176 -0.466 . . . . 10.0 110.203 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . 0.466 ' O ' ' HG3' ' C' ' 534' ' ' GLU . . . -63.13 -47.88 80.88 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.591 -0.522 . . . . 10.0 109.591 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -61.92 -40.23 94.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.717 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . 0.645 ' NH2' ' HB3' ' C' ' 528' ' ' ARG . 1.3 mtm180 -66.73 -40.49 88.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.497 -0.774 . . . . 10.0 110.168 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 17.2 mt -62.46 -40.8 97.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.129 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' C' ' 530' ' ' ALA . 40.1 mt-10 -63.77 -39.44 94.26 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.845 -0.428 . . . . 10.0 109.845 178.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -66.13 -40.61 90.78 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 97.3 mt -68.67 -33.43 73.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.262 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -77.06 -37.01 55.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.431 -0.349 . . . . 10.0 111.205 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -64.16 -53.35 50.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.114 0.483 . . . . 10.0 109.706 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -72.75 -32.75 65.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.474 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.43 -45.33 86.49 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.863 -0.684 . . . . 10.0 111.426 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -63.31 -35.64 92.33 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 110.72 -0.952 . . . . 10.0 110.72 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -70.49 -46.02 64.52 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.754 -0.832 . . . . 10.0 108.754 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 48.2 mtt85 -59.81 -36.66 77.21 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.73 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 74.1 mt -60.77 -41.82 96.24 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.605 -0.517 . . . . 10.0 109.605 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.98 -46.49 71.19 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . 0.646 ' O ' ' HD2' ' C' ' 550' ' ' LYS . 0.2 OUTLIER -58.22 -47.82 82.3 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.503 -0.771 . . . . 10.0 110.151 178.56 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -61.45 -40.91 96.22 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 116.345 -0.388 . . . . 10.0 110.494 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -63.32 -39.48 94.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.909 0.385 . . . . 10.0 110.177 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . 0.514 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -66.99 -46.47 74.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.374 178.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . 0.646 ' HD2' ' O ' ' C' ' 546' ' ' GLU . 0.0 OUTLIER -63.42 -36.71 84.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.144 178.716 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.93 -38.22 90.27 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.588 -0.893 . . . . 10.0 108.588 178.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 91.3 m -65.41 -44.55 87.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.474 -0.785 . . . . 10.0 108.895 178.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . 0.514 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 29.4 mt-10 -63.43 -41.11 98.68 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.332 -0.618 . . . . 10.0 109.332 178.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -63.85 -42.64 97.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.778 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 49.3 mt -65.61 -38.24 88.88 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 18.1 m -67.57 -38.45 84.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.388 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 2.9 p -78.29 -9.56 59.29 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.153 0.502 . . . . 10.0 110.162 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 19.4 mt -90.77 -25.33 20.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.785 -0.643 . . . . 10.0 109.434 178.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.9 m -60.89 -37.89 83.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.047 -0.524 . . . . 10.0 109.948 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . 0.42 ' O ' ' HG2' ' C' ' 564' ' ' PRO . 0.5 OUTLIER -74.79 0.52 15.13 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.583 179.638 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . 0.491 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 12.5 mptt -117.2 -45.83 2.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.015 0.436 . . . . 10.0 110.521 179.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -75.47 -8.76 57.56 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.101 -0.5 . . . . 10.0 112.151 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . 0.561 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 61.4 mttm -113.62 -75.73 0.01 OUTLIER Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 113.043 0.757 . . . . 10.0 113.043 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 30.4 Cg_endo -65.86 -45.16 6.64 Favored 'Trans proline' 0 C--N 1.357 0.989 0 C-N-CA 121.404 1.403 . . . . 10.0 112.355 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -64.79 -40.98 96.13 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.487 0.184 . . . . 10.0 111.275 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -40.76 96.78 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.863 -0.421 . . . . 10.0 109.863 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . 0.584 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 31.7 mm-40 -67.84 -35.52 78.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.998 178.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -66.46 -43.94 84.12 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.749 -0.834 . . . . 10.0 108.749 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.44 -42.97 97.22 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.647 178.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . 0.414 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 65.0 mtt180 -63.88 -42.52 97.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.052 178.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . 0.584 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.5 mt-30 -64.93 -21.96 66.91 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.571 -0.741 . . . . 20.0 111.794 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -89.39 -42.15 5.59 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 109.556 -1.418 . . . . 10.0 109.556 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 54.1 mt -59.25 -41.17 88.15 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.068 0.396 . . . . 10.0 112.068 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . 0.433 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 87.9 mt -51.61 -64.38 1.47 Allowed Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 112.716 0.635 . . . . 10.0 112.716 -179.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . 0.433 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 36.2 Cg_endo -65.46 -32.15 50.11 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.773 1.649 . . . . 10.0 111.964 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 12.1 t -64.41 -48.02 86.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.649 -0.25 . . . . 10.0 110.527 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 49.1 mt -62.24 -37.45 85.48 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.461 -0.57 . . . . 10.0 109.461 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . 0.447 ' O ' HG23 ' C' ' 582' ' ' VAL . 2.9 mm-40 -62.75 -49.1 76.34 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.758 -0.656 . . . . 10.0 109.919 178.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 37.3 m -64.34 -37.39 87.33 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.396 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -66.52 -40.16 89.02 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.223 -0.658 . . . . 10.0 109.223 178.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 78.1 mttt -61.11 -43.88 98.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.157 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . 0.447 HG23 ' O ' ' C' ' 578' ' ' GLU . 97.4 t -59.86 -45.1 95.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 121.197 0.522 . . . . 10.0 109.926 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 9.5 m -68.25 -35.61 78.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.417 -0.81 . . . . 10.0 111.109 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . 0.464 ' O ' ' HG ' ' C' ' 588' ' ' LEU . 4.6 m-85 -72.24 -47.0 53.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.234 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 52.0 mt -58.94 -45.38 90.55 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.828 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . 0.562 ' O ' ' HG3' ' C' ' 590' ' ' GLU . 9.4 p -63.24 -46.73 85.57 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.568 -0.53 . . . . 10.0 109.568 178.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -56.18 -45.74 79.64 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.89 179.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' C' ' 584' ' ' PHE . 97.2 mt -55.67 -54.14 47.91 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.277 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -62.34 -46.83 86.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 10.0 111.7 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . 0.562 ' HG3' ' O ' ' C' ' 586' ' ' SER . 45.7 mt-10 -59.0 -47.95 83.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.463 -179.353 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -66.32 -43.13 87.03 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.296 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 35.9 m -61.47 -35.91 78.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.743 0.306 . . . . 10.0 111.014 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . 0.506 ' HE3' ' HA ' ' C' ' 590' ' ' GLU . 42.8 mtmt -64.99 -34.62 78.87 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.952 0.352 . . . . 10.0 111.952 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . 0.414 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 89.0 mttt -92.95 -14.17 27.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.966 0.412 . . . . 10.0 111.776 -179.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 94.0 mt -106.91 34.93 3.2 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.295 0.569 . . . . 10.0 110.16 179.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 60.8 t30 . . . . . 0 C--O 1.246 0.886 0 CA-C-O 118.49 -0.767 . . . . 10.0 110.502 -179.649 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 2.9 m . . . . . 0 N--CA 1.451 -0.404 0 CA-C-O 120.758 0.313 . . . . 10.0 110.421 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . 0.402 ' HA ' ' O ' ' B' ' 52' ' ' LEU . 28.7 tt0 -108.18 132.9 53.15 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.748 -179.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -117.29 142.89 46.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.658 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.417 ' HD3' ' HB3' ' B' ' 54' ' ' ASP . 50.8 mmtt -101.92 113.43 26.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.518 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.565 HD22 HD23 ' B' ' 159' ' ' LEU . 33.4 mt -112.13 125.97 54.69 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.522 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 59.2 t -110.13 122.81 65.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 120.941 -0.303 . . . . 10.0 110.504 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.594 HG12 ' HD2' ' B' ' 16' ' ' LYS . 59.5 t -102.18 108.86 24.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.357 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 9.6 m -109.57 153.53 11.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.543 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 168.76 168.72 31.23 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 111.227 -0.749 . . . . 10.0 111.227 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.418 ' O ' HG22 ' B' ' 14' ' ' VAL . . . -74.2 155.92 37.83 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.253 0.549 . . . . 10.0 111.545 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -66.13 119.3 12.81 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.672 -0.694 . . . . 10.0 111.788 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 124.43 -20.4 6.98 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.706 -0.759 . . . . 10.0 112.605 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . 0.418 HG22 ' O ' ' B' ' 11' ' ' ALA . 35.6 m -65.28 -24.64 35.47 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -179.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.34 45.83 3.96 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.569 -0.824 . . . . 10.0 113.568 178.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . 0.594 ' HD2' HG12 ' B' ' 8' ' ' VAL . 4.3 mtmp? -65.12 -44.0 90.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.668 0.27 . . . . 10.0 110.79 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.84 -46.91 84.07 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.084 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.83 -47.75 83.75 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.779 -0.646 . . . . 10.0 111.346 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 25.1 mt -57.68 -46.73 83.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.432 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . 0.487 ' O ' HG12 ' B' ' 24' ' ' ILE . 1.4 m -68.64 -47.75 65.8 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.083 -0.508 . . . . 10.0 112.198 -179.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 88.6 mt -62.24 -31.77 52.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-O 120.806 0.336 . . . . 10.0 111.077 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.483 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 9.2 tp-100 -66.3 -28.11 68.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.112 0.482 . . . . 10.0 110.581 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 29.4 tp -86.64 -33.86 19.98 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.934 0.397 . . . . 10.0 110.658 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . 0.487 HG12 ' O ' ' B' ' 20' ' ' THR . 46.3 mm -73.0 -78.36 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 112.421 0.526 . . . . 10.0 112.421 -179.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -98.42 -1.05 42.36 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.058 0.392 . . . . 10.0 112.058 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.483 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 4.0 t30 60.55 55.29 3.45 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.214 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -135.72 123.72 22.8 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.761 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -80.88 133.95 35.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.301 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 23.7 m -85.94 166.98 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.54 -0.3 . . . . 10.0 110.482 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -133.58 -17.19 2.28 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.364 0.602 . . . . 10.0 110.898 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 17.0 pm0 -97.68 165.52 11.93 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.464 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -83.23 96.77 8.56 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 178.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -69.54 112.86 13.41 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.78 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -78.88 54.41 5.12 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.894 2.396 . . . . 10.0 111.919 -179.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -56.75 133.38 54.09 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.057 -0.974 . . . . 10.0 112.098 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.839 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 79.6 mt -126.34 -53.98 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 178.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.411 ' HB3' HG23 ' D' ' 821' ' ' VAL . 1.7 tm-20 -154.61 95.01 1.74 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.126 -0.943 . . . . 10.0 108.745 178.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -140.21 124.22 17.54 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.693 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.92 150.05 23.91 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.723 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . 0.409 ' HB3' HG13 ' B' ' 24' ' ' ILE . 97.9 m-85 -131.42 121.74 25.1 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . 0.759 HH11 HD21 ' B' ' 52' ' ' LEU . 28.8 ttp85 -118.14 126.5 52.34 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.727 0.298 . . . . 10.0 111.585 -178.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 52.7 tttt -140.92 161.95 36.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.5 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -120.77 127.09 51.64 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 110.11 -0.33 . . . . 10.0 110.11 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 7.3 m -138.83 169.22 18.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.966 0.412 . . . . 10.0 111.021 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 42.2 t -102.66 111.22 31.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 179.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . 0.407 HD11 HD11 ' B' ' 53' ' ' LEU . 32.7 mt -111.14 110.73 33.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.919 -178.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 61.65 38.96 14.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.698 -0.683 . . . . 10.0 111.941 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.6 -15.07 56.5 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.832 -0.622 . . . . 10.0 113.816 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -104.36 130.45 52.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 117.118 0.459 . . . . 10.0 111.331 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 1.2 t -75.53 127.68 33.63 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 73.8 m -137.0 139.71 41.62 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-O 121.14 0.495 . . . . 10.0 111.726 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.759 HD21 HH11 ' B' ' 41' ' ' ARG . 46.0 tp -95.27 121.04 36.51 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 107.609 -1.256 . . . . 10.0 107.609 178.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.407 HD11 HD11 ' B' ' 46' ' ' ILE . 88.0 mt -108.31 119.83 40.62 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 112.331 0.493 . . . . 10.0 112.331 -178.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.417 ' HB3' ' HD3' ' B' ' 5' ' ' LYS . 30.6 t70 -108.49 98.74 8.22 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.117 -1.068 . . . . 10.0 108.117 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 10.1 mt -90.57 127.12 43.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.477 -0.783 . . . . 10.0 111.369 -178.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.4 ' HG ' HG23 ' B' ' 58' ' ' THR . 61.1 tp -102.43 111.74 24.17 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.303 179.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -104.5 103.07 12.7 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.861 -0.608 . . . . 10.0 109.507 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . 0.484 HG21 ' CE1' ' B' ' 71' ' ' TYR . 11.4 p -105.36 171.58 7.25 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.04 -0.527 . . . . 10.0 112.383 -178.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . 0.839 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -61.96 145.75 52.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 10.0 112.06 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -108.74 25.54 18.83 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.62 -0.718 . . . . 10.0 111.4 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -136.0 34.88 2.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.055 0.455 . . . . 20.0 111.756 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.414 ' OE1' ' HD2' ' B' ' 68' ' ' ARG . 21.0 mt-10 -96.99 143.39 27.89 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.289 179.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -84.78 -74.18 0.4 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.387 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -158.38 87.32 0.9 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.167 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -105.55 141.19 37.45 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.866 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.34 -35.36 79.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.031 0.443 . . . . 10.0 110.28 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 50.3 ttp -62.76 -39.44 94.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.846 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.599 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 46.5 ttt85 -65.89 -46.6 77.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.132 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.533 ' O ' ' HG3' ' B' ' 73' ' ' ARG . 13.6 t70 -55.59 -44.46 76.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.717 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -64.34 -48.65 74.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.781 -0.645 . . . . 10.0 112.377 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . 0.599 ' CE2' ' HA ' ' B' ' 68' ' ' ARG 0.256 0.5 OUTLIER -70.78 -19.6 62.69 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.527 0.936 . . . . 10.0 113.527 -178.795 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . 0.417 ' HB3' HG21 ' B' ' 103' ' ' VAL . 40.7 mmm -74.45 -24.24 59.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.181 0.515 . . . . 10.0 110.081 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . 0.533 ' HG3' ' O ' ' B' ' 69' ' ' ASP . 89.8 mtt180 -73.47 -30.75 63.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.5 -179.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.3 -5.2 43.45 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.979 0.733 . . . . 10.0 112.979 -179.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -87.87 130.78 10.26 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.383 -0.913 . . . . 10.0 111.799 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -80.94 -65.02 1.07 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.743 0.306 . . . . 10.0 110.275 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -103.18 147.75 16.96 Favored Glycine 0 N--CA 1.446 -0.7 0 N-CA-C 111.046 -0.822 . . . . 10.0 111.046 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -123.79 136.22 54.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.268 0.556 . . . . 10.0 111.909 -179.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.806 ' HG ' HD22 ' B' ' 159' ' ' LEU . 79.8 mt -107.61 120.45 42.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.316 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 18.2 m -92.69 88.7 6.37 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 27.3 t -88.1 116.03 29.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.987 -0.551 . . . . 10.0 112.048 -178.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.679 ' HB3' HD11 ' B' ' 93' ' ' ILE . 15.6 p90 -129.11 159.68 35.22 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.558 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -96.97 132.37 42.83 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 110.129 -0.323 . . . . 10.0 110.129 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . 0.549 ' CD1' ' HA ' ' B' ' 118' ' ' CYS . 2.5 pt -68.3 -10.94 13.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.91 0.386 . . . . 10.0 111.442 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . 0.409 ' HB3' ' HB2' ' B' ' 122' ' ' SER . 0.0 OUTLIER -104.25 5.47 34.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.434 179.946 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -124.3 104.44 8.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.172 0.511 . . . . 10.0 110.306 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.46 -34.57 78.06 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.579 -0.737 . . . . 10.0 111.875 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -60.55 -41.54 94.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.863 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . 0.422 ' O ' HG12 ' B' ' 93' ' ' ILE . 11.2 m -63.42 -37.95 89.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.43 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . 0.498 ' HE1' ' HA ' ' B' ' 130' ' ' ALA . 65.5 t80 -64.98 -35.43 81.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.022 0.439 . . . . 10.0 110.766 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -80.37 -32.72 37.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.063 0.459 . . . . 10.0 110.574 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -73.91 -7.47 52.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.772 -0.649 . . . . 10.0 112.034 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . 0.679 HD11 ' HB3' ' B' ' 82' ' ' PHE . 23.8 mm -58.91 -37.9 69.9 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 CA-C-O 121.148 0.499 . . . . 10.0 109.985 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 16.0 t-80 -64.0 -33.46 75.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.196 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -62.77 -42.65 99.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.802 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . 0.416 ' CD2' ' HA ' ' B' ' 93' ' ' ILE . 19.0 m-85 -64.38 -44.79 90.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.084 -0.507 . . . . 10.0 109.695 179.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . 0.481 ' HD2' ' SD ' ' B' ' 111' ' ' MET . 10.8 tpt180 -56.67 -48.41 77.68 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.309 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -66.39 -41.55 89.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.447 -0.342 . . . . 10.0 111.614 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -60.67 -45.86 92.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.942 0.401 . . . . 10.0 110.691 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . 0.465 ' HA ' HG22 ' B' ' 103' ' ' VAL . 54.3 mt -65.79 -40.89 88.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.802 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . 0.641 ' HG2' ' HA ' ' B' ' 107' ' ' GLU . 39.3 mtpt -58.15 -37.18 74.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.004 -0.543 . . . . 10.0 111.259 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 59.8 ttp85 -76.98 -47.65 20.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.018 -0.537 . . . . 10.0 112.407 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.465 HG22 ' HA ' ' B' ' 100' ' ' ILE . 32.7 m -66.85 -30.1 48.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 N-CA-C 112.654 0.612 . . . . 10.0 112.654 -178.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.427 ' HA ' ' HD2' ' B' ' 104' ' ' LYS . 10.7 mmmm -91.72 -12.51 33.78 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 121.112 -0.235 . . . . 10.0 111.382 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 28.0 t0 60.0 34.8 21.5 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.696 0.76 . . . . 10.0 110.971 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 42.9 m -156.43 147.16 21.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.736 -0.665 . . . . 10.0 109.858 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . 0.641 ' HA ' ' HG2' ' B' ' 101' ' ' LYS . 20.7 mp0 -93.88 -26.67 16.8 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.972 0.415 . . . . 10.0 110.503 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -94.0 77.18 4.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.69 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 57.8 t -120.06 133.38 23.93 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.749 -0.659 . . . . 10.0 110.081 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . 0.488 ' HB3' ' HB3' ' B' ' 162' ' ' GLU . 32.4 Cg_exo -59.55 114.97 2.28 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.843 2.362 . . . . 10.0 112.324 179.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . 0.481 ' SD ' ' HD2' ' B' ' 97' ' ' ARG . 41.1 mtt -136.71 156.5 48.45 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.386 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . 0.531 ' HB ' HD23 ' B' ' 79' ' ' LEU . 87.0 t -135.38 132.38 52.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 110.049 -0.352 . . . . 10.0 110.049 179.134 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 19.9 tp -84.53 121.89 28.23 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.381 -0.6 . . . . 10.0 109.381 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 47.7 t -117.11 115.13 47.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.031 0.443 . . . . 10.0 111.769 -178.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.69 97.25 1.76 Allowed Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 110.49 -1.044 . . . . 10.0 110.49 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -87.28 161.41 18.0 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.853 0.359 . . . . 10.0 111.925 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 91.4 mttt 69.54 35.18 2.56 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.336 -0.847 . . . . 10.0 112.148 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . 0.549 ' HA ' ' CD1' ' B' ' 84' ' ' ILE . 29.1 p -74.33 -12.97 60.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.479 -0.328 . . . . 10.0 111.797 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -81.39 -20.64 40.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.398 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 73.7 mt -67.92 142.42 95.44 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.013 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -61.66 -32.36 86.92 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.914 2.409 . . . . 10.0 111.947 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . 0.409 ' HB2' ' HB3' ' B' ' 85' ' ' ASN . 0.1 OUTLIER -73.87 118.7 17.14 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.33 179.596 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 18.0 ttt180 -141.93 115.47 9.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.806 0.336 . . . . 10.0 111.094 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.56 -24.78 11.64 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.571 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 38.5 t -104.34 114.29 43.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.56 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . 0.526 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 13.8 t70 -75.61 152.42 37.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.676 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.2 m -56.75 -42.29 79.04 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.838 -0.619 . . . . 10.0 112.094 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -64.91 -44.7 88.68 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 121.256 -0.178 . . . . 10.0 111.294 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . 0.526 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 38.0 mt-30 -58.16 -45.97 86.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.851 0.357 . . . . 10.0 110.805 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . 0.498 ' HA ' ' HE1' ' B' ' 90' ' ' PHE . . . -67.6 -44.94 76.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.307 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -62.7 -39.79 95.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.847 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -61.7 -41.29 97.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.342 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 37.8 tp -64.78 -44.19 90.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.009 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.22 -43.98 97.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.184 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -60.35 -36.5 78.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.803 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 20.6 m -66.65 -30.42 70.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.688 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -85.82 -18.18 33.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.582 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.64 28.94 28.12 Favored Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 111.259 -0.736 . . . . 10.0 111.259 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . 0.415 ' HB ' ' HD2' ' B' ' 140' ' ' PRO . 50.4 pt -128.19 159.07 69.04 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.723 -0.238 . . . . 10.0 110.444 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . 0.415 ' HD2' ' HB ' ' B' ' 139' ' ' ILE . 90.2 Cg_endo -82.83 158.36 15.98 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 122.569 2.179 . . . . 10.0 112.42 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -119.07 124.38 46.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.398 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 23.0 mm -119.13 121.42 66.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.947 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . 0.404 ' HG2' ' CB ' ' B' ' 118' ' ' CYS . 6.7 tt0 -85.24 123.6 30.92 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.676 -1.231 . . . . 10.0 107.676 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 70.1 p -130.09 170.45 14.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.783 0.801 . . . . 10.0 113.073 -176.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 8.7 t -155.44 108.16 2.71 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.672 -1.149 . . . . 10.0 108.495 178.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -66.15 -24.94 66.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.739 0.304 . . . . 10.0 111.611 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 23.1 ttpp -74.85 -35.28 62.38 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.123 0.416 . . . . 10.0 112.123 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 69.6 p -100.68 -7.46 23.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.942 0.401 . . . . 10.0 111.156 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . 0.421 HH12 ' CG ' ' B' ' 153' ' ' ASP . 1.8 ttt-85 67.07 23.3 9.71 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 115.588 -0.733 . . . . 10.0 111.781 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -90.08 127.42 36.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.395 -0.366 . . . . 10.0 111.541 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 75.11 -4.85 37.02 Favored Glycine 0 CA--C 1.52 0.362 0 N-CA-C 114.635 0.614 . . . . 10.0 114.635 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 65.6 t -55.61 -60.91 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 117.1 0.45 . . . . 10.0 111.88 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . 0.421 ' CG ' HH12 ' B' ' 149' ' ' ARG . 0.1 OUTLIER -66.88 -34.01 76.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.974 0.416 . . . . 10.0 110.597 -179.51 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -59.76 -43.35 94.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.696 -0.684 . . . . 10.0 111.383 -179.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -59.64 -45.4 92.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.671 179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . 0.4 ' O ' HG23 ' B' ' 160' ' ' VAL . 55.8 m-85 -64.52 -43.99 92.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.806 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -59.88 -40.66 89.46 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.915 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 18.4 m -62.99 -43.07 99.81 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.789 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.806 HD22 ' HG ' ' B' ' 79' ' ' LEU . 39.6 tp -60.66 -44.11 96.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.42 . . . . 10.0 111.128 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . 0.4 HG23 ' O ' ' B' ' 156' ' ' PHE . 58.1 t -61.9 -38.53 80.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.181 0.515 . . . . 10.0 110.332 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -67.09 -33.66 75.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.177 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . 0.488 ' HB3' ' HB3' ' B' ' 110' ' ' PRO . 42.2 mm-40 -68.07 -40.61 82.68 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 109.763 -0.458 . . . . 10.0 109.763 178.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 81.2 mt -62.62 -45.5 98.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.341 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 76.0 mtt180 -61.03 -46.75 89.47 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.671 -0.695 . . . . 10.0 109.709 178.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -54.4 -47.53 72.62 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.674 -0.693 . . . . 10.0 111.42 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -64.65 -45.84 85.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.205 0.446 . . . . 10.0 112.205 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -66.96 -40.31 87.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.264 -0.425 . . . . 10.0 112.098 -179.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -65.6 -43.66 88.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.957 0.408 . . . . 10.0 110.351 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.7 tttm -60.23 -44.58 95.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.024 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 77.0 mtp -66.17 -31.92 73.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.416 -0.356 . . . . 10.0 111.783 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 22.0 m . . . . . 0 C--N 1.326 -0.42 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.679 -179.545 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 111.779 -0.528 . . . . 10.0 111.779 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 9.3 p -123.79 133.68 53.78 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.598 -0.301 . . . . 10.0 110.561 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 8.8 t -123.45 135.44 63.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.282 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 811' ' ' LYS . . . . . 0.818 ' HB3' HG22 ' D' ' 821' ' ' VAL . 13.9 pttp -99.99 116.5 32.17 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.073 0.463 . . . . 10.0 111.112 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 812' ' ' VAL . . . . . 0.767 HG11 HD11 ' D' ' 834' ' ' LEU . 32.2 t -96.11 133.36 37.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.571 -179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.06 134.22 35.33 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.795 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 47.1 mt -99.71 150.28 36.67 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.132 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -67.75 0.64 4.02 Favored 'Trans proline' 0 CA--C 1.534 0.485 0 C-N-CA 122.999 2.466 . . . . 10.0 113.069 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -98.03 17.18 18.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.017 0.437 . . . . 10.0 110.076 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 28.1 tttp 66.89 48.35 1.32 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 115.369 -0.832 . . . . 10.0 110.565 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -150.05 -179.32 7.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.497 -0.774 . . . . 10.0 109.508 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.7 160.76 41.81 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.463 -0.199 . . . . 10.0 110.463 178.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 6.6 t -142.61 132.89 24.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.387 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 821' ' ' VAL . . . . . 0.818 HG22 ' HB3' ' D' ' 811' ' ' LYS . 57.1 t -91.82 117.68 35.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.076 0.465 . . . . 10.0 111.593 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 27.4 m -115.06 164.16 11.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.072 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.26 135.5 34.42 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.78 0.324 . . . . 10.0 110.948 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 824' ' ' VAL . . . . . 0.613 HG11 ' HB2' ' D' ' 871' ' ' ASP . 21.3 t -83.04 125.36 40.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 7.6 mtp180 -121.9 151.45 40.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.867 0.365 . . . . 10.0 110.823 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -91.7 37.38 0.96 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.497 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . -143.78 -66.79 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.449 -0.882 . . . . 10.0 113.047 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 828' ' ' MET . . . . . 0.415 ' HB2' ' HB2' ' D' ' 832' ' ' ASP . 11.5 ptm -58.44 155.62 11.7 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 113.072 0.767 . . . . 10.0 113.072 -179.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 829' ' ' SER . . . . . 0.857 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.3 OUTLIER -97.06 178.21 5.34 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.59 -0.732 . . . . 10.0 111.136 -179.222 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 79.3 t -60.12 -43.36 92.75 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 109.765 -0.457 . . . . 10.0 109.765 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 831' ' ' TYR . . . . . 0.642 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 34.1 t80 -55.36 -45.2 76.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.278 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 832' ' ' ASP . . . . . 0.415 ' HB2' ' HB2' ' D' ' 828' ' ' MET . 13.1 m-20 -69.16 -48.13 63.11 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.976 -0.557 . . . . 10.0 111.601 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 4.3 m -63.78 -40.32 96.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.88 -179.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 834' ' ' LEU . . . . . 0.767 HD11 HG11 ' D' ' 812' ' ' VAL . 3.2 mm? -82.89 -9.52 59.27 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 111.902 0.334 . . . . 10.0 111.902 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -62.61 -51.89 65.52 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 120.622 0.249 . . . . 10.0 110.552 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 13.3 mmmt -60.45 -29.99 69.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.947 -0.569 . . . . 10.0 111.22 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 837' ' ' ALA . . . . . 0.515 ' O ' HG12 ' D' ' 840' ' ' VAL . . . -75.66 -42.62 50.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.167 -0.469 . . . . 10.0 111.085 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 838' ' ' LEU . . . . . 0.742 HD12 ' HG3' ' D' ' 845' ' ' GLN . 30.8 mt -76.14 -41.08 51.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.724 0.297 . . . . 10.0 111.74 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -63.36 -26.27 68.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.431 -0.35 . . . . 10.0 111.259 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 840' ' ' VAL . . . . . 0.515 HG12 ' O ' ' D' ' 837' ' ' ALA . 0.9 OUTLIER -80.52 -17.66 12.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.114 0.483 . . . . 10.0 111.147 -179.545 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' D' D ' 841' ' ' ARG . . . . . 0.426 ' HD3' ' HA ' ' D' ' 841' ' ' ARG . 4.8 mmt180 -106.54 -0.62 23.77 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.37 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 77.5 32.89 45.23 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.762 -0.733 . . . . 10.0 112.105 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 62.5 mt -115.17 161.11 18.87 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.711 0.291 . . . . 10.0 110.745 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -122.38 152.0 40.63 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.112 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 845' ' ' GLN . . . . . 0.742 ' HG3' HD12 ' D' ' 838' ' ' LEU . 19.0 mp0 -78.42 21.5 0.37 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.906 0.706 . . . . 10.0 112.906 -178.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 37.4 p-10 -95.4 -40.68 9.38 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.422 0.527 . . . . 10.0 112.422 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 62.1 m -109.04 6.66 25.25 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.901 0.334 . . . . 10.0 111.901 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 36.2 m -106.61 144.75 32.82 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.91 0.386 . . . . 10.0 111.006 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 7.3 p -132.82 137.99 52.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.922 -0.581 . . . . 10.0 109.733 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 850' ' ' VAL . . . . . 0.407 ' O ' HG22 ' D' ' 861' ' ' THR . 18.1 t -99.83 139.49 21.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 120.768 0.318 . . . . 10.0 110.636 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 851' ' ' TYR . . . . . 0.857 ' HB3' ' HB3' ' D' ' 858' ' ' LYS . 65.7 m-85 -119.23 132.62 55.95 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.987 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 852' ' ' ARG . . . . . 0.594 ' HD3' HD11 ' D' ' 870' ' ' LEU . 8.4 mtm180 -79.21 171.37 15.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.351 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 853' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' D' ' 874' ' ' GLU . 0.2 OUTLIER -116.73 96.23 5.39 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.439 179.775 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 33.6 mt -133.36 115.76 23.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.537 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 3.4 mmpt? 63.78 42.38 6.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.663 -0.699 . . . . 10.0 111.681 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 76.66 -31.32 1.46 Allowed Glycine 0 N--CA 1.452 -0.239 0 CA-C-N 115.796 -0.638 . . . . 10.0 113.742 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 857' ' ' ARG . . . . . 0.453 HH11 ' HD3' ' D' ' 857' ' ' ARG . 20.5 mtp180 -91.53 158.4 16.48 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.281 0.562 . . . . 10.0 112.0 -179.166 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 858' ' ' LYS . . . . . 0.857 ' HB3' ' HB3' ' D' ' 851' ' ' TYR . 44.0 mtpt -87.68 148.95 24.55 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.455 -0.793 . . . . 10.0 111.223 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 1.3 m -127.99 137.21 52.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.453 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 860' ' ' VAL . . . . . 0.631 HG22 ' HE1' ' D' ' 851' ' ' TYR . 8.6 t -66.07 130.35 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.688 0.28 . . . . 10.0 111.421 -179.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 861' ' ' THR . . . . . 0.407 HG22 ' O ' ' D' ' 850' ' ' VAL . 2.1 t -127.68 160.79 30.58 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.955 -0.387 . . . . 10.0 109.955 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -103.57 159.45 15.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.865 0.364 . . . . 10.0 111.591 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 863' ' ' TRP . . . . . 0.642 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 96.2 m95 -79.0 -30.8 44.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.038 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.61 -29.76 70.97 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.508 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 2.2 m -64.36 145.51 55.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.417 -179.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 866' ' ' ALA . . . . . 0.857 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -73.5 161.83 29.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.118 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 867' ' ' ILE . . . . . 0.549 ' HA ' HD23 ' D' ' 870' ' ' LEU . 6.2 tp -93.98 -1.84 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.088 0.471 . . . . 10.0 111.097 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 868' ' ' ALA . . . . . 0.501 ' HB3' ' HD3' ' D' ' 869' ' ' PRO . . . -54.29 -51.8 74.65 Favored Pre-proline 0 CA--C 1.539 0.546 0 N-CA-C 113.582 0.956 . . . . 10.0 113.582 -179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 869' ' ' PRO . . . . . 0.501 ' HD3' ' HB3' ' D' ' 868' ' ' ALA . 6.0 Cg_exo -79.83 19.34 1.01 Allowed 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 122.466 2.111 . . . . 10.0 113.04 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 870' ' ' LEU . . . . . 0.594 HD11 ' HD3' ' D' ' 852' ' ' ARG . 2.6 mm? -107.64 22.22 16.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.258 0.551 . . . . 10.0 110.741 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 871' ' ' ASP . . . . . 0.613 ' HB2' HG11 ' D' ' 824' ' ' VAL . 10.3 t70 -87.38 108.12 18.84 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.564 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 127.93 -55.25 0.76 Allowed Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.665 -0.779 . . . . 10.0 112.767 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -85.41 172.06 11.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.833 0.349 . . . . 10.0 111.33 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 874' ' ' GLU . . . . . 0.475 ' O ' ' HB2' ' D' ' 853' ' ' LEU . 29.0 mt-10 -118.37 159.2 23.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.253 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 875' ' ' LEU . . . . . 0.419 ' HB2' HG13 ' D' ' 812' ' ' VAL . 24.8 mt -122.9 154.32 38.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.019 0.438 . . . . 10.0 111.875 -178.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 876' ' ' ILE . . . . . 0.641 ' HB ' ' HE3' ' D' ' 858' ' ' LYS . 61.1 mt -126.17 122.29 61.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.222 -0.659 . . . . 10.0 109.222 178.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 40.3 t -93.18 131.99 38.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.762 0.315 . . . . 10.0 111.146 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.89 162.78 20.38 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.717 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 50.6 t -114.84 133.16 61.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 120.91 0.386 . . . . 10.0 110.652 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 99.2 mt . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.343 -0.837 . . . . 10.0 110.075 179.626 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 33.6 mt . . . . . 0 N--CA 1.452 -0.374 0 N-CA-C 109.986 -0.376 . . . . 10.0 109.986 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 21.6 mtm180 -65.79 -43.1 89.73 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.13 -0.692 . . . . 10.0 109.13 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -64.98 -41.1 95.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.608 -0.724 . . . . 10.0 109.172 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -65.73 -45.78 81.38 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.298 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . 0.49 ' O ' ' HB2' ' A' ' 247' ' ' LEU . 48.1 mmm -60.4 -48.25 82.58 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.964 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.9 p -59.53 -37.82 79.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.054 0.454 . . . . 10.0 111.236 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 93.5 mttt -78.61 -59.44 2.78 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.17 179.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -56.23 -50.13 72.18 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.983 0.735 . . . . 10.0 112.983 -178.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 243' ' ' MET . 21.4 mt -56.5 -51.59 67.92 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.582 0.23 . . . . 10.0 111.437 -179.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -67.65 -33.01 74.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.531 -0.304 . . . . 10.0 111.355 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . 0.449 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 0.2 OUTLIER -68.64 -43.5 76.14 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.604 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 48.4 t -67.91 -41.91 85.2 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.409 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.867 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 44.0 mttm -64.28 -42.96 96.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.712 0.291 . . . . 10.0 110.826 179.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -64.43 -40.81 96.47 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.109 -0.496 . . . . 10.0 109.945 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 7.7 mtpt -77.93 -21.81 50.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.811 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.46 ' HA ' ' HB2' ' A' ' 257' ' ' TYR . 0.5 OUTLIER -66.55 -26.26 37.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.413 -0.358 . . . . 10.0 110.057 179.349 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . 0.505 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 19.5 mt-30 -62.45 -61.79 6.94 Favored Pre-proline 0 N--CA 1.451 -0.408 0 CA-C-N 115.922 -0.581 . . . . 10.0 109.599 178.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . 0.505 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 19.7 Cg_endo -62.61 -27.06 76.01 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 121.741 1.627 . . . . 10.0 110.818 177.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . 0.494 ' HE1' ' CG ' ' C' ' 517' ' ' HIS . 3.9 m-30 -62.13 -60.61 3.35 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.838 -0.801 . . . . 10.0 108.838 178.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 86.5 mt -64.3 -35.01 79.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.915 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -64.55 -55.08 22.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.543 -0.299 . . . . 10.0 110.548 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -64.3 -42.05 96.55 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.325 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . 0.481 ' O ' ' HB2' ' A' ' 265' ' ' TRP . 4.7 m-30 -62.04 -38.69 89.68 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.422 -0.354 . . . . 10.0 110.122 178.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -67.81 -43.2 80.19 Favored 'General case' 0 C--O 1.22 -0.471 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -58.99 -49.34 78.26 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.767 ' HE3' ' HB1' ' C' ' 509' ' ' ALA . 14.6 mptt -63.94 -55.28 23.68 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.734 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . 0.481 ' HB2' ' O ' ' A' ' 261' ' ' PHE . 0.0 OUTLIER -58.22 -39.97 80.45 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.049 0.388 . . . . 10.0 112.049 -179.324 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . 0.46 ' O ' ' HG3' ' A' ' 270' ' ' GLU . 43.0 tt0 -63.47 -47.45 81.72 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -64.44 -44.66 90.44 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.724 -0.473 . . . . 10.0 109.724 178.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . 0.506 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 48.3 mt-10 -61.11 -38.05 84.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.653 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 14.9 ttt -70.56 -46.27 63.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.061 179.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 266' ' ' GLN . 40.8 mt-10 -63.84 -45.91 87.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.472 179.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 74.3 mt -63.47 -29.99 71.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.004 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . 0.506 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 0.1 OUTLIER -73.77 -45.98 48.45 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.103 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -61.62 -37.66 84.76 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.343 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -62.92 -20.4 65.15 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.216 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.584 ' O ' ' HB2' ' A' ' 279' ' ' LEU . 51.5 mttp -99.85 -30.86 11.8 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.952 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 272' ' ' TYR . 42.6 t -62.04 -42.56 95.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.879 179.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . 0.417 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 17.5 mt-10 -55.77 -59.25 12.02 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 111.695 0.257 . . . . 10.0 111.695 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . 0.417 ' HD3' ' HB2' ' A' ' 277' ' ' GLU . 29.1 Cg_endo -66.67 -36.97 23.01 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 121.639 1.559 . . . . 10.0 111.397 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.584 ' HB2' ' O ' ' A' ' 275' ' ' LYS . 3.0 mt -60.16 -44.76 94.74 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 120.666 0.269 . . . . 10.0 110.722 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 23.2 ttm180 -58.62 -42.14 87.52 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.174 -0.676 . . . . 10.0 109.174 179.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -69.73 -47.87 61.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.842 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -58.25 -47.29 84.03 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.016 0.436 . . . . 10.0 110.399 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 61.1 mt -66.93 -41.6 86.73 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.933 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -62.78 -56.4 17.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.495 0.188 . . . . 10.0 111.335 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -66.33 -41.57 89.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.892 0.377 . . . . 10.0 110.695 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -62.03 -49.43 75.29 Favored Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 111.621 -0.592 . . . . 10.0 111.621 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -67.17 -35.57 79.94 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 109.93 -0.396 . . . . 10.0 109.93 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 39.2 ttm180 -60.42 -45.14 94.68 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 178.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -63.1 -54.18 41.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.061 178.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 73.3 mttt -58.14 -46.42 85.68 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.476 -0.784 . . . . 10.0 111.551 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 60.7 mt -68.53 -42.4 78.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.576 -0.284 . . . . 10.0 111.622 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -61.19 -46.91 88.54 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.35 -0.241 . . . . 10.0 110.35 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -65.75 -36.31 83.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.762 0.315 . . . . 10.0 111.006 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 36.9 mt -69.86 -41.86 74.3 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 178.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -67.66 -37.46 82.42 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.021 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.3 -30.86 70.83 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.913 -0.585 . . . . 10.0 109.602 178.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . 0.543 ' HE2' ' HB2' ' C' ' 476' ' ' PRO . 18.6 tttp -82.25 -26.24 33.39 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.381 178.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 18.9 mt -67.01 -24.72 66.05 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.719 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . 0.438 ' HB2' ' CD ' ' A' ' 300' ' ' PRO . 31.4 m -65.85 -63.54 3.19 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.837 178.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . 0.438 ' CD ' ' HB2' ' A' ' 299' ' ' SER . 17.7 Cg_endo -61.64 -47.08 12.1 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 121.632 1.555 . . . . 10.0 111.732 178.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.535 HD22 ' HG2' ' C' ' 473' ' ' LYS . 80.2 mt -65.24 -28.62 69.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.726 0.298 . . . . 10.0 111.38 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -81.46 -45.58 7.32 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 110.802 -0.919 . . . . 10.0 110.802 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -62.22 -43.41 98.88 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.852 -0.425 . . . . 10.0 109.852 178.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -66.86 -31.72 72.51 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 109.535 -0.543 . . . . 10.0 109.535 178.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . 0.486 ' HB2' ' O ' ' A' ' 301' ' ' LEU . 12.9 tpt -67.86 -45.45 74.54 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 306' ' ' ARG . 49.5 mtt85 -66.95 -36.21 81.71 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.896 178.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -64.46 -47.52 78.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.24 178.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . 0.892 ' HG3' HD21 ' C' ' 469' ' ' LEU . 13.0 mmt180 -70.76 -33.32 70.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.168 178.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -63.62 -36.78 84.94 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 35.2 ttm105 -60.3 -50.89 71.85 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.17 -1.048 . . . . 10.0 108.17 177.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.16 88.45 Favored 'General case' 0 C--N 1.331 -0.203 0 O-C-N 123.702 0.626 . . . . 10.0 110.222 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . 0.685 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 5.2 m-70 -56.98 -57.61 11.78 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.958 -0.564 . . . . 10.0 109.886 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . 0.418 ' O ' ' HG3' ' A' ' 317' ' ' ARG . 47.8 t -68.56 -39.17 80.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.446 -0.797 . . . . 10.0 112.308 -178.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . 0.432 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 7.3 t0 -62.71 -45.69 91.6 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.579 0.228 . . . . 10.0 111.369 -179.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -65.46 -32.05 73.46 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.984 -0.747 . . . . 10.0 108.984 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 36.1 mt -71.88 -34.3 69.08 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 115.223 -0.899 . . . . 10.0 109.809 178.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . 0.432 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 64.2 mtt180 -62.58 -49.89 73.47 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.636 -0.505 . . . . 10.0 109.636 178.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 2.9 m -66.57 -13.38 60.95 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.482 -0.781 . . . . 10.0 111.23 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -100.99 -43.0 6.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.4 -0.364 . . . . 10.0 110.754 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . 0.489 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 64.2 mt -67.65 -30.87 70.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.444 -0.344 . . . . 10.0 111.398 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . 0.403 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -57.32 -60.86 8.43 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 121.268 -0.173 . . . . 10.0 110.698 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . 0.403 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 27.8 Cg_endo -66.16 -38.02 23.01 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.246 1.297 . . . . 10.0 110.385 177.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . 0.489 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 4.2 m-30 -55.57 -52.68 62.92 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 111.83 0.307 . . . . 10.0 111.83 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 22.0 p -63.96 -43.68 95.08 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 123.088 0.243 . . . . 10.0 111.603 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . 0.466 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 2.6 t70 -65.88 -41.78 91.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.996 0.427 . . . . 10.0 110.819 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . 0.46 ' O ' ' HG3' ' A' ' 330' ' ' ARG . 73.0 mt-10 -70.81 -30.11 66.47 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . 0.668 HD23 ' HD3' ' A' ' 330' ' ' ARG . 13.4 mt -66.34 -35.65 80.89 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 108.231 -1.025 . . . . 10.0 108.231 177.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . 0.466 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 59.8 mtt180 -64.99 -35.56 81.57 Favored 'General case' 0 C--O 1.223 -0.294 0 N-CA-C 108.676 -0.861 . . . . 10.0 108.676 177.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -67.48 -41.55 84.42 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.103 -0.703 . . . . 10.0 109.103 178.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . 0.668 ' HD3' HD23 ' A' ' 327' ' ' LEU . 4.6 mtp-105 -65.31 -45.54 83.93 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 108.984 -0.747 . . . . 10.0 108.984 178.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 44.2 mt -64.34 -38.24 90.32 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.89 179.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . 0.458 ' O ' ' HG2' ' A' ' 336' ' ' GLU . . . -63.55 -45.06 92.23 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.92 -44.76 94.12 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.304 -0.628 . . . . 10.0 109.304 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . 0.495 HH21 ' CG ' ' C' ' 444' ' ' ASP . 81.6 mtt180 -63.72 -43.27 97.04 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.989 178.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 55.4 mt -65.18 -44.99 86.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.668 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 332' ' ' ALA . 34.8 mm-40 -59.21 -42.48 91.05 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.572 -0.529 . . . . 10.0 109.572 178.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 341' ' ' ASN . . . -69.83 -39.8 76.26 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.246 -0.65 . . . . 10.0 109.246 178.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 7.0 tp -62.37 -28.66 69.92 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.402 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -70.43 -44.53 67.68 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.844 -0.428 . . . . 10.0 109.844 178.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -71.52 -49.8 37.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.444 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . 0.41 ' HB2' ' O ' ' A' ' 337' ' ' ALA . 1.2 m-20 -61.3 -46.57 89.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.363 -0.835 . . . . 10.0 109.938 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -64.95 -44.25 94.79 Favored Glycine 0 N--CA 1.449 -0.5 0 N-CA-C 111.687 -0.565 . . . . 10.0 111.687 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.87 -43.59 97.87 Favored Glycine 0 C--N 1.332 0.309 0 N-CA-C 110.756 -0.938 . . . . 10.0 110.756 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -66.08 -45.01 82.8 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.281 -0.637 . . . . 10.0 109.281 178.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . 0.408 ' HE ' ' CD ' ' C' ' 433' ' ' GLU . 59.8 mtt180 -56.48 -48.46 77.1 Favored 'General case' 0 C--O 1.224 -0.257 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 81.9 mt -61.18 -39.73 91.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.979 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -66.63 -48.81 68.25 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.563 -0.532 . . . . 10.0 109.563 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -59.39 -46.83 87.58 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.898 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -62.42 -42.09 99.18 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.092 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 6.4 m80 -62.43 -43.93 97.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.747 0.308 . . . . 10.0 110.377 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.99 -45.16 94.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.932 0.396 . . . . 10.0 109.947 178.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . 0.888 ' HG2' HG13 ' C' ' 422' ' ' VAL . 11.0 mttp -67.75 -35.89 79.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.877 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.64 -35.88 81.23 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 52.2 m -61.34 -50.86 71.23 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.771 -0.825 . . . . 10.0 108.771 178.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -65.75 -28.14 68.82 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.669 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . 0.476 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 2.2 m80 -64.84 -40.2 94.79 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.249 -1.019 . . . . 10.0 108.249 177.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 83.0 mt -72.82 -41.43 64.91 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.413 -0.812 . . . . 10.0 109.573 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 4.9 m -56.01 -53.87 51.69 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.062 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . 0.505 ' HA ' ' OE1' ' A' ' 362' ' ' GLU . 61.3 p -70.9 -19.65 62.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.004 -0.543 . . . . 10.0 110.789 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 356' ' ' HIS . 34.8 tp -68.43 -42.85 78.3 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.393 -0.595 . . . . 10.0 109.393 178.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.44 -30.32 70.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.271 0.558 . . . . 10.0 109.893 178.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . 0.505 ' OE1' ' HA ' ' A' ' 359' ' ' THR . 35.4 mt-10 -78.19 5.8 9.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.441 -0.799 . . . . 10.0 111.311 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.692 ' HD3' HG23 ' C' ' 411' ' ' THR . 27.0 mttp -131.1 -46.38 1.01 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.025 -0.534 . . . . 10.0 109.65 178.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.17 -11.69 61.07 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.964 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.503 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 90.7 mttt -108.79 -72.77 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.43 0 CA-C-O 119.336 -0.364 . . . . 10.0 111.97 178.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.503 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 31.5 Cg_endo -64.16 -51.32 2.2 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 121.553 1.502 . . . . 10.0 112.862 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . 0.512 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -61.98 -42.32 99.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 10.0 111.384 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 368' ' ' LEU . 9.3 mt -67.39 -36.82 82.08 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.99 -0.284 . . . . 10.0 110.874 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . 0.752 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 68.9 mt-10 -66.66 -35.34 79.93 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.905 -0.776 . . . . 10.0 108.905 177.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -63.94 -47.01 82.17 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.636 -0.876 . . . . 10.0 108.636 178.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 1.5 mt -59.76 -44.48 93.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.309 179.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.458 HH11 ' HD2' ' A' ' 372' ' ' ARG . 58.8 mtt180 -66.79 -42.34 86.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.045 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.752 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.6 mt-30 -60.96 -34.79 75.3 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.686 -0.688 . . . . 20.0 111.413 178.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -79.19 -35.32 30.5 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 109.583 -1.407 . . . . 10.0 109.583 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 18.8 mt -57.64 -35.49 70.56 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.667 0.247 . . . . 10.0 111.667 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . 0.566 ' HB2' ' HD3' ' A' ' 377' ' ' PRO . 22.0 mt -56.59 -65.83 1.46 Allowed Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 111.737 0.273 . . . . 10.0 111.737 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . 0.566 ' HD3' ' HB2' ' A' ' 376' ' ' LEU . 30.1 Cg_endo -65.22 -33.95 47.23 Favored 'Trans proline' 0 C--N 1.357 1.012 0 C-N-CA 121.72 1.614 . . . . 10.0 111.828 179.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 19.2 t -62.68 -50.86 78.05 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 N-CA-C 110.429 -0.211 . . . . 10.0 110.429 179.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 56.0 mt -61.84 -35.99 79.87 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . 0.455 ' O ' HG23 ' A' ' 384' ' ' VAL . 45.2 mt-10 -62.99 -52.65 62.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.309 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.8 p -61.54 -36.71 81.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.736 0.303 . . . . 10.0 110.482 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -65.92 -43.52 87.87 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 178.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 79.7 mttt -67.04 -39.14 86.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.697 179.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 380' ' ' GLU . 54.1 t -60.72 -45.74 97.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 109.67 -0.493 . . . . 10.0 109.67 178.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.0 p -69.34 -41.98 75.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.446 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . 0.441 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 5.6 m-30 -63.03 -49.48 74.46 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.597 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 82.8 mt -58.82 -38.39 78.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.968 0.413 . . . . 10.0 111.017 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 14.7 m -72.73 -37.36 67.78 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.12 178.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -70.07 -34.5 73.27 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.931 0.396 . . . . 10.0 110.661 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 70.0 mt -58.87 -47.07 86.2 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.277 179.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 77.0 mt-10 -68.62 -29.67 68.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.195 0.522 . . . . 10.0 110.039 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.42 -36.92 83.88 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.699 179.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -68.26 -46.57 70.06 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.149 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.2 -30.27 70.97 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.288 -0.415 . . . . 10.0 111.96 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt . . . . . 0 N--CA 1.464 0.26 0 CA-C-O 121.02 0.438 . . . . 10.0 110.946 179.436 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' C' ' 405' ' ' TRP . 57.4 mt . . . . . 0 N--CA 1.45 -0.47 0 CA-C-O 120.639 0.257 . . . . 10.0 111.152 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 98.4 mt -71.8 -40.4 69.21 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 120.862 0.363 . . . . 10.0 111.238 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.09 -46.62 77.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.448 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . 0.508 ' O ' HG23 ' C' ' 408' ' ' VAL . 1.0 OUTLIER -65.19 -38.29 90.03 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 179.262 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . 0.501 ' HB2' ' O ' ' C' ' 401' ' ' LEU . 1.7 t90 -61.1 -34.88 75.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.437 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -64.81 -45.53 85.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.132 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 1.6 m -61.71 -36.33 80.63 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.092 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . 0.508 HG23 ' O ' ' C' ' 404' ' ' ASN . 96.9 t -67.01 -37.75 79.99 Favored 'Isoleucine or valine' 0 C--O 1.231 0.107 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 178.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 38.6 m -62.93 -42.6 99.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.737 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 14.5 m -62.44 -30.64 71.38 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . 0.692 HG23 ' HD3' ' A' ' 363' ' ' LYS . 47.1 m -66.81 -33.57 75.91 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.745 178.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -70.52 -38.47 74.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.13 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 2.0 m -63.15 -40.94 99.03 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . 0.721 ' HA ' ' HG3' ' C' ' 417' ' ' GLU . 36.9 mmtt -69.25 -31.85 70.67 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.033 179.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 46.1 tp -71.06 -37.92 72.51 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . 0.578 ' HA ' ' HB2' ' C' ' 419' ' ' LEU . 54.6 mtt180 -66.7 -23.32 66.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.631 -0.713 . . . . 10.0 111.03 179.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . 0.721 ' HG3' ' HA ' ' C' ' 414' ' ' LYS . 2.3 mt-10 -64.56 -36.08 83.07 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 108.243 -1.021 . . . . 10.0 108.243 177.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . 0.779 ' O ' ' HB ' ' C' ' 422' ' ' VAL . 18.4 mt-30 -81.66 -30.03 32.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.033 -0.985 . . . . 10.0 109.277 178.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . 0.578 ' HB2' ' HA ' ' C' ' 416' ' ' ARG . 71.6 mt -69.27 -11.62 60.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.318 179.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -97.89 -99.75 2.07 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.159 -0.543 . . . . 10.0 112.038 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -49.44 -43.67 37.6 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.789 2.993 . . . . 10.0 113.769 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . 0.888 HG13 ' HG2' ' A' ' 352' ' ' LYS . 55.1 t -59.66 -46.95 92.78 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-O 120.531 0.205 . . . . 10.0 111.085 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 5.0 m -65.97 -39.65 90.56 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.952 -0.388 . . . . 10.0 109.952 178.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -60.54 -45.72 92.82 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -64.3 -30.88 71.91 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.715 -0.675 . . . . 10.0 109.551 178.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -67.6 -38.17 83.6 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.885 -0.783 . . . . 10.0 108.885 178.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . 0.456 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 44.4 m95 -67.05 -41.66 86.13 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 108.178 -1.045 . . . . 10.0 108.178 177.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -60.56 -40.52 91.93 Favored 'General case' 0 C--N 1.333 -0.11 0 N-CA-C 108.349 -0.982 . . . . 10.0 108.349 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -63.95 -46.53 84.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.447 178.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 50.0 mt -61.69 -28.82 69.67 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.106 179.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 67.6 mm-40 -64.96 -46.43 81.55 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.612 -0.885 . . . . 10.0 108.612 177.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -62.64 -40.91 98.5 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 108.405 -0.961 . . . . 10.0 108.405 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . 0.408 ' CD ' ' HE ' ' A' ' 345' ' ' ARG . 10.3 mt-10 -60.08 -55.43 34.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.115 -0.948 . . . . 10.0 110.914 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 3.1 p -59.14 -38.3 79.36 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.967 0.358 . . . . 10.0 111.967 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -63.55 -50.6 68.88 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 110.03 -0.359 . . . . 10.0 110.03 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.8 -48.03 76.57 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.677 -0.773 . . . . 10.0 111.358 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 74.5 mt -57.74 -40.04 78.73 Favored 'General case' 0 C--O 1.22 -0.455 0 O-C-N 123.556 0.21 . . . . 10.0 110.986 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -66.47 -33.56 75.97 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.706 -0.398 . . . . 10.0 110.914 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -67.52 -41.38 84.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.839 -0.8 . . . . 10.0 108.839 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . 0.464 ' O ' ' HB2' ' C' ' 444' ' ' ASP . 28.0 mt-10 -69.84 -53.48 17.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.328 -0.851 . . . . 10.0 109.77 178.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 80.7 mmm -57.92 -41.04 81.84 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.977 0.732 . . . . 10.0 112.977 -178.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . 0.482 ' O ' ' HG3' ' C' ' 446' ' ' GLU . 33.4 p -60.91 -49.91 75.56 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.643 -0.423 . . . . 10.0 110.003 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 8.1 tttt -67.71 -37.92 82.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.741 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . 0.495 ' CG ' HH21 ' A' ' 334' ' ' ARG . 0.4 OUTLIER -58.32 -51.52 69.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.285 178.951 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 85.2 mt -65.98 -37.33 85.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.917 -0.583 . . . . 10.0 111.119 179.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' C' ' 442' ' ' SER . 38.1 mt-10 -63.3 -47.13 83.58 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.108 -0.701 . . . . 10.0 109.108 178.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . 0.531 ' HB3' ' HE ' ' A' ' 330' ' ' ARG . 10.9 mm-40 -65.84 -36.0 82.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.594 -0.73 . . . . 10.0 109.308 178.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.38 -47.12 93.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.871 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 69.7 mttt -66.28 -30.44 70.86 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.962 0.411 . . . . 10.0 110.87 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -86.3 5.29 35.22 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.543 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 323' ' ' TYR . 37.8 mttp -124.93 -36.67 2.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.703 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.0 -44.52 99.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 110.29 -0.263 . . . . 10.0 110.29 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . 0.819 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 41.0 mt-30 -59.31 -58.84 16.49 Favored Pre-proline 0 CA--C 1.535 0.365 0 CA-C-N 116.541 -0.3 . . . . 10.0 111.014 179.147 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . 0.819 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 33.0 Cg_exo -60.65 -34.77 91.78 Favored 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 122.035 1.824 . . . . 10.0 112.013 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . 0.497 ' O ' ' HB2' ' C' ' 459' ' ' PHE . 16.9 t80 -67.17 -50.14 62.2 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.209 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 28.1 mt -64.8 -39.94 94.41 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 110.203 -0.295 . . . . 10.0 110.203 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.73 -47.03 88.11 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . 0.608 ' HA ' ' HD2' ' C' ' 461' ' ' LYS . 2.2 t70 -72.73 -34.15 66.89 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.445 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . 0.497 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 0.7 OUTLIER -70.64 -32.33 69.59 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 178.893 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -62.51 -34.47 76.96 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 178.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . 0.608 ' HD2' ' HA ' ' C' ' 458' ' ' ASP . 58.4 mttt -66.09 -43.39 87.47 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.542 -0.91 . . . . 10.0 108.542 177.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' C' ' 458' ' ' ASP . 37.7 mmtm -60.93 -45.46 94.59 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.448 -0.797 . . . . 10.0 108.975 178.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -60.68 -39.53 88.82 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.395 178.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . 0.403 HE21 ' HB3' ' C' ' 464' ' ' GLN . 6.9 mt-30 -66.97 -49.09 66.49 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 110.095 -0.335 . . . . 10.0 110.095 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 1.26 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 49.0 mt-10 -57.09 -37.5 71.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.816 0.341 . . . . 10.0 110.163 179.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.25 -52.56 10.58 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.903 -0.59 . . . . 10.0 111.078 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 74.3 mmm -60.79 -49.0 79.24 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.615 0.245 . . . . 10.0 111.47 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -67.27 -37.28 83.22 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.679 -0.489 . . . . 10.0 109.679 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 1.26 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 96.5 mt -61.96 -44.47 96.68 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 115.803 -0.635 . . . . 20.0 109.513 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . 0.496 ' HA ' ' HB2' ' C' ' 473' ' ' LYS . 22.2 m-30 -70.85 -22.95 62.25 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.497 179.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 26.9 mtt180 -67.76 -33.85 75.66 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 108.801 -0.814 . . . . 10.0 108.801 178.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -93.04 10.09 32.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.324 -0.853 . . . . 10.0 109.905 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . 0.535 ' HG2' HD22 ' A' ' 301' ' ' LEU . 75.9 mttt -121.46 -67.3 0.98 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.755 179.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 61.8 t -55.77 -42.2 69.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.01 -0.541 . . . . 10.0 112.229 -178.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -59.93 -62.61 5.55 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 112.293 0.479 . . . . 10.0 112.293 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . 0.543 ' HB2' ' HE2' ' A' ' 297' ' ' LYS . 28.8 Cg_endo -64.19 -32.97 62.22 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 121.69 1.594 . . . . 10.0 111.424 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' C' ' 477' ' ' LEU . 23.6 mt -65.9 -42.72 89.86 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 120.993 -0.283 . . . . 10.0 110.25 178.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . 0.439 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 58.4 mtt180 -62.88 -38.22 90.02 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -66.13 -50.73 62.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.892 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.27 -39.48 94.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.785 0.326 . . . . 10.0 110.198 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 17.9 mt -65.57 -33.71 76.54 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 178.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . 0.439 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 4.5 tt0 -71.93 -38.91 69.78 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 178.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -64.64 -43.1 94.76 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.352 -0.981 . . . . 10.0 108.352 177.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -69.25 -33.44 73.44 Favored Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 110.826 -0.91 . . . . 10.0 110.826 178.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.77 -45.58 70.99 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' C' ' 486' ' ' ARG . 57.0 mtt180 -61.73 -36.68 81.67 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.215 -0.661 . . . . 10.0 109.215 178.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -65.74 -49.32 68.83 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 177.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -63.43 -37.09 85.95 Favored 'General case' 0 C--O 1.226 -0.159 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.276 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . 0.609 ' O ' ' HB2' ' C' ' 493' ' ' GLN . 60.4 mt -64.95 -32.33 74.0 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 178.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 6.3 m80 -73.87 -43.14 59.5 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.26 -1.015 . . . . 10.0 108.26 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . 0.436 ' O ' ' HE2' ' C' ' 495' ' ' LYS . 22.5 mt-10 -58.77 -44.1 90.55 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.289 -0.869 . . . . 10.0 109.2 178.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 90.1 mt -74.95 -39.95 61.06 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 115.431 -0.804 . . . . 10.0 111.703 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . 0.609 ' HB2' ' O ' ' C' ' 489' ' ' LEU . 2.5 tt0 -62.57 -44.48 96.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.792 0.33 . . . . 10.0 110.607 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -75.27 4.65 6.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.412 0.625 . . . . 10.0 110.844 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.543 ' O ' ' HB2' ' C' ' 499' ' ' LEU . 0.6 OUTLIER -114.39 -46.33 2.98 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.18 178.484 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 74.1 mt -63.8 -35.82 81.87 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.992 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . 0.44 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 22.9 m -62.68 -59.8 11.67 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 120.67 -0.412 . . . . 10.0 111.253 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . 0.44 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 30.4 Cg_endo -65.85 -40.78 15.75 Favored 'Trans proline' 0 C--N 1.356 0.936 0 C-N-CA 121.629 1.552 . . . . 10.0 111.721 178.542 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 12.8 mt -66.81 -37.07 83.81 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 121.237 -0.185 . . . . 10.0 110.837 179.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.71 -45.56 92.42 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.06 -1.216 . . . . 10.0 110.06 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -62.69 -42.01 99.41 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.237 -0.653 . . . . 10.0 109.237 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . 0.512 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 19.6 tt0 -65.27 -47.67 75.88 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.293 -0.867 . . . . 10.0 109.74 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . 0.513 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 77.1 mmm -60.98 -36.83 80.47 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.999 -0.371 . . . . 10.0 109.999 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . 0.428 ' O ' ' HG3' ' C' ' 508' ' ' ARG . 90.8 mtt180 -62.54 -48.0 81.44 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -65.8 -38.29 88.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.02 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.513 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 56.3 mtt180 -60.93 -47.99 83.87 Favored 'General case' 0 CA--C 1.522 -0.125 0 N-CA-C 108.291 -1.003 . . . . 10.0 108.291 177.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.95 -42.89 95.05 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.43 -0.805 . . . . 10.0 109.878 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . 0.652 ' O ' ' HB2' ' C' ' 512' ' ' ASP . 57.1 mtt180 -59.65 -51.05 71.46 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 109.612 -0.514 . . . . 10.0 109.612 178.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . 0.767 ' HB1' ' HE3' ' A' ' 264' ' ' LYS . . . -59.57 -38.38 80.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.157 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . 0.404 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 11.2 m170 -71.27 -56.94 5.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.566 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . 0.417 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 75.9 t -61.46 -39.27 82.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.941 -179.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.652 ' HB2' ' O ' ' C' ' 508' ' ' ARG . 0.4 OUTLIER -61.75 -41.96 98.35 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.342 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.9 -36.46 82.31 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.968 -0.752 . . . . 10.0 108.968 178.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 93.1 mt -67.39 -37.78 83.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.258 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . 0.52 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 83.9 mtt180 -58.43 -56.01 27.63 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.16 0.505 . . . . 10.0 110.256 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.75 22.74 0.46 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.6 0.593 . . . . 10.0 112.6 -179.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . 0.494 ' CG ' ' HE1' ' A' ' 257' ' ' TYR . 14.7 m80 -138.95 -43.48 0.47 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 121.87 -0.518 . . . . 10.0 111.562 179.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 86.0 mt -73.79 -38.43 64.63 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . 0.402 ' N ' ' HD2' ' C' ' 520' ' ' PRO . . . -61.79 -56.39 32.89 Favored Pre-proline 0 CA--C 1.535 0.397 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.373 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . 0.402 ' HD2' ' N ' ' C' ' 519' ' ' ALA . 18.1 Cg_endo -62.0 -38.08 60.2 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 121.549 1.499 . . . . 10.0 111.607 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . 0.4 ' O ' ' HB2' ' C' ' 524' ' ' GLU . 8.7 t80 -68.24 -39.28 82.33 Favored 'General case' 0 C--N 1.334 -0.091 0 C-N-CA 120.677 -0.409 . . . . 10.0 111.69 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . 0.452 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 10.2 p -66.36 -34.28 77.62 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 109.119 -0.697 . . . . 10.0 109.119 178.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -68.73 -36.6 78.6 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 177.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' C' ' 521' ' ' TYR . 47.4 mt-10 -62.79 -44.78 95.29 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 107.64 -1.244 . . . . 10.0 107.64 176.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 93.5 mt -61.89 -43.8 98.1 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 114.962 -1.017 . . . . 10.0 109.69 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . 0.452 ' HG3' ' O ' ' C' ' 522' ' ' SER . 66.2 mtt180 -56.98 -45.66 82.76 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.991 -0.374 . . . . 10.0 109.991 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -62.72 -49.39 75.24 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.169 -0.469 . . . . 10.0 111.043 179.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' C' ' 528' ' ' ARG . 52.9 mtt85 -66.32 -42.4 88.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.162 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 67.2 mt -66.16 -33.48 75.87 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.416 -0.356 . . . . 10.0 110.25 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . 0.413 ' O ' ' HG3' ' C' ' 534' ' ' GLU . . . -64.84 -42.82 94.61 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.885 -0.784 . . . . 10.0 108.885 178.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . 0.404 ' O ' ' HB2' ' C' ' 534' ' ' GLU . . . -67.67 -40.69 84.43 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.621 178.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . 0.423 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 24.2 ttm180 -64.38 -42.32 96.22 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 34.8 mt -64.47 -36.95 85.84 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.959 -0.564 . . . . 10.0 109.566 178.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' C' ' 530' ' ' ALA . 25.1 mt-10 -58.41 -47.82 82.67 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.713 -0.847 . . . . 10.0 108.713 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.18 -37.99 89.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.557 -0.747 . . . . 10.0 109.769 178.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 76.7 mt -68.29 -27.03 65.96 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.627 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -81.65 -40.27 23.15 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -68.83 -53.45 21.4 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.517 -0.549 . . . . 10.0 109.517 178.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -66.94 -40.56 87.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.562 179.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . 0.433 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -63.46 -45.85 93.91 Favored Glycine 0 C--O 1.226 -0.348 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.989 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -61.33 -40.35 98.5 Favored Glycine 0 N--CA 1.449 -0.441 0 N-CA-C 110.754 -0.938 . . . . 10.0 110.754 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -66.19 -44.65 83.34 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 178.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 69.9 mtt180 -61.46 -39.5 91.07 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.747 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 62.6 mt -61.35 -41.8 97.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.717 0.294 . . . . 10.0 110.569 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -70.58 -38.78 74.09 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.4 -0.593 . . . . 10.0 109.4 178.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -63.22 -49.22 75.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.257 -0.883 . . . . 10.0 109.709 178.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -59.14 -42.52 90.85 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 115.694 -0.684 . . . . 10.0 109.913 178.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.3 m170 -60.83 -48.68 80.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.962 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -62.56 -47.82 82.19 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.864 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.65 -31.66 72.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.138 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . 0.503 ' O ' ' HG ' ' C' ' 555' ' ' LEU . . . -66.26 -49.98 65.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.251 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.23 -35.24 75.0 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.937 0.399 . . . . 10.0 110.507 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -69.09 -31.46 70.19 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.479 179.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 62.1 m170 -82.74 -26.02 32.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.518 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' C' ' 551' ' ' ALA . 82.2 mt -64.48 -35.38 80.74 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.88 -42.57 94.71 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.937 -0.764 . . . . 10.0 108.937 178.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.75 -38.39 88.97 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.647 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 51.8 mt -66.32 -34.64 78.45 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 178.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 70.9 m -66.23 -31.4 72.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.582 178.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . 0.424 ' O ' ' HD2' ' C' ' 564' ' ' PRO . 3.1 mm-40 -64.63 -25.21 67.86 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 121.515 0.674 . . . . 10.0 109.518 178.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . 0.747 ' HA ' ' HB3' ' C' ' 565' ' ' ALA . 0.0 OUTLIER -98.64 -27.36 14.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.532 179.324 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -79.47 -27.2 41.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 10.0 112.087 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . 0.953 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 89.1 mttt -105.88 -73.87 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . 0.953 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 32.4 Cg_exo -60.3 -52.49 3.99 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.279 1.986 . . . . 10.0 112.876 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . 0.747 ' HB3' ' HA ' ' C' ' 561' ' ' LYS . . . -63.15 -45.58 91.22 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.672 0.619 . . . . 10.0 112.672 -179.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . 0.508 HD23 HD12 ' C' ' 569' ' ' LEU . 12.0 mt -62.57 -36.6 83.19 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.85 -0.34 . . . . 10.0 111.061 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . 1.162 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 53.3 tt0 -67.9 -36.14 79.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.974 -0.75 . . . . 10.0 108.974 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -68.57 -44.4 74.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.487 -0.778 . . . . 10.0 109.323 178.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . 0.508 HD12 HD23 ' C' ' 566' ' ' LEU . 77.5 mt -61.42 -46.29 90.74 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.534 179.228 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . 0.559 ' HA ' ' HB2' ' C' ' 573' ' ' LEU . 45.5 mtt180 -71.09 -29.35 65.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.92 0.391 . . . . 10.0 110.391 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . 1.162 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 99.0 mt-30 -65.3 -29.69 70.48 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.667 -0.697 . . . . 20.0 109.98 178.107 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -90.15 -27.0 22.3 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 109.519 -1.432 . . . . 10.0 109.519 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . 0.559 ' HB2' ' HA ' ' C' ' 570' ' ' ARG . 14.5 mt -59.12 -43.08 91.92 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.56 0.207 . . . . 10.0 111.56 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 93.8 mt -55.57 -61.04 6.86 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 112.126 0.417 . . . . 10.0 112.126 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -58.85 -35.98 97.72 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 122.092 1.861 . . . . 10.0 111.737 178.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 18.0 t -65.41 -45.21 93.74 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 110.052 -0.351 . . . . 10.0 110.052 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 63.2 mt -63.13 -38.7 92.2 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . 0.412 ' O ' HG23 ' C' ' 582' ' ' VAL . 54.8 mt-10 -65.17 -49.32 70.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.887 178.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 2.8 p -62.5 -41.39 98.79 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.025 0.44 . . . . 10.0 110.175 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -64.71 -41.02 96.3 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.805 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -61.33 -47.16 87.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.12 178.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . 0.412 HG23 ' O ' ' C' ' 578' ' ' GLU . 84.1 t -60.43 -42.24 90.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.869 -0.419 . . . . 10.0 109.869 179.077 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 20.0 m -64.29 -44.27 92.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.319 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . 0.445 ' O ' ' HG ' ' C' ' 588' ' ' LEU . 8.2 m-85 -66.06 -46.64 77.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.842 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 29.5 mt -55.65 -48.48 74.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.803 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . 0.423 ' O ' ' HG3' ' C' ' 590' ' ' GLU . 5.1 m -66.56 -42.14 87.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.175 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -61.65 -42.51 99.01 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.287 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' C' ' 584' ' ' PHE . 84.7 mt -59.09 -40.82 86.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.06 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . 0.449 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 15.8 mt-10 -66.62 -38.4 86.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.961 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' C' ' 586' ' ' SER . 51.8 mt-10 -72.6 -40.46 66.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.084 0.469 . . . . 10.0 110.853 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 8.4 m-30 -66.25 -44.93 82.3 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.962 -0.563 . . . . 10.0 112.172 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 2.7 p -59.5 -33.48 71.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.81 0.338 . . . . 10.0 111.699 -179.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 86.8 mttt -69.0 -20.23 64.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.194 0.521 . . . . 10.0 111.349 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.13 -2.93 51.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.891 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 81.9 mt -119.79 16.59 12.7 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.12 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.616 -0.707 . . . . 10.0 109.664 179.811 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.53 0.193 0 CA-C-O 120.664 0.269 . . . . 10.0 111.446 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -96.22 124.14 40.11 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.458 -0.571 . . . . 10.0 109.458 178.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -114.76 120.97 41.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.785 0.326 . . . . 10.0 110.452 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 23.9 mtmm -91.01 111.05 22.34 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.248 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.462 HD22 HD23 ' B' ' 159' ' ' LEU . 15.0 mt -107.75 119.62 39.95 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.478 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 55.4 t -103.44 124.25 57.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 120.914 0.388 . . . . 10.0 110.632 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 22.9 t -98.8 112.53 31.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.564 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 22.9 m -109.41 161.6 7.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.789 0.328 . . . . 10.0 111.075 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 156.95 -179.67 32.57 Favored Glycine 0 N--CA 1.446 -0.661 0 N-CA-C 111.22 -0.752 . . . . 10.0 111.22 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -83.66 173.87 11.0 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.957 0.408 . . . . 10.0 111.11 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -84.6 118.07 4.64 Favored Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 120.597 -0.811 . . . . 10.0 112.016 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 110.96 -1.94 28.61 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.419 -0.896 . . . . 10.0 112.959 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 27.8 m -73.05 -38.69 56.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 111.996 0.369 . . . . 10.0 111.996 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 113.9 33.72 1.8 Allowed Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.383 -0.913 . . . . 10.0 113.264 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . 0.403 ' HB2' ' HE3' ' B' ' 16' ' ' LYS . 38.5 mtmt -62.28 -58.79 6.41 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.835 0.35 . . . . 10.0 111.119 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . 0.409 ' O ' HG13 ' B' ' 21' ' ' ILE . 0.8 OUTLIER -57.89 -33.22 68.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.519 -0.764 . . . . 10.0 111.616 -179.537 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.54 -41.45 94.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.955 0.407 . . . . 10.0 110.273 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 91.5 mt -67.4 -39.23 85.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.012 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 2.1 m -64.42 -49.28 72.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.879 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . 0.409 HG13 ' O ' ' B' ' 17' ' ' SER . 68.8 mt -64.08 -31.11 52.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.107 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.606 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 9.2 tp-100 -68.92 -30.56 69.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.661 0.267 . . . . 10.0 110.906 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.2 tp -87.6 -35.36 18.12 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.182 0.515 . . . . 10.0 111.088 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 43.7 mm -80.83 -55.57 8.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 112.548 0.573 . . . . 10.0 112.548 -178.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . 0.434 ' OE1' ' HA ' ' D' ' 840' ' ' VAL . 15.3 mt-30 -96.98 -15.58 21.03 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.735 0.642 . . . . 10.0 112.735 -178.161 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.606 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 86.2 m-20 65.58 29.73 10.88 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.71 0.767 . . . . 10.0 109.208 -178.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -128.76 138.09 51.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.858 -1.064 . . . . 10.0 109.479 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -94.61 139.17 31.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.301 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 m -103.39 114.16 42.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.057 -0.519 . . . . 10.0 110.752 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -91.55 6.82 44.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.343 0.592 . . . . 10.0 109.782 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -94.72 158.73 15.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.306 -0.861 . . . . 10.0 110.207 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -105.43 79.96 1.52 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.0 0.428 . . . . 10.0 110.054 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . 0.483 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 1.6 t0 -98.64 130.81 27.08 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.383 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 17.4 Cg_exo -69.16 -172.84 0.55 Allowed 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.196 2.598 . . . . 10.0 112.286 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -169.94 143.48 2.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.389 -0.369 . . . . 10.0 111.121 -179.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.584 ' HB ' ' HB ' ' D' ' 821' ' ' VAL . 11.5 mt -115.99 -62.58 2.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 108.458 -0.942 . . . . 10.0 108.458 178.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.472 ' O ' HG23 ' D' ' 821' ' ' VAL . 2.5 tt0 -154.74 92.5 1.48 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.298 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . 0.624 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 61.1 m-20 -109.21 160.05 16.42 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.187 179.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.6 p -148.24 138.3 22.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 112.274 0.472 . . . . 10.0 112.274 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . 0.604 ' CE2' HG22 ' D' ' 840' ' ' VAL . 1.5 m-85 -128.55 151.5 49.38 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.847 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . 0.616 ' NH1' ' HB2' ' D' ' 817' ' ' LYS . 5.1 ttp180 -137.25 126.46 24.64 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.521 0.2 . . . . 10.0 110.634 -178.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 8.6 tttm -151.06 141.03 22.02 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.369 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -88.94 135.14 33.7 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.14 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 21.7 m -137.54 167.21 23.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.852 0.358 . . . . 10.0 111.227 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 58.9 t -115.48 114.41 46.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.669 -0.696 . . . . 10.0 109.744 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 46.1 mt -127.27 121.0 56.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.337 -179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 66.25 21.88 10.99 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.432 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.51 -20.39 50.88 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 121.033 -0.604 . . . . 10.0 112.45 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -88.46 150.43 23.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.997 0.427 . . . . 10.0 110.907 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 9.8 t -103.58 137.5 41.57 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 108.505 -0.924 . . . . 10.0 108.505 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 3.6 p -147.84 153.24 38.89 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.954 0.407 . . . . 10.0 111.529 -178.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 26.5 tp -100.93 117.03 34.18 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.619 -0.882 . . . . 10.0 108.619 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.553 ' O ' ' HA ' ' B' ' 41' ' ' ARG . 46.7 mt -92.43 120.52 33.0 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.464 0.542 . . . . 10.0 112.464 -178.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -104.77 90.75 3.58 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 106.992 -1.484 . . . . 10.0 106.992 177.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 13.5 mt -84.9 134.56 26.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.729 -0.669 . . . . 10.0 112.055 -177.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.493 HD12 ' O ' ' B' ' 38' ' ' ASP . 63.7 tp -112.36 111.12 21.76 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.582 -0.735 . . . . 10.0 111.348 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.624 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 6.5 t70 -89.95 91.04 8.42 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.34 -0.985 . . . . 10.0 108.34 178.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 81.7 p -78.36 171.7 14.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.87 -178.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.04 158.71 27.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.692 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -82.86 -47.83 5.72 Favored Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 110.573 -1.011 . . . . 10.0 110.573 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -127.31 118.99 25.26 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.28 -0.637 . . . . 20.0 109.28 178.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.417 ' OE2' ' HB2' ' B' ' 68' ' ' ARG . 8.9 tt0 -137.71 166.95 22.7 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.502 -179.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -115.59 -160.49 0.75 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.053 -0.521 . . . . 10.0 109.969 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -71.38 104.56 3.23 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.75 -0.463 . . . . 10.0 109.75 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 68.4 m -136.99 135.49 37.68 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.974 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.96 -33.55 76.08 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.543 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 63.6 mmm -61.65 -41.52 97.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 10.0 109.984 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.467 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 58.9 ttt85 -64.18 -45.77 86.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.604 -0.726 . . . . 10.0 110.797 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.448 ' OD1' HG12 ' B' ' 103' ' ' VAL . 2.6 t0 -62.05 -38.38 88.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.194 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 18.7 tp60 -69.02 -47.4 65.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.626 -0.716 . . . . 10.0 112.099 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . 0.467 ' CE2' ' HA ' ' B' ' 68' ' ' ARG 0.292 0.2 OUTLIER -69.01 -23.18 64.06 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 114.14 1.163 . . . . 10.0 114.14 -178.722 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . 0.597 ' HB3' HG21 ' B' ' 103' ' ' VAL . 55.4 mtm -87.42 -25.67 23.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.198 0.523 . . . . 10.0 110.3 178.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . 0.637 HH21 ' HA ' ' B' ' 103' ' ' VAL . 15.4 ttm180 -67.34 -28.7 68.19 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.914 -0.584 . . . . 10.0 111.363 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -89.63 -1.45 58.02 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.346 0.499 . . . . 10.0 112.346 -179.092 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.27 149.66 34.27 Favored Glycine 0 C--O 1.237 0.305 0 C-N-CA 120.647 -0.787 . . . . 10.0 113.102 -179.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -102.99 -55.35 2.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.061 0.457 . . . . 10.0 109.873 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . 0.428 ' HA3' HD11 ' B' ' 163' ' ' ILE . . . -115.01 142.77 17.83 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 110.992 -0.843 . . . . 10.0 110.992 179.433 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 73.8 m-85 -122.35 126.34 47.83 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.121 0.486 . . . . 10.0 112.155 -178.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.889 ' HG ' HD22 ' B' ' 159' ' ' LEU . 56.5 mt -98.79 117.59 33.61 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.864 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 9.6 m -91.21 91.57 8.27 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 50.0 t -90.01 119.96 38.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.08 0.467 . . . . 10.0 112.167 -178.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.767 ' HB3' HD11 ' B' ' 93' ' ' ILE . 15.2 p90 -132.12 140.06 48.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.021 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -82.77 128.03 34.0 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.829 -0.434 . . . . 10.0 109.829 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . 0.817 HD11 ' HA ' ' B' ' 118' ' ' CYS . 43.1 pt -72.25 -5.9 6.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 112.083 0.401 . . . . 10.0 112.083 -179.149 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . 0.404 ' OD1' ' HD2' ' B' ' 117' ' ' LYS . 2.0 p-10 -98.45 1.14 46.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.942 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -129.23 119.45 24.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.635 -0.712 . . . . 10.0 110.335 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.67 -38.11 76.94 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 -178.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 52.3 tttp -59.73 -39.12 83.67 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.906 0.384 . . . . 10.0 111.062 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 49.2 m -59.42 -38.18 79.99 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.701 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -68.62 -36.71 79.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.116 0.484 . . . . 10.0 111.115 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -79.82 -30.72 40.54 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.683 -179.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.36 -16.28 63.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.19 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . 0.767 HD11 ' HB3' ' B' ' 82' ' ' PHE . 38.7 mm -56.74 -42.29 76.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.677 179.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -66.6 -36.99 83.94 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.912 0.387 . . . . 10.0 110.223 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -62.82 -39.36 94.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.042 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -78.96 -34.09 44.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.385 -0.371 . . . . 10.0 111.061 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -57.68 -50.01 74.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.314 179.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . 0.51 ' HA ' ' HD3' ' B' ' 101' ' ' LYS . 33.9 mm-40 -68.2 -32.44 72.66 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.993 -0.548 . . . . 10.0 111.026 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -63.38 -47.43 82.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.002 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . 0.574 ' HA ' HG22 ' B' ' 103' ' ' VAL . 55.3 mt -63.13 -35.8 73.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.29 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' B' ' 98' ' ' GLU . 49.7 mtpt -62.62 -31.4 72.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.513 179.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.01 -20.06 33.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.85 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.637 ' HA ' HH21 ' B' ' 73' ' ' ARG . 15.0 m -87.99 -33.72 6.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.599 -0.441 . . . . 10.0 111.586 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -95.95 -15.84 22.1 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.473 179.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 63.12 48.11 3.89 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.454 -0.794 . . . . 10.0 112.054 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 9.2 t -166.68 164.88 16.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.659 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -101.58 -20.21 15.15 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -91.91 77.15 5.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.626 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.472 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 39.6 t -123.43 132.83 24.28 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.26 -179.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 21.5 Cg_exo -65.71 106.97 0.98 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.852 2.368 . . . . 10.0 111.881 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . 0.461 ' HB2' HG21 ' B' ' 139' ' ' ILE . 61.4 mtt -127.81 152.34 47.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.862 -0.608 . . . . 10.0 109.891 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . 0.572 ' HB ' HD23 ' B' ' 79' ' ' LEU . 88.6 t -135.67 127.99 46.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.744 -0.465 . . . . 10.0 109.744 179.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 18.7 tp -80.43 114.52 19.38 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 45.3 t -111.15 110.23 31.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.518 -178.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -86.35 128.89 9.1 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 109.335 -1.506 . . . . 10.0 109.335 178.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -114.89 155.94 25.92 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 117.42 0.61 . . . . 10.0 112.372 -178.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . 0.423 ' HB3' HD12 ' B' ' 120' ' ' LEU . 80.3 mttt 71.99 46.05 0.37 Allowed 'General case' 0 N--CA 1.462 0.146 0 O-C-N 124.174 0.921 . . . . 10.0 112.65 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . 0.817 ' HA ' HD11 ' B' ' 84' ' ' ILE . 26.3 p -79.0 -15.31 58.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.032 0.444 . . . . 10.0 110.642 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -86.22 1.29 51.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.165 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . 0.423 HD12 ' HB3' ' B' ' 117' ' ' LYS . 24.4 mt -100.27 137.09 19.93 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.568 179.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.92 -3.16 13.5 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.914 2.409 . . . . 10.0 112.326 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 13.2 t -85.51 26.47 0.93 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.923 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 -64.52 107.0 1.26 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.052 0.453 . . . . 10.0 111.927 -179.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 2.8 m -97.25 -34.47 11.08 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.762 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 46.5 t -87.41 119.24 34.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.894 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . 0.656 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 27.8 t70 -72.78 153.8 40.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.521 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.25 -41.88 85.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.858 -0.61 . . . . 10.0 112.152 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -69.64 -38.03 77.0 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.308 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . 0.656 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 25.7 mt-30 -55.39 -45.38 76.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.179 0.514 . . . . 10.0 110.517 179.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.97 -41.96 77.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.458 -0.792 . . . . 10.0 110.929 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -60.43 -40.68 91.95 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.959 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -62.5 -45.5 92.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.9 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 32.3 tp -62.85 -45.86 90.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.873 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.67 -45.97 90.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.968 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -61.05 -31.8 71.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.516 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 32.3 m -70.8 -29.81 66.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.459 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -93.5 -6.78 46.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.797 0.332 . . . . 10.0 110.879 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 75.09 29.72 60.13 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.976 -0.631 . . . . 10.0 111.843 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . 0.461 HG21 ' HB2' ' B' ' 111' ' ' MET . 49.0 pt -122.02 154.82 61.44 Favored Pre-proline 0 C--N 1.329 -0.306 0 N-CA-C 110.55 -0.167 . . . . 10.0 110.55 -179.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -80.51 150.96 19.57 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.922 2.415 . . . . 10.0 112.268 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -113.14 121.51 44.74 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.502 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 11.9 mm -118.12 117.9 56.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.54 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -82.9 123.76 29.7 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.023 -1.103 . . . . 10.0 108.023 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . 0.537 ' HA ' ' O ' ' B' ' 150' ' ' GLN . 76.3 p -135.89 172.66 12.69 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 113.568 0.951 . . . . 10.0 113.568 -177.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -163.8 121.41 1.81 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 113.953 -1.476 . . . . 10.0 107.635 178.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -72.61 -25.63 61.38 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.317 0.488 . . . . 10.0 112.317 -178.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 22.5 tttt -66.26 -47.96 72.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.848 0.356 . . . . 10.0 111.6 -179.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.1 0.82 41.45 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.2 -0.455 . . . . 10.0 111.522 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 18.3 ttt85 54.5 47.81 21.92 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.18 -179.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . 0.537 ' O ' ' HA ' ' B' ' 144' ' ' THR . 32.8 tt0 -90.05 111.85 23.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.609 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 66.94 10.19 55.31 Favored Glycine 0 CA--C 1.519 0.286 0 N-CA-C 114.594 0.598 . . . . 10.0 114.594 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 90.6 t -59.68 -49.15 84.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 117.046 0.423 . . . . 10.0 111.119 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -63.75 -45.01 91.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.301 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -61.64 -38.35 87.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.863 -0.608 . . . . 10.0 112.055 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.92 -50.63 72.69 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.838 0.352 . . . . 10.0 110.915 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -65.81 -41.52 91.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.816 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . 0.407 ' O ' ' HG3' ' B' ' 161' ' ' ARG . 13.5 m-30 -63.01 -41.67 99.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.682 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 98.8 m -57.89 -41.5 82.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.798 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.889 HD22 ' HG ' ' B' ' 79' ' ' LEU . 30.3 tp -58.06 -50.75 72.38 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.212 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 39.3 t -62.73 -38.88 82.84 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.458 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' B' ' 161' ' ' ARG . 43.7 mtm-85 -61.76 -34.36 75.71 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.495 179.054 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -76.42 -37.13 57.52 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.194 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . 0.529 HG13 ' O ' ' B' ' 159' ' ' LEU . 78.5 mt -64.01 -44.5 97.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.849 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 29.0 ttm180 -59.53 -52.19 66.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.761 0.315 . . . . 10.0 110.646 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -61.19 -33.52 73.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.156 0.503 . . . . 10.0 110.244 179.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -65.09 -39.43 93.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.591 -0.731 . . . . 10.0 111.042 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' B' ' 163' ' ' ILE . 67.7 mttt -70.48 -42.64 71.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.455 -0.338 . . . . 10.0 110.464 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -71.56 -15.46 62.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.265 0.555 . . . . 10.0 110.145 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -80.5 -39.2 28.39 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.957 -0.757 . . . . 10.0 108.957 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 17.0 mmt -67.99 -30.5 69.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.454 -0.794 . . . . 10.0 111.781 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 12.9 m . . . . . 0 C--N 1.33 -0.242 0 CA-C-O 120.782 0.325 . . . . 10.0 111.322 179.469 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.266 0 N-CA-C 111.79 -0.524 . . . . 10.0 111.79 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' D' D ' 809' ' ' THR . . . . . 0.422 HG21 HD11 ' B' ' 36' ' ' ILE . 36.1 p -121.42 118.08 28.49 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.359 -0.238 . . . . 10.0 110.359 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 3.5 t -101.69 134.23 42.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.036 0.446 . . . . 10.0 111.209 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 38.3 mtpt -83.35 114.54 21.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.653 -0.703 . . . . 10.0 110.326 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 44.4 t -100.88 122.61 53.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 813' ' ' TYR . . . . . 0.495 ' HB2' ' HA ' ' D' ' 876' ' ' ILE . 77.4 m-85 -89.86 137.76 32.06 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.462 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 814' ' ' LEU . . . . . 0.652 HD13 ' HD2' ' D' ' 841' ' ' ARG . 19.4 mt -109.35 147.92 37.0 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 115.647 -0.706 . . . . 10.0 110.782 -178.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 815' ' ' PRO . . . . . 0.484 ' HB3' ' HA ' ' D' ' 878' ' ' GLU . 65.2 Cg_endo -73.93 56.76 3.69 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.322 2.681 . . . . 10.0 111.79 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 816' ' ' ASN . . . . . 0.593 ' OD1' ' HB3' ' B' ' 41' ' ' ARG . 0.7 OUTLIER -163.47 33.48 0.09 Allowed 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 107.975 -1.12 . . . . 10.0 107.975 -179.535 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' D' D ' 817' ' ' LYS . . . . . 0.616 ' HB2' ' NH1' ' B' ' 41' ' ' ARG . 31.3 mtpt 52.51 39.79 28.57 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 114.357 -1.292 . . . . 10.0 111.66 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -139.18 -173.94 3.73 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 113.23 0.826 . . . . 10.0 113.23 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.51 172.02 17.81 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.678 -0.692 . . . . 10.0 112.218 -177.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 12.1 t -150.99 139.26 20.28 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.346 -1.353 . . . . 10.0 107.346 177.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 821' ' ' VAL . . . . . 0.584 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 2.3 t -110.03 107.53 23.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 120.331 -0.548 . . . . 10.0 111.295 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 10.6 t -109.49 143.59 19.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.01 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.57 136.37 39.26 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.521 -0.309 . . . . 10.0 110.73 179.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 59.1 t -89.02 127.45 41.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.917 0.389 . . . . 10.0 110.418 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 825' ' ' ARG . . . . . 0.443 ' HB2' ' SD ' ' D' ' 828' ' ' MET . 51.3 mtp180 -131.01 155.23 47.2 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.77 154.13 36.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.007 0.432 . . . . 10.0 110.883 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 95.49 -55.59 1.71 Allowed Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.817 -0.706 . . . . 10.0 113.071 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 828' ' ' MET . . . . . 0.443 ' SD ' ' HB2' ' D' ' 825' ' ' ARG . 10.2 ptm -64.67 147.73 52.42 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.406 0.622 . . . . 10.0 112.483 -179.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 829' ' ' SER . . . . . 0.661 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.1 OUTLIER -100.05 177.88 4.96 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.429 -0.805 . . . . 10.0 110.777 -179.667 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' D' D ' 830' ' ' VAL . . . . . 0.525 ' O ' ' HB2' ' D' ' 834' ' ' LEU . 69.6 t -59.06 -44.54 91.63 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 179.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 831' ' ' TYR . . . . . 0.637 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 27.4 t80 -55.83 -34.23 65.2 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.32 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -68.5 -64.58 0.84 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.675 -178.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 1.2 m -61.69 -38.56 88.29 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.382 0.512 . . . . 10.0 112.382 -179.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 834' ' ' LEU . . . . . 0.576 ' HB3' ' HZ3' ' D' ' 863' ' ' TRP . 3.7 mm? -75.4 -17.55 60.17 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.933 0.716 . . . . 10.0 112.933 -178.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 835' ' ' ASP . . . . . 0.416 ' HB2' ' O ' ' D' ' 831' ' ' TYR . 32.1 t70 -62.13 -48.88 78.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.95 0.405 . . . . 10.0 109.939 179.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 836' ' ' LYS . . . . . 0.406 ' O ' ' HB ' ' D' ' 840' ' ' VAL . 3.4 mmmm -67.43 -25.93 66.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.362 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -81.67 -18.34 44.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.57 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 838' ' ' LEU . . . . . 0.595 HD12 ' HG3' ' D' ' 845' ' ' GLN . 16.3 mt -99.26 -47.12 5.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.042 0.448 . . . . 10.0 111.007 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 839' ' ' LYS . . . . . 0.442 ' HA ' ' HD3' ' D' ' 839' ' ' LYS . 28.9 mmtp -62.01 -27.49 68.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.898 -0.592 . . . . 10.0 111.061 -179.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 840' ' ' VAL . . . . . 0.83 HG13 ' HG3' ' D' ' 841' ' ' ARG . 10.1 p -57.73 -22.84 19.09 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 O-C-N 123.739 0.649 . . . . 10.0 111.208 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 841' ' ' ARG . . . . . 0.83 ' HG3' HG13 ' D' ' 840' ' ' VAL . 2.5 mtp-105 -120.6 10.15 11.0 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.224 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 73.49 33.35 58.59 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.975 -0.631 . . . . 10.0 112.801 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 90.8 mt -104.93 142.69 34.31 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -108.56 153.82 22.83 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.523 -0.308 . . . . 10.0 111.22 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 845' ' ' GLN . . . . . 0.595 ' HG3' HD12 ' D' ' 838' ' ' LEU . 23.8 mp0 -76.49 51.36 0.72 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.245 0.545 . . . . 10.0 111.795 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -118.79 -71.74 0.72 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.85 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -92.73 32.45 1.24 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.817 -0.629 . . . . 10.0 111.597 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 36.2 m -125.0 137.84 54.23 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.74 -0.467 . . . . 10.0 109.74 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 4.7 p -126.9 137.8 56.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.622 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 850' ' ' VAL . . . . . 0.47 HG22 HG22 ' D' ' 877' ' ' VAL . 43.4 t -101.58 126.85 55.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 121.066 0.46 . . . . 10.0 111.05 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -109.32 144.74 37.08 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.9 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 852' ' ' ARG . . . . . 0.785 ' HD3' HD11 ' D' ' 870' ' ' LEU . 27.8 mtm180 -92.13 179.43 5.58 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.252 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 853' ' ' LEU . . . . . 0.473 HD23 HD11 ' D' ' 876' ' ' ILE . 0.2 OUTLIER -123.32 56.76 1.17 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.333 0.587 . . . . 10.0 110.455 -179.583 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 61.4 mt -83.21 100.96 7.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.816 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 855' ' ' LYS . . . . . 0.413 ' HA ' ' HE2' ' D' ' 855' ' ' LYS . 10.7 mmpt? 63.8 14.37 8.23 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.938 -0.573 . . . . 10.0 111.302 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 102.62 -13.26 56.62 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 121.067 -0.587 . . . . 10.0 111.92 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -83.05 130.53 35.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.007 0.432 . . . . 10.0 110.649 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 858' ' ' LYS . . . . . 0.514 ' HD2' HD13 ' D' ' 876' ' ' ILE . 1.6 mppt? -84.07 104.37 14.08 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.102 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.95 136.68 41.36 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.962 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 42.3 t -67.07 126.41 26.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.922 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 5.1 m -119.49 142.85 47.91 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -86.89 162.49 17.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.785 0.326 . . . . 10.0 111.591 -178.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 863' ' ' TRP . . . . . 0.637 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 73.0 m95 -78.97 -25.3 43.49 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.886 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -72.95 -22.94 60.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.705 -0.679 . . . . 10.0 111.319 -179.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 5.3 m -62.96 146.19 53.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.388 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 866' ' ' ALA . . . . . 0.661 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -78.0 149.79 34.0 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.107 -0.331 . . . . 10.0 110.107 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 867' ' ' ILE . . . . . 0.591 HD11 HD11 ' D' ' 875' ' ' LEU . 7.9 tp -92.0 -10.41 9.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.111 0.481 . . . . 10.0 111.498 -179.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -55.07 -52.68 69.07 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 113.749 1.018 . . . . 10.0 113.749 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -77.51 9.85 2.73 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 121.864 1.709 . . . . 10.0 113.369 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 870' ' ' LEU . . . . . 0.785 HD11 ' HD3' ' D' ' 852' ' ' ARG . 1.3 mm? -104.25 4.7 34.09 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.045 0.387 . . . . 10.0 112.045 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -69.22 104.14 2.12 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.501 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 145.17 -13.55 1.87 Allowed Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.05 -1.071 . . . . 10.0 113.811 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -128.42 -174.85 3.34 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 117.554 0.677 . . . . 10.0 112.201 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -109.33 153.05 24.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.142 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 875' ' ' LEU . . . . . 0.591 HD11 HD11 ' D' ' 867' ' ' ILE . 47.8 mt -121.18 128.53 52.56 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.178 -0.305 . . . . 10.0 110.178 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 876' ' ' ILE . . . . . 0.514 HD13 ' HD2' ' D' ' 858' ' ' LYS . 2.4 mp -113.65 122.23 67.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.835 0.35 . . . . 10.0 110.806 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 877' ' ' VAL . . . . . 0.48 HG11 HD21 ' D' ' 838' ' ' LEU . 17.6 t -106.42 130.13 58.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 878' ' ' GLU . . . . . 0.484 ' HA ' ' HB3' ' D' ' 815' ' ' PRO . 0.0 OUTLIER -128.1 163.34 24.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.765 0.317 . . . . 10.0 110.962 179.707 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 59.0 t -93.24 130.0 42.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.433 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 49.2 mt . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.551 -0.738 . . . . 10.0 110.46 179.54 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 69.7 mt . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.544 0.211 . . . . 10.0 111.329 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 30.2 ttm180 -66.95 -44.03 81.61 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 178.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -61.07 -44.7 96.97 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 108.362 -0.977 . . . . 10.0 108.362 178.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . 0.42 ' OE1' ' HB3' ' C' ' 528' ' ' ARG . 20.5 mt-10 -59.11 -55.88 29.36 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.225 -0.898 . . . . 10.0 109.892 178.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . 0.42 ' HA ' ' HB3' ' A' ' 246' ' ' ASP . 81.4 mmm -58.57 -35.18 71.97 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 112.763 0.653 . . . . 10.0 112.763 -179.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . 0.473 ' O ' ' HG3' ' A' ' 248' ' ' GLU . 51.1 m -62.07 -38.02 87.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.168 0.508 . . . . 10.0 109.762 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -84.15 -40.43 18.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.004 -0.543 . . . . 10.0 109.539 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . 0.42 ' HB3' ' HA ' ' A' ' 243' ' ' MET . 12.8 t70 -56.61 -51.58 68.13 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.068 179.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 52.8 mt -60.02 -41.72 92.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.928 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . 0.473 ' HG3' ' O ' ' A' ' 244' ' ' SER . 7.3 mt-10 -66.67 -49.22 66.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.623 -0.262 . . . . 10.0 110.882 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.04 -43.47 98.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.017 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . 0.583 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 41.9 t -67.25 -46.95 82.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.577 0 CA-C-N 116.429 -0.35 . . . . 10.0 111.323 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . 0.452 ' O ' HG12 ' A' ' 254' ' ' VAL . 53.6 mttm -68.15 -47.46 68.01 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.449 0.537 . . . . 10.0 112.449 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.53 -29.95 71.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.553 0.216 . . . . 10.0 111.285 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -92.8 -26.8 17.54 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 121.142 -0.223 . . . . 10.0 111.563 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.583 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 1.1 p -64.0 -28.5 45.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.573 0.225 . . . . 10.0 110.922 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . 0.492 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 21.7 mt-30 -61.33 -62.13 6.54 Favored Pre-proline 0 CA--C 1.533 0.314 0 N-CA-C 109.487 -0.56 . . . . 10.0 109.487 178.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . 0.492 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 15.5 Cg_endo -62.44 -31.6 80.79 Favored 'Trans proline' 0 C--N 1.359 1.114 0 C-N-CA 121.633 1.555 . . . . 10.0 111.262 177.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . 0.482 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 5.5 m-30 -62.53 -53.57 52.82 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 178.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 49.1 mt -68.99 -34.3 75.07 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.763 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . 0.584 ' HA ' HE21 ' A' ' 262' ' ' GLN . 13.2 t70 -59.93 -45.19 93.4 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.976 -0.749 . . . . 10.0 108.976 178.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -63.88 -43.92 94.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.359 -0.837 . . . . 10.0 109.625 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -63.81 -39.74 94.96 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.681 179.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . 0.584 HE21 ' HA ' ' A' ' 259' ' ' ASP . 12.8 mt-30 -65.25 -40.08 93.53 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 178.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 39.1 mttp -63.73 -47.24 81.87 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.562 -0.903 . . . . 10.0 108.562 178.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.633 ' HE3' ' HB1' ' C' ' 509' ' ' ALA . 13.2 mptt -58.34 -51.33 70.25 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.543 -0.753 . . . . 10.0 109.446 178.14 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -56.06 -38.65 70.92 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.956 179.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . 0.408 HE21 ' HB3' ' A' ' 266' ' ' GLN . 0.0 OUTLIER -63.81 -45.13 91.02 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.694 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -61.31 -48.04 83.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.18 -0.464 . . . . 10.0 109.795 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . 0.496 ' OE1' ' HD2' ' C' ' 506' ' ' ARG . 1.9 mt-10 -61.49 -52.58 63.91 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.865 -0.607 . . . . 10.0 111.075 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 89.4 mmm -62.13 -47.7 83.43 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.549 0.574 . . . . 10.0 112.549 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -59.71 -44.78 93.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.498 0.19 . . . . 10.0 110.601 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 41.4 mt -67.43 -37.33 82.87 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.843 -0.428 . . . . 10.0 109.843 178.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . 0.422 ' O ' HG23 ' A' ' 276' ' ' VAL . 2.5 m-30 -60.42 -50.52 73.25 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.571 -0.529 . . . . 10.0 109.571 178.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 273' ' ' ARG . 0.0 OUTLIER -62.06 -42.24 98.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.244 179.554 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -61.62 -23.54 66.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.458 -0.792 . . . . 10.0 110.694 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.657 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 14.8 mmtp -94.52 -40.6 9.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.673 178.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 272' ' ' TYR . 26.0 t -50.61 -44.38 25.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 O-C-N 123.175 0.297 . . . . 10.0 111.784 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . 0.477 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 1.3 mt-10 -57.18 -62.18 5.71 Favored Pre-proline 0 CA--C 1.536 0.432 0 N-CA-C 113.041 0.756 . . . . 10.0 113.041 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . 0.477 ' HD3' ' HB2' ' A' ' 277' ' ' GLU . 32.2 Cg_endo -67.03 -37.94 17.66 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 121.902 1.735 . . . . 10.0 112.344 179.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.657 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 33.7 mt -62.77 -42.45 99.69 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.624 0.249 . . . . 10.0 110.423 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . 0.496 ' O ' ' HB2' ' A' ' 284' ' ' GLN . 10.5 ttt180 -64.23 -36.46 84.15 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.14 -0.689 . . . . 10.0 109.14 178.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.56 -42.85 95.4 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.976 -0.556 . . . . 10.0 109.786 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -64.98 -46.37 81.76 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.59 -0.522 . . . . 10.0 109.59 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 89.0 mt -63.75 -40.66 97.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.119 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . 0.496 ' HB2' ' O ' ' A' ' 280' ' ' ARG . 0.5 OUTLIER -65.48 -50.35 65.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.188 179.185 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -58.78 -46.17 88.15 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.557 -0.534 . . . . 10.0 109.557 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.75 -43.93 97.03 Favored Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 111.101 -0.8 . . . . 10.0 111.101 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.3 -44.23 92.26 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 110.585 -0.154 . . . . 10.0 110.585 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 -56.0 -45.41 79.04 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.829 0.347 . . . . 10.0 110.105 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . 0.425 HE21 ' HB3' ' A' ' 289' ' ' GLN . 5.9 mt-30 -68.68 -56.82 6.89 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.692 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 37.3 mttt -55.45 -39.49 70.38 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.203 -0.453 . . . . 10.0 112.131 -179.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . 0.597 ' O ' ' HG3' ' A' ' 295' ' ' GLN . 39.4 mt -69.88 -43.51 71.69 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.889 -0.411 . . . . 10.0 109.889 178.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . 0.477 ' O ' ' HG3' ' A' ' 296' ' ' GLU . 53.5 t60 -65.9 -39.07 90.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.123 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -61.54 -39.38 90.84 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.739 -0.837 . . . . 10.0 108.739 178.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 59.0 mt -69.06 -38.13 78.92 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.218 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . 0.597 ' HG3' ' O ' ' A' ' 291' ' ' LEU . 55.7 mt-30 -60.69 -41.47 95.22 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.169 0.509 . . . . 10.0 109.906 178.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 292' ' ' HIS . 31.7 mt-10 -71.5 -4.68 28.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.269 -0.878 . . . . 10.0 111.276 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 297' ' ' LYS . 9.4 mmtp -111.2 -43.2 3.77 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 178.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 87.8 mt -60.76 -32.16 71.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.021 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . 0.503 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 13.1 m -69.36 -63.46 2.03 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 112.052 0.39 . . . . 10.0 112.052 179.502 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . 0.503 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 43.3 Cg_endo -68.03 -46.81 2.08 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 121.902 1.734 . . . . 10.0 112.942 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.487 HD13 ' HG2' ' C' ' 473' ' ' LYS . 89.5 mt -67.64 -32.6 73.41 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.645 -0.502 . . . . 10.0 109.645 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -69.45 -46.47 55.72 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 109.681 -1.368 . . . . 10.0 109.681 178.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -60.15 -42.34 94.69 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -62.36 -44.06 97.36 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.959 178.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 4.1 tpt -64.83 -37.83 88.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.316 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . 0.483 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 47.5 mtt180 -69.31 -38.1 78.09 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 178.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . 0.516 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 38.1 t70 -65.73 -45.34 83.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.762 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . 0.591 ' HG3' ' CD2' ' C' ' 469' ' ' LEU . 13.9 mmt180 -68.45 -28.41 67.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.654 -0.703 . . . . 10.0 109.386 178.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . 0.531 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -67.47 -34.28 76.84 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.692 -0.855 . . . . 10.0 108.692 177.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . 0.516 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 74.4 mtt180 -60.83 -49.54 77.08 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 108.432 -0.951 . . . . 10.0 108.432 177.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -66.62 -39.85 88.5 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.69 178.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . 0.531 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.2 OUTLIER -54.29 -54.72 36.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.596 -0.729 . . . . 10.0 110.031 178.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 61.7 t -73.05 -38.21 55.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.534 -0.757 . . . . 10.0 111.968 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -58.88 -53.18 61.26 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 110.392 -0.225 . . . . 10.0 110.392 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -60.97 -31.04 70.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.289 0.566 . . . . 10.0 109.918 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 316' ' ' LEU . 13.6 mt -71.42 -40.91 70.14 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.732 178.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 84.9 mtt180 -64.22 -43.64 94.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.604 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 2.8 m -65.07 -15.53 62.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.616 179.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 12.0 m80 -101.14 -39.76 7.52 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.22 -0.445 . . . . 10.0 110.322 178.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 47.5 mt -60.96 -40.03 91.8 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.593 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.62 -60.59 8.82 Favored Pre-proline 0 CA--C 1.535 0.381 0 O-C-N 123.135 0.272 . . . . 10.0 111.309 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -66.71 -36.3 25.15 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 121.337 1.358 . . . . 10.0 111.517 178.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 -58.68 -48.74 80.06 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.638 0.256 . . . . 10.0 111.035 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . 0.449 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 49.7 p -67.59 -38.62 84.27 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . 0.741 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 7.6 t0 -63.52 -40.93 98.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.194 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -64.36 -40.9 96.76 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 108.276 -1.009 . . . . 10.0 108.276 177.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 68.7 mt -63.25 -33.74 76.14 Favored 'General case' 0 C--O 1.221 -0.412 0 CA-C-N 115.386 -0.824 . . . . 10.0 109.604 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . 0.741 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 75.8 mtt180 -62.59 -42.49 99.6 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -70.43 -47.51 60.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.942 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . 0.528 ' O ' ' HG2' ' A' ' 334' ' ' ARG . 4.3 ttm180 -61.55 -48.98 78.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.051 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 49.3 mt -62.35 -34.67 77.11 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 116.539 -0.301 . . . . 10.0 110.477 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.9 -47.26 85.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -63.76 -43.23 97.03 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.03 178.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . 0.657 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 3.6 mmt85 -58.97 -52.06 67.38 Favored 'General case' 0 C--O 1.227 -0.108 0 N-CA-C 109.425 -0.583 . . . . 10.0 109.425 178.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 58.1 mt -63.82 -37.38 87.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.36 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -61.5 -45.14 95.49 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.268 -0.271 . . . . 10.0 110.268 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.17 -39.68 86.48 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 82.2 mt -67.53 -19.56 65.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.579 -0.737 . . . . 10.0 111.084 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 33.9 mtpt -91.47 -46.38 8.02 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.633 -0.506 . . . . 10.0 109.633 178.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -58.8 -53.38 59.05 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.983 -0.747 . . . . 10.0 108.983 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . 0.407 ' OD1' ' HB3' ' C' ' 432' ' ' LYS . 66.5 m-20 -76.17 -23.6 54.73 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.477 178.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -66.71 -46.09 78.55 Favored Glycine 0 CA--C 1.507 -0.455 0 N-CA-C 111.308 -0.717 . . . . 10.0 111.308 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.95 -38.38 95.95 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 110.113 -1.195 . . . . 10.0 110.113 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.13 -43.13 92.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.072 -0.714 . . . . 10.0 109.072 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . 0.539 ' HD3' ' OE2' ' C' ' 433' ' ' GLU . 19.2 mtm180 -60.19 -49.96 75.57 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.074 178.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 94.8 mt -60.03 -44.39 94.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.42 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.72 -48.16 80.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.032 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . 0.431 ' HB3' ' NZ ' ' A' ' 352' ' ' LYS . 4.7 mt-10 -62.03 -36.6 82.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.295 179.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -66.97 -38.66 86.48 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.543 -0.54 . . . . 10.0 109.543 178.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 34.5 m-70 -66.02 -39.5 90.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 10.0 109.975 178.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -63.88 -47.12 81.91 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.127 -0.694 . . . . 10.0 109.127 178.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . 0.456 ' NZ ' ' HB3' ' C' ' 425' ' ' GLU . 27.7 mttp -66.85 -33.28 75.26 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.762 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.11 -44.61 79.52 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 56.8 m -61.13 -47.32 86.8 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -61.59 -44.53 96.83 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.905 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . 0.448 ' HB2' ' O ' ' A' ' 352' ' ' LYS . 0.1 OUTLIER -58.35 -48.28 81.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.154 179.359 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 62.7 mt -61.11 -35.57 77.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.574 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 19.2 m -63.9 -51.98 62.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.015 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.36 -30.88 71.76 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.087 0.47 . . . . 10.0 110.098 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 19.4 mt -68.23 -35.4 77.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.423 178.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 26.6 p -67.22 -27.73 67.48 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.561 -0.533 . . . . 10.0 109.561 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -77.23 -0.85 26.8 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 115.613 -0.722 . . . . 10.0 110.068 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.567 ' HG2' HG22 ' C' ' 411' ' ' THR . 89.7 mttt -116.78 -42.33 2.98 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.396 -0.82 . . . . 10.0 108.823 178.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -63.29 -21.14 66.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.538 -0.756 . . . . 10.0 111.573 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.969 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 94.2 mttt -104.98 -69.24 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.457 0 N-CA-C 112.172 0.434 . . . . 10.0 112.172 179.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.969 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 23.1 Cg_exo -66.28 -50.33 1.51 Allowed 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.502 2.134 . . . . 10.0 113.319 -178.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -64.62 -43.37 93.95 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.678 0.275 . . . . 10.0 111.74 -179.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . 0.465 HD23 ' HA ' ' A' ' 368' ' ' LEU . 13.8 mt -67.11 -35.99 80.96 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.763 -0.375 . . . . 10.0 110.278 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . 0.687 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 5.8 tt0 -66.11 -38.2 87.61 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.527 -0.916 . . . . 10.0 108.527 178.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.04 -43.06 96.69 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 178.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . 0.449 HD12 HD23 ' A' ' 368' ' ' LEU . 19.0 mt -62.28 -45.58 92.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.601 -0.727 . . . . 10.0 110.638 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 372' ' ' ARG . 17.9 mtt180 -67.53 -37.84 83.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.943 0.402 . . . . 10.0 109.941 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.687 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.7 mt-30 -67.27 -16.92 64.56 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 115.569 -0.741 . . . . 20.0 111.34 178.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -96.3 -40.36 3.99 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 108.746 -1.742 . . . . 10.0 108.746 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 62.4 mt -58.24 -36.84 73.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.66 -0.27 . . . . 10.0 111.672 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . 0.42 ' O ' ' HG2' ' A' ' 380' ' ' GLU . 96.1 mt -59.65 -63.8 3.78 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 120.925 -0.31 . . . . 10.0 111.364 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . 0.416 ' CD ' ' HB2' ' A' ' 376' ' ' LEU . 19.7 Cg_endo -61.83 -35.14 80.3 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 121.994 1.796 . . . . 10.0 111.676 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 6.1 t -61.26 -49.5 84.33 Favored 'Isoleucine or valine' 0 C--O 1.231 0.108 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 178.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 34.3 mt -63.06 -33.66 75.92 Favored 'General case' 0 C--O 1.224 -0.255 0 N-CA-C 109.759 -0.459 . . . . 10.0 109.759 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . 0.442 ' O ' HG23 ' A' ' 384' ' ' VAL . 6.0 mm-40 -61.51 -55.51 30.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.017 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.3 p -63.37 -35.45 80.44 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.006 0.432 . . . . 10.0 110.136 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.9 m-30 -63.76 -47.33 81.39 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.144 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -57.8 -40.5 80.07 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 380' ' ' GLU . 68.8 t -58.09 -50.82 76.86 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.103 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.844 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -66.45 -34.63 78.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.731 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . 0.535 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 22.0 m-30 -69.34 -45.58 69.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.904 0.383 . . . . 10.0 110.109 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.45 -38.02 89.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.223 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . 0.573 ' HB2' ' HD3' ' C' ' 594' ' ' LYS . 3.4 p -74.71 -31.89 61.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.8 0.333 . . . . 10.0 110.906 179.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -71.16 -34.89 71.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.367 179.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 87.3 mt -59.37 -37.19 77.28 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.256 179.248 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -64.43 -45.3 88.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.469 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -61.12 -49.95 75.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.518 -0.765 . . . . 10.0 111.609 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -57.4 -43.87 84.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.708 0.29 . . . . 10.0 111.228 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 27.5 m -63.98 -50.26 69.28 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.277 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.864 -179.47 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 92.7 mt . . . . . 0 CA--C 1.522 -0.1 0 CA-C-O 120.995 0.426 . . . . 10.0 110.277 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 85.2 mt -71.67 -31.51 66.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.395 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -67.32 -45.98 74.85 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.892 -0.781 . . . . 10.0 108.892 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -64.31 -40.32 95.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.439 178.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -35.85 79.6 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.328 179.132 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -60.55 -49.18 78.59 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.008 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 1.1 m -59.27 -42.14 90.51 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.936 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . 0.431 ' O ' ' HB2' ' C' ' 412' ' ' PHE . 70.8 t -64.41 -44.22 97.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.316 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 30.0 m -62.4 -45.99 90.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.396 -0.366 . . . . 10.0 110.496 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 25.2 m -63.17 -45.55 91.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.467 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . 0.567 HG22 ' HG2' ' A' ' 363' ' ' LYS . 12.8 p -67.14 -36.94 82.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.698 0.285 . . . . 10.0 111.11 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . 0.431 ' HB2' ' O ' ' C' ' 408' ' ' VAL . 2.7 t80 -67.87 -39.72 83.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.994 179.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 47.4 m -64.34 -43.28 95.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.307 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -66.14 -32.42 73.86 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.245 0.545 . . . . 10.0 109.969 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . 0.403 ' O ' ' HG ' ' C' ' 419' ' ' LEU . 7.7 mt -65.62 -44.24 87.1 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.067 -0.716 . . . . 10.0 109.067 177.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . 0.517 ' HA ' HD12 ' C' ' 419' ' ' LEU . 98.6 mtt180 -65.6 -34.3 77.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.259 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . 0.458 ' O ' ' HD2' ' C' ' 421' ' ' PRO . 42.2 mt-10 -65.58 -40.69 93.04 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -67.56 -33.91 75.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.862 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' C' ' 416' ' ' ARG . 85.7 mt -62.11 -12.84 21.58 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-N 115.722 -0.672 . . . . 10.0 111.867 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -74.32 -75.72 0.76 Allowed Glycine 0 CA--C 1.522 0.509 0 C-N-CA 120.494 -0.86 . . . . 10.0 111.058 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . 0.458 ' HD2' ' O ' ' C' ' 417' ' ' GLU . 16.2 Cg_endo -58.33 -39.6 82.82 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 123.12 2.547 . . . . 10.0 112.612 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 49.0 t -59.89 -43.12 91.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 87.8 m -68.44 -39.19 81.59 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.823 -0.436 . . . . 10.0 109.823 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -61.1 -48.31 82.27 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . 0.456 ' HB3' ' NZ ' ' A' ' 352' ' ' LYS . 69.1 mt-10 -62.69 -47.72 82.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.36 -0.837 . . . . 10.0 109.783 178.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -57.59 -41.12 80.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.3 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -67.84 -42.36 81.55 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.175 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . 0.489 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 3.9 t70 -63.59 -37.75 88.5 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.321 -0.622 . . . . 10.0 109.321 179.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -67.84 -43.39 79.62 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.486 -0.779 . . . . 10.0 108.96 178.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 30.5 mt -61.28 -36.57 80.42 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.915 -0.584 . . . . 10.0 109.74 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -67.4 -33.87 76.08 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.241 178.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 56.9 mttp -67.59 -47.78 68.75 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.028 -1.101 . . . . 10.0 108.028 177.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . 0.539 ' OE2' ' HD3' ' A' ' 345' ' ' ARG . 42.3 mt-10 -59.72 -47.6 85.01 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 114.951 -1.022 . . . . 10.0 111.106 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 2.8 p -63.41 -37.37 87.02 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.599 0.238 . . . . 10.0 110.825 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -62.98 -49.51 74.41 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.753 -0.832 . . . . 10.0 108.753 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.48 -46.38 93.94 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.885 -0.886 . . . . 10.0 110.885 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 59.2 mt -59.27 -34.12 71.88 Favored 'General case' 0 C--O 1.222 -0.385 0 CA-C-O 120.503 0.192 . . . . 10.0 110.564 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 52.3 mtt85 -69.24 -36.49 77.23 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 178.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -72.11 -33.02 67.51 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.997 -0.742 . . . . 10.0 108.997 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . 0.657 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 47.2 mt-10 -71.06 -53.39 14.86 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.182 -0.917 . . . . 10.0 109.197 178.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . 0.564 ' HA ' ' HB3' ' C' ' 444' ' ' ASP . 64.1 mtt -65.58 -29.16 69.73 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.616 0.969 . . . . 10.0 113.616 -178.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 1.8 p -61.17 -47.46 86.08 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.018 -0.673 . . . . 10.0 109.442 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -78.07 -39.61 41.11 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.954 -0.567 . . . . 10.0 109.855 178.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . 0.564 ' HB3' ' HA ' ' C' ' 441' ' ' MET . 11.8 t70 -56.04 -60.32 3.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.095 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 96.0 mt -60.31 -41.97 94.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.954 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.91 -39.79 90.89 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.851 -0.339 . . . . 10.0 110.91 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.67 -38.08 80.11 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.739 -0.838 . . . . 10.0 108.739 178.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 8.9 t -58.98 -43.42 88.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.292 0 CA-C-N 115.753 -0.658 . . . . 10.0 109.232 178.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -65.97 -40.77 91.54 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 178.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -74.48 -3.97 33.93 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.491 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . 0.677 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 4.1 mttp -106.34 -42.94 4.91 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.412 178.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 31.3 t -61.77 -41.47 90.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.678 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . 0.671 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 26.1 mt-30 -55.41 -60.48 8.27 Favored Pre-proline 0 CA--C 1.536 0.433 0 O-C-N 123.164 0.29 . . . . 10.0 111.461 179.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . 0.671 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 21.4 Cg_exo -67.74 -26.46 38.93 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 122.106 1.871 . . . . 10.0 111.334 178.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . 0.677 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.1 OUTLIER -64.23 -53.11 54.33 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 179.284 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 68.1 mt -66.31 -38.3 87.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.729 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . 0.449 ' HB3' ' HA ' ' C' ' 454' ' ' PRO . 1.5 t70 -59.57 -44.9 93.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.327 178.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . 0.518 ' HA ' ' HZ2' ' C' ' 461' ' ' LYS . 2.8 t70 -78.96 -33.6 45.09 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.917 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . 0.453 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 0.1 OUTLIER -62.85 -43.4 98.91 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 178.666 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -63.66 -42.18 98.11 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 123.368 0.417 . . . . 10.0 110.051 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . 0.518 ' HZ2' ' HA ' ' C' ' 458' ' ' ASP . 4.3 mttp -58.8 -43.09 90.42 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.213 0.53 . . . . 10.0 109.621 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -72.72 -40.6 65.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.306 -0.861 . . . . 10.0 110.436 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 1.2 m95 -62.49 -38.81 91.35 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.337 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -67.72 -42.97 81.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.161 178.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 0.595 ' HB3' HD11 ' C' ' 469' ' ' LEU . 38.7 mt-10 -62.61 -35.53 79.85 Favored 'General case' 0 C--N 1.333 -0.117 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 178.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -76.73 -48.21 19.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.148 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 9.8 ttt -61.4 -57.06 13.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.001 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -65.56 -38.67 90.25 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.252 -0.647 . . . . 10.0 109.252 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 0.595 HD11 ' HB3' ' C' ' 465' ' ' GLU . 96.4 mt -59.34 -36.27 75.39 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.358 -0.837 . . . . 20.0 109.925 178.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -77.19 -39.38 48.99 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.62 178.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -60.98 -38.65 86.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.996 0.427 . . . . 10.0 110.189 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -81.4 6.74 13.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.536 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . 0.487 ' HG2' HD13 ' A' ' 301' ' ' LEU . 51.3 mttp -123.0 -50.29 1.93 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.277 178.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 78.0 t -61.12 -36.89 75.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.691 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.28 -59.49 10.84 Favored Pre-proline 0 CA--C 1.534 0.327 0 N-CA-C 111.758 0.281 . . . . 10.0 111.758 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -60.96 -37.39 77.24 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 121.584 1.523 . . . . 10.0 111.051 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 38.5 mt -67.06 -33.85 76.4 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.006 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 24.9 mtt180 -63.55 -38.61 91.78 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 178.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -64.98 -45.76 84.27 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 178.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.68 -44.18 94.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.716 178.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 63.3 mt -65.92 -41.82 90.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.922 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -63.72 -49.68 72.11 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -65.06 -42.13 94.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.928 0.394 . . . . 10.0 110.278 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.54 -36.42 93.33 Favored Glycine 0 N--CA 1.447 -0.615 0 N-CA-C 111.011 -0.835 . . . . 10.0 111.011 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . 0.441 ' O ' ' HG ' ' C' ' 489' ' ' LEU . . . -76.12 -39.84 54.19 Favored 'General case' 0 C--O 1.219 -0.511 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 63.2 mtt180 -61.89 -43.78 98.16 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.978 -0.749 . . . . 10.0 108.978 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -65.74 -40.06 91.76 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 108.812 -0.81 . . . . 10.0 108.812 178.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -65.77 -34.81 79.04 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 109.614 -0.514 . . . . 10.0 109.614 178.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' C' ' 485' ' ' ALA . 57.9 mt -65.48 -41.44 93.29 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.728 -0.841 . . . . 10.0 108.728 178.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -68.55 -40.44 80.65 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.722 -0.844 . . . . 10.0 108.722 178.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -60.29 -44.26 95.52 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 108.521 -0.918 . . . . 10.0 108.521 177.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 46.7 mt -69.87 -33.06 71.73 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.854 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -61.09 -40.14 92.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.924 0.393 . . . . 10.0 110.56 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -79.57 11.66 2.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.586 0.708 . . . . 10.0 110.36 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.58 ' O ' ' HB2' ' C' ' 499' ' ' LEU . 54.7 mttp -125.59 -57.6 1.45 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.628 -0.715 . . . . 10.0 109.806 178.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 90.2 mt -60.71 -35.22 75.77 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.443 0.534 . . . . 10.0 112.443 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . 0.812 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 6.8 m -76.13 -62.84 0.67 Allowed Pre-proline 0 CA--C 1.538 0.517 0 C-N-CA 121.052 -0.259 . . . . 10.0 111.457 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . 0.812 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 52.1 Cg_exo -58.73 -54.54 2.76 Favored 'Trans proline' 0 C--N 1.357 1.015 0 C-N-CA 122.077 1.851 . . . . 10.0 111.787 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . 0.58 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 48.1 mt -65.92 -27.58 68.3 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 109.926 -0.398 . . . . 10.0 109.926 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -65.86 -47.12 77.89 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 110.127 -1.189 . . . . 10.0 110.127 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -64.8 -39.46 93.62 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.879 -0.785 . . . . 10.0 108.879 178.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -61.72 -52.39 64.46 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.64 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 88.0 mmm -58.87 -38.16 78.15 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.359 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -63.79 -45.57 89.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.853 0.359 . . . . 10.0 110.262 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . 0.441 ' O ' ' HB3' ' C' ' 508' ' ' ARG . 26.0 t70 -68.17 -45.52 73.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.696 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.496 ' HD2' ' OE1' ' A' ' 268' ' ' GLU . 13.4 mtt180 -63.73 -43.1 97.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.243 179.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -65.14 -33.42 75.97 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 177.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . 0.441 ' HB3' ' O ' ' C' ' 505' ' ' ASP . 37.5 ttm180 -62.94 -43.92 97.48 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 108.685 -0.858 . . . . 10.0 108.685 178.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . 0.633 ' HB1' ' HE3' ' A' ' 264' ' ' LYS . . . -65.74 -33.45 75.9 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.657 -0.702 . . . . 10.0 109.36 178.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . 0.543 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 6.2 m-70 -66.76 -51.12 59.55 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.103 -0.703 . . . . 10.0 109.103 178.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . 0.418 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 95.9 t -64.25 -42.33 95.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.659 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.52 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 34.9 t70 -61.95 -39.01 90.64 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 179.059 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -64.98 -40.22 94.65 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.332 -0.988 . . . . 10.0 108.332 177.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 87.6 mt -62.29 -29.71 70.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.472 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . 0.52 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 75.5 mtt180 -66.11 -30.68 71.22 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.396 -0.594 . . . . 10.0 109.396 178.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.4 10.94 33.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.605 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . 0.468 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 42.6 m170 -122.82 -49.64 1.98 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.332 -0.395 . . . . 10.0 111.435 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 89.8 mt -86.62 -42.77 13.18 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . 0.425 ' N ' ' HD2' ' C' ' 520' ' ' PRO . . . -56.18 -56.3 32.66 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 111.793 0.294 . . . . 10.0 111.793 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . 0.425 ' HD2' ' N ' ' C' ' 519' ' ' ALA . 25.6 Cg_endo -62.99 -29.89 76.05 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 121.857 1.704 . . . . 10.0 110.627 178.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . 0.407 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 0.0 OUTLIER -64.28 -39.63 94.32 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.886 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 15.8 m -62.52 -40.56 97.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.669 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . 0.479 ' O ' ' HG3' ' C' ' 527' ' ' GLN . 0.3 OUTLIER -65.68 -47.58 74.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.392 179.328 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -65.01 -37.08 86.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.615 -0.72 . . . . 10.0 110.804 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 23.8 mt -64.11 -38.41 90.95 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.117 -0.698 . . . . 10.0 109.117 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 50.6 mtt85 -62.94 -37.5 87.28 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.069 178.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' C' ' 523' ' ' ASP . 18.8 mt-30 -59.87 -42.92 94.78 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 179.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . 0.42 ' HB3' ' OE1' ' A' ' 242' ' ' GLU . 10.0 mtt180 -74.0 -44.44 54.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.103 179.268 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 68.0 mt -58.38 -38.82 78.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.031 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . 0.469 ' O ' ' HG2' ' C' ' 534' ' ' GLU . . . -62.6 -40.15 96.03 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.407 -0.361 . . . . 10.0 110.331 179.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.75 -41.33 79.08 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.127 -0.694 . . . . 10.0 109.127 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . 0.438 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 19.1 ttm180 -60.18 -42.29 94.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.357 -0.838 . . . . 10.0 109.108 178.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.68 -32.39 73.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.626 -0.716 . . . . 10.0 110.48 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' C' ' 538' ' ' GLU . 9.6 mm-40 -67.38 -44.65 78.39 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.57 -39.67 94.98 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.226 178.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 93.8 mt -68.7 -22.73 64.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.748 179.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -83.15 -47.25 11.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.289 -0.414 . . . . 10.0 109.972 179.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' C' ' 534' ' ' GLU . 9.3 mm-40 -64.69 -53.73 42.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.184 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -68.13 -43.28 78.72 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.311 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -58.49 -51.12 60.66 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.964 -0.636 . . . . 10.0 111.821 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.43 -41.88 99.74 Favored Glycine 0 N--CA 1.451 -0.361 0 N-CA-C 111.677 -0.569 . . . . 10.0 111.677 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -64.14 -50.35 68.56 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.982 -0.377 . . . . 10.0 109.982 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . 0.455 HH11 ' HD2' ' C' ' 543' ' ' ARG . 50.9 mtt180 -58.3 -35.55 72.0 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.624 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 33.2 mt -62.19 -47.09 86.03 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.696 -0.483 . . . . 10.0 109.696 178.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -64.45 -39.53 93.99 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.89 -0.596 . . . . 10.0 109.635 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 78.9 mt-10 -65.46 -47.69 75.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.777 178.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 15.7 m-30 -60.03 -40.86 90.8 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.323 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 29.8 m-70 -62.63 -46.14 89.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.827 0.346 . . . . 10.0 110.378 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.06 -47.5 77.11 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.354 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.39 -32.24 73.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.636 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.22 -37.1 80.5 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 23.1 m -66.2 -47.44 73.87 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.398 -0.964 . . . . 10.0 108.398 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -61.85 -33.98 75.16 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.717 -0.674 . . . . 10.0 109.521 178.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -74.0 -33.62 63.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.141 179.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 44.0 mt -69.34 -44.02 72.47 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.78 -0.452 . . . . 10.0 109.78 178.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 10.1 m -61.97 -40.73 96.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.471 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . 0.534 ' HA ' ' HG2' ' C' ' 560' ' ' GLU . 4.6 p -72.87 -17.57 61.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.247 0.546 . . . . 10.0 110.526 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' C' ' 558' ' ' LEU . 15.6 mt -87.09 -40.2 14.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.858 -0.61 . . . . 10.0 109.513 178.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.5 p -67.26 -28.03 67.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.217 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . 0.534 ' HG2' ' HA ' ' C' ' 557' ' ' THR . 2.7 pt-20 -72.75 -5.49 38.16 Favored 'General case' 0 C--N 1.339 0.12 0 CA-C-O 121.405 0.621 . . . . 10.0 110.106 178.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . 0.564 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 12.4 mptt -116.79 -39.3 3.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.241 177.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -65.87 -16.58 63.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.856 -0.611 . . . . 10.0 111.179 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . 0.944 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 95.9 mttt -103.59 -70.29 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.409 0 CA-C-O 119.311 -0.376 . . . . 10.0 111.199 178.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . 0.944 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 26.2 Cg_exo -64.04 -49.75 3.58 Favored 'Trans proline' 0 C--N 1.36 1.154 0 C-N-CA 122.405 2.07 . . . . 10.0 113.263 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -64.58 -38.95 92.78 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 121.14 -0.224 . . . . 10.0 111.54 -179.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' C' ' 566' ' ' LEU . 7.1 mt -66.64 -38.62 87.26 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.29 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -66.63 -36.87 83.62 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 178.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.62 -47.28 84.45 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.742 -0.836 . . . . 10.0 108.742 177.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . 0.447 HD12 HD23 ' C' ' 566' ' ' LEU . 89.4 mt -61.59 -40.89 96.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.455 178.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . 0.429 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 65.6 mtt180 -65.62 -46.93 77.41 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.015 -0.365 . . . . 10.0 110.015 178.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . 0.532 ' HA ' HD12 ' C' ' 574' ' ' LEU . 98.5 mt-30 -65.86 -22.74 66.55 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 115.788 -0.642 . . . . 20.0 111.983 179.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -86.15 -40.09 7.64 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 109.189 -1.564 . . . . 10.0 109.189 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 29.8 mt -64.88 -32.13 73.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.579 -0.31 . . . . 10.0 111.624 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . 0.532 HD12 ' HA ' ' C' ' 571' ' ' GLN . 35.7 mt -54.35 -62.28 4.22 Favored Pre-proline 0 CA--C 1.54 0.581 0 N-CA-C 112.357 0.502 . . . . 10.0 112.357 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -66.05 -31.09 46.72 Favored 'Trans proline' 0 C--N 1.357 0.974 0 C-N-CA 121.966 1.777 . . . . 10.0 111.001 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 11.6 t -64.65 -46.37 92.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.058 -0.519 . . . . 10.0 109.828 179.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 46.3 mt -64.71 -38.6 91.54 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . 0.46 ' O ' HG23 ' C' ' 582' ' ' VAL . 28.7 mt-10 -60.17 -50.84 72.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.55 178.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 2.7 p -68.27 -38.13 81.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.678 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -60.21 -44.44 95.14 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.246 178.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . 0.462 ' O ' ' HG ' ' C' ' 585' ' ' LEU . 68.5 mttm -62.1 -36.89 83.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.654 178.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . 0.46 HG23 ' O ' ' C' ' 578' ' ' GLU . 53.2 t -62.29 -46.3 96.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 178.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.63 -34.29 77.88 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.352 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -69.38 -44.44 71.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.287 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' C' ' 581' ' ' LYS . 88.0 mt -57.29 -47.2 82.06 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.538 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 1.9 p -68.81 -46.15 69.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.613 179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -57.8 -54.0 51.88 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.441 -0.345 . . . . 10.0 111.743 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 88.9 mt -57.66 -41.06 80.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.804 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -71.4 -51.59 23.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.583 -0.28 . . . . 10.0 111.725 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -62.24 -40.69 97.0 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.944 0.35 . . . . 10.0 111.944 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . 0.477 ' O ' ' HG ' ' C' ' 595' ' ' LEU . 8.7 m-85 -64.46 -48.74 74.14 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.919 0.34 . . . . 10.0 111.919 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 11.8 p -63.18 -36.48 83.76 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 111.949 0.352 . . . . 10.0 111.949 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -63.8 -28.55 69.94 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.453 -0.34 . . . . 10.0 111.092 179.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . 0.573 ' HD3' ' HB2' ' A' ' 388' ' ' SER . 96.4 mttt -95.15 -15.49 23.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.428 -0.351 . . . . 10.0 111.504 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' C' ' 591' ' ' TYR . 60.9 mt -80.19 -25.07 39.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.293 -0.412 . . . . 10.0 111.381 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.793 -0.623 . . . . 10.0 109.759 179.989 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 121.027 0.441 . . . . 10.0 111.317 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . 0.438 ' HG2' ' HB2' ' B' ' 52' ' ' LEU . 9.3 mt-10 -115.32 130.61 56.95 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.047 -0.723 . . . . 10.0 109.047 178.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -122.26 136.38 54.89 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.851 0.357 . . . . 10.0 110.91 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.525 ' HD3' ' HB2' ' B' ' 54' ' ' ASP . 27.1 mmtt -107.52 114.37 28.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.372 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.48 HD22 HD23 ' B' ' 159' ' ' LEU . 14.2 mt -109.47 132.1 54.45 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.389 -179.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.429 HG22 ' HB3' ' B' ' 56' ' ' LEU . 67.2 t -121.44 125.92 74.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.965 0.412 . . . . 10.0 110.916 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 3.6 t -93.19 113.14 27.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.555 HG21 HD11 ' B' ' 100' ' ' ILE . 20.9 m -96.72 168.43 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.993 0.425 . . . . 10.0 111.801 -179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . 0.483 ' HA2' ' CZ ' ' B' ' 96' ' ' TYR . . . 131.65 161.0 9.99 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 110.873 -0.891 . . . . 10.0 110.873 -179.463 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.12 -140.55 0.07 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.891 0.376 . . . . 10.0 110.89 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -101.69 159.51 18.33 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.69 -0.767 . . . . 10.0 111.684 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.97 -24.54 15.13 Favored Glycine 0 CA--C 1.519 0.311 0 C-N-CA 121.048 -0.596 . . . . 10.0 113.004 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . 0.447 HG23 ' HG3' ' B' ' 16' ' ' LYS . 3.3 m -60.65 -50.74 79.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 112.317 0.488 . . . . 10.0 112.317 -179.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 105.23 35.84 3.04 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.783 -0.722 . . . . 10.0 113.351 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . 0.447 ' HG3' HG23 ' B' ' 14' ' ' VAL . 50.6 mtmt -59.49 -54.06 50.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.166 0.508 . . . . 10.0 111.255 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.62 -37.65 76.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.593 -0.731 . . . . 10.0 111.863 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.72 -44.79 92.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.339 -0.392 . . . . 10.0 110.997 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 99.1 mt -66.98 -33.26 75.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.055 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . 0.4 ' O ' HG12 ' B' ' 24' ' ' ILE . 7.1 m -71.15 -49.55 42.81 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.991 -0.549 . . . . 10.0 111.357 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 85.2 mt -63.31 -29.97 48.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.184 0.516 . . . . 10.0 110.43 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.597 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 6.3 tp-100 -66.75 -16.78 64.49 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.623 -0.717 . . . . 10.0 111.107 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 18.7 tp -106.5 -31.45 8.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.07 0.462 . . . . 10.0 110.901 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . 0.4 HG12 ' O ' ' B' ' 20' ' ' THR . 51.1 mm -76.04 -49.6 25.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.704 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -115.35 -8.97 12.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.764 0.316 . . . . 10.0 111.201 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.597 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 20.8 m120 65.83 41.53 3.8 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.317 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -133.75 142.79 48.09 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.018 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -99.97 137.23 38.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.491 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 19.1 m -89.87 159.55 2.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.906 0.384 . . . . 10.0 111.558 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -121.73 -19.92 6.63 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.351 0.596 . . . . 10.0 110.256 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -93.47 156.9 16.49 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.271 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -86.28 104.83 16.18 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 110.111 -0.329 . . . . 10.0 110.111 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 31.9 t70 -77.54 115.77 52.43 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.757 179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 3.8 Cg_exo -78.31 62.59 8.16 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 123.24 2.626 . . . . 10.0 110.47 179.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . 0.513 HG22 ' HA ' ' B' ' 59' ' ' ALA . 0.8 OUTLIER -61.01 130.97 49.08 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.291 -0.868 . . . . 10.0 112.118 -179.628 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.438 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 74.3 mt -121.42 -53.12 3.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.106 -0.952 . . . . 10.0 108.566 178.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.28 104.79 3.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.514 -0.767 . . . . 10.0 109.345 179.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -159.0 137.5 10.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.423 -0.353 . . . . 10.0 111.269 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 15.4 m -135.76 149.63 49.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.812 0.339 . . . . 10.0 111.137 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -126.07 142.31 51.57 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . 0.528 ' HD3' ' OD2' ' B' ' 54' ' ' ASP . 30.2 ttp180 -129.06 133.05 47.54 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 111.838 0.31 . . . . 10.0 111.838 -178.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 30.1 mtpt -143.56 175.0 10.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.872 -0.604 . . . . 10.0 110.417 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -115.11 120.27 39.23 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 39.2 t -131.01 132.93 63.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.67 0.272 . . . . 10.0 110.651 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 38.9 t -78.61 111.66 15.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 108.635 -0.876 . . . . 10.0 108.635 178.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . 0.772 HD11 HD11 ' B' ' 53' ' ' LEU . 38.3 mt -114.28 117.7 56.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 120.883 0.373 . . . . 10.0 111.17 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.627 ' HB2' HH22 ' B' ' 164' ' ' ARG . 35.9 m-20 59.85 32.08 21.08 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.476 -0.783 . . . . 10.0 111.076 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.07 -29.93 7.13 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.69 -0.687 . . . . 10.0 113.004 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -84.8 146.59 27.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.906 0.384 . . . . 10.0 111.286 -179.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 14.8 t -102.86 139.19 38.75 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.899 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 3.0 p -154.12 158.45 40.44 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.316 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.438 ' HB2' ' HG2' ' B' ' 3' ' ' GLU . 96.6 mt -93.67 120.56 34.1 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.235 -0.654 . . . . 10.0 109.235 179.282 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.772 HD11 HD11 ' B' ' 46' ' ' ILE . 63.7 mt -105.86 124.19 49.18 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.533 0.568 . . . . 10.0 112.533 -178.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.528 ' OD2' ' HD3' ' B' ' 41' ' ' ARG . 0.5 OUTLIER -107.77 110.49 22.32 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 107.591 -1.262 . . . . 10.0 107.591 177.84 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 22.8 mt -99.94 114.92 39.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 120.836 0.35 . . . . 10.0 111.489 -178.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.429 ' HB3' HG22 ' B' ' 7' ' ' VAL . 26.4 tp -94.49 112.13 23.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.931 -0.577 . . . . 10.0 111.147 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -93.67 94.83 8.81 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 178.658 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 37.6 p -67.51 161.74 24.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.174 -0.921 . . . . 10.0 113.157 -177.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . 0.513 ' HA ' HG22 ' B' ' 35' ' ' THR . . . -65.61 165.24 12.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.578 -0.737 . . . . 10.0 111.112 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -84.28 -80.72 1.05 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.832 -0.699 . . . . 10.0 111.957 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -92.35 114.42 26.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.841 0.353 . . . . 20.0 110.718 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -150.05 160.93 43.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.493 -0.321 . . . . 10.0 110.22 -179.546 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 55.7 mm-40 -106.45 -170.61 1.75 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.009 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -80.12 76.75 6.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.201 0.524 . . . . 10.0 111.195 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.39 147.72 23.91 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.821 179.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.29 -35.63 77.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.9 0.381 . . . . 10.0 110.997 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 27.7 ttt -62.42 -37.02 84.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.794 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.65 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 55.8 ttt85 -60.95 -51.8 67.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.815 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.05 -35.35 78.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.776 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -61.17 -41.14 96.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.595 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . 0.65 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 2.5 p90 -84.09 -24.71 30.23 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 112.837 0.68 . . . . 10.0 112.837 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 53.1 mmm -76.36 -24.56 54.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.069 0.461 . . . . 10.0 111.242 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -79.73 -0.3 33.61 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.675 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.58 2.05 44.31 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.735 0.643 . . . . 10.0 112.735 -179.2 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -107.06 152.57 16.89 Favored Glycine 0 N--CA 1.454 -0.154 0 C-N-CA 120.248 -0.977 . . . . 10.0 113.108 -179.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -99.86 -60.6 1.5 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.964 0.411 . . . . 10.0 110.19 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -99.79 139.59 14.5 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.654 -0.703 . . . . 10.0 111.993 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -125.26 131.08 53.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.925 0.393 . . . . 10.0 111.082 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.776 ' HG ' HD22 ' B' ' 159' ' ' LEU . 77.6 mt -99.88 122.46 42.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.977 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 32.5 m -95.37 86.24 4.46 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.816 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.608 ' HA ' ' HB ' ' B' ' 114' ' ' VAL . 22.0 t -87.29 122.82 39.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.243 -178.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.825 ' HB3' HD11 ' B' ' 93' ' ' ILE . 38.9 p90 -130.04 169.3 15.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.41 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -104.94 123.16 47.28 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.504 179.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 2.3 pp -68.29 -10.97 13.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 112.01 0.374 . . . . 10.0 112.01 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . 0.566 ' HB3' ' O ' ' B' ' 122' ' ' SER . 2.2 p30 -102.95 10.96 37.97 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.373 -0.376 . . . . 10.0 111.46 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -136.83 104.29 5.45 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.93 -38.21 75.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.791 -0.64 . . . . 10.0 112.008 -178.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -63.0 -39.48 94.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.702 0.287 . . . . 10.0 110.992 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 24.0 t -60.19 -37.56 80.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.969 -0.559 . . . . 10.0 110.644 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -71.21 -39.28 71.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.395 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -66.86 -33.38 75.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.003 0.43 . . . . 10.0 111.145 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.24 -8.23 53.66 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.283 0.475 . . . . 10.0 112.283 -178.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . 0.825 HD11 ' HB3' ' B' ' 82' ' ' PHE . 25.8 mm -60.84 -35.83 67.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.109 0.48 . . . . 10.0 110.04 178.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . 0.441 ' O ' ' HG2' ' B' ' 98' ' ' GLU . 6.6 t-80 -68.63 -29.95 68.55 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 179.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -68.86 -44.12 74.01 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.091 -0.707 . . . . 10.0 109.091 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . 0.483 ' CZ ' ' HA2' ' B' ' 10' ' ' GLY . 22.5 m-85 -64.41 -43.87 93.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.6 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -54.87 -51.78 64.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.268 -0.878 . . . . 10.0 111.181 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' B' ' 94' ' ' HIS . 8.6 mm-40 -66.93 -37.39 84.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.354 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . 0.475 ' O ' HG13 ' B' ' 103' ' ' VAL . 32.5 tt0 -60.35 -46.94 88.13 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.484 -0.325 . . . . 10.0 110.213 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . 0.555 HD11 HG21 ' B' ' 9' ' ' VAL . 52.6 mt -66.69 -43.34 90.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.815 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . 0.539 ' HG2' ' HA ' ' B' ' 107' ' ' GLU . 33.7 mtpt -59.0 -35.98 74.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.856 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 45.9 ttp85 -77.05 -46.38 23.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.872 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.532 HG22 ' HA ' ' B' ' 100' ' ' ILE . 21.1 m -63.39 -28.17 44.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -95.03 -11.53 28.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.53 -0.305 . . . . 10.0 111.004 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 16.9 t70 60.73 21.06 11.09 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.383 0.611 . . . . 10.0 111.099 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 14.0 m -144.74 140.38 28.49 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.268 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . 0.539 ' HA ' ' HG2' ' B' ' 101' ' ' LYS . 26.9 mp0 -84.95 -20.0 31.29 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.317 0.58 . . . . 10.0 109.849 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -89.16 78.01 7.44 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.233 -0.894 . . . . 10.0 110.322 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.416 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 89.5 t -127.07 130.63 23.73 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.529 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 24.1 Cg_exo -64.74 112.36 1.96 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.967 2.445 . . . . 10.0 111.607 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . 0.586 ' HB2' HG21 ' B' ' 139' ' ' ILE . 54.1 mtt -130.21 158.27 40.19 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.598 -0.519 . . . . 10.0 109.598 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . 0.617 ' HB ' HD23 ' B' ' 79' ' ' LEU . 84.3 t -137.31 129.72 42.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . 0.495 ' HG ' ' HE1' ' B' ' 82' ' ' PHE . 15.2 tp -82.44 117.74 22.7 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.808 -0.812 . . . . 10.0 108.808 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . 0.608 ' HB ' ' HA ' ' B' ' 81' ' ' VAL . 38.7 t -109.75 111.49 36.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 120.94 0.4 . . . . 10.0 111.984 -178.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -91.86 88.08 1.33 Allowed Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 110.375 -1.09 . . . . 10.0 110.375 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . 0.426 ' HA ' ' O ' ' B' ' 144' ' ' THR . 61.8 t30 -87.46 162.9 17.01 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 -178.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 28.3 mttm 67.72 32.84 5.2 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.242 -0.89 . . . . 10.0 111.731 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 28.0 p -85.8 6.71 26.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.288 0.566 . . . . 10.0 110.32 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.69 -21.73 26.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.987 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 82.3 mt -77.61 142.17 65.91 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.429 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.35 -19.91 55.43 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.945 2.43 . . . . 10.0 112.151 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . 0.566 ' O ' ' HB3' ' B' ' 85' ' ' ASN . 1.7 m -83.04 105.19 13.82 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 179.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -127.72 109.91 12.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.968 0.413 . . . . 10.0 111.657 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.05 -42.08 9.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.053 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 30.2 t -87.36 115.44 27.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.685 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -80.16 154.29 28.09 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.289 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . 0.488 HG23 ' HE2' ' B' ' 141' ' ' PHE . 5.9 m -60.23 -33.92 72.95 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.694 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -61.88 -37.72 85.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.061 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -68.18 -41.63 81.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.179 0.514 . . . . 10.0 110.084 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.99 -48.11 69.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.286 -0.87 . . . . 10.0 111.482 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.472 ' HG3' ' O ' ' B' ' 127' ' ' THR . 23.4 mt-30 -61.81 -38.03 86.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.956 0.408 . . . . 10.0 110.53 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -62.06 -51.5 67.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.744 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 55.6 tp -64.59 -41.77 96.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.003 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.76 -41.21 95.01 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.686 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -63.39 -40.23 96.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.41 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 12.9 m -66.03 -37.76 86.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.646 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 7.3 m-30 -73.87 -29.63 62.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.701 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 88.71 28.39 21.7 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 110.643 -0.983 . . . . 10.0 110.643 -178.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . 0.586 HG21 ' HB2' ' B' ' 111' ' ' MET . 46.0 pt -126.41 154.55 74.95 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.439 -0.38 . . . . 10.0 110.461 -179.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.21 157.05 29.85 Favored 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.448 2.098 . . . . 10.0 111.756 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.488 ' HE2' HG23 ' B' ' 127' ' ' THR . 37.9 t80 -119.57 126.89 52.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.606 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 36.6 mm -124.41 128.24 73.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.361 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -87.87 125.94 34.76 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.37 -0.974 . . . . 10.0 108.37 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . 0.426 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 40.6 p -123.3 138.13 54.69 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 113.323 0.86 . . . . 10.0 113.323 -177.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 7.7 t -107.47 125.17 50.92 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.094 -1.076 . . . . 10.0 108.094 178.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.24 -26.44 52.6 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.233 0.54 . . . . 10.0 110.41 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 46.5 tttp -77.26 -48.29 17.89 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.504 -0.771 . . . . 10.0 112.787 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' B' ' 149' ' ' ARG . 72.3 p -98.2 -10.99 23.21 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.629 0.603 . . . . 10.0 112.629 -178.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . 0.4 ' HB2' ' O ' ' B' ' 148' ' ' THR . 15.2 mtp-105 70.95 13.87 6.95 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 122.823 0.449 . . . . 10.0 111.329 -178.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . 0.403 ' O ' ' HA ' ' B' ' 144' ' ' THR . 6.4 tt0 -62.93 123.52 18.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.306 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 81.06 -13.78 30.29 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.938 -0.574 . . . . 10.0 113.97 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 86.9 t -61.71 -42.84 95.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.436 0.532 . . . . 10.0 112.436 -178.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -66.75 -48.26 69.67 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.852 0.316 . . . . 10.0 111.852 -179.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -66.77 -26.34 66.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.433 -0.349 . . . . 10.0 111.606 -179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.8 -47.69 85.19 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.966 0.413 . . . . 10.0 110.034 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -66.57 -40.14 88.82 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.958 178.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 19.3 m-30 -63.45 -45.39 91.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.065 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 69.8 m -57.79 -41.92 83.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.81 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.776 HD22 ' HG ' ' B' ' 79' ' ' LEU . 41.5 tp -57.66 -47.59 81.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.448 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.31 -36.42 76.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.232 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 77.7 mtt180 -66.8 -38.0 85.64 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.509 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . 0.539 ' HA ' ' HE3' ' B' ' 165' ' ' LYS . 76.0 mm-40 -65.05 -40.85 95.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.834 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . 0.49 HG13 ' O ' ' B' ' 159' ' ' LEU . 70.7 mt -61.25 -40.99 87.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.98 179.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . 0.627 HH22 ' HB2' ' B' ' 47' ' ' ASP . 0.5 OUTLIER -63.93 -40.0 95.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.038 179.465 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . 0.539 ' HE3' ' HA ' ' B' ' 162' ' ' GLU . 28.5 mtmt -61.34 -33.62 73.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.097 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 24.3 t-80 -65.0 -39.11 92.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.066 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -69.01 -45.61 70.08 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.963 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -65.86 -47.03 76.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.963 -0.562 . . . . 10.0 111.938 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 54.5 tttm -56.66 -45.16 81.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.671 0.272 . . . . 10.0 111.533 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -65.85 -26.18 67.54 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 111.899 0.333 . . . . 10.0 111.899 -179.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 14.7 m . . . . . 0 C--N 1.326 -0.444 0 CA-C-O 120.808 0.337 . . . . 10.0 111.794 -179.47 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.44 0 N-CA-C 111.955 -0.458 . . . . 10.0 111.955 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' D' D ' 809' ' ' THR . . . . . 0.472 ' HB ' ' CG1' ' D' ' 821' ' ' VAL . 6.7 p -123.59 135.47 53.99 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.709 0.29 . . . . 10.0 110.972 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 6.8 t -118.5 133.85 64.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 110.206 -0.294 . . . . 10.0 110.206 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 811' ' ' LYS . . . . . 0.464 ' HE3' ' HB2' ' D' ' 811' ' ' LYS . 14.9 mtmt -87.69 112.92 22.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.485 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 39.1 t -91.52 124.78 44.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 109.736 -0.468 . . . . 10.0 109.736 179.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -88.97 115.01 26.22 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.765 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 83.0 mt -88.86 143.01 30.94 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.272 -179.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 815' ' ' PRO . . . . . 0.435 ' HB3' ' HA ' ' D' ' 878' ' ' GLU . 49.3 Cg_endo -68.44 -9.26 25.45 Favored 'Trans proline' 0 N--CA 1.476 0.451 0 C-N-CA 123.213 2.609 . . . . 10.0 112.666 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -88.39 18.59 4.37 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.735 -0.468 . . . . 10.0 109.735 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 26.4 mttt 61.87 47.29 6.14 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.547 0.689 . . . . 10.0 110.838 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -146.1 -177.19 5.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.758 -1.11 . . . . 10.0 108.639 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.92 165.23 37.35 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.952 -0.299 . . . . 10.0 111.351 -179.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 9.7 t -151.21 152.29 33.07 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.584 179.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 821' ' ' VAL . . . . . 0.472 ' CG1' ' HB ' ' D' ' 809' ' ' THR . 90.1 t -112.82 120.34 62.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 120.971 0.415 . . . . 10.0 110.934 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 31.3 m -113.13 157.51 13.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.612 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.21 133.09 35.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.621 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 13.1 t -86.98 109.29 18.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.556 -0.293 . . . . 10.0 110.328 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 -127.47 150.38 49.68 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -79.76 164.19 23.88 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 120.886 0.374 . . . . 10.0 110.696 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 89.25 -56.73 3.95 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 121.041 -0.599 . . . . 10.0 112.591 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 16.4 ptm -65.36 139.92 58.61 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.11 0.481 . . . . 10.0 111.268 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 829' ' ' SER . . . . . 0.914 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.0 OUTLIER -92.3 172.99 8.04 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.611 -179.374 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' D' D ' 830' ' ' VAL . . . . . 0.455 ' O ' ' HB2' ' D' ' 834' ' ' LEU . 90.5 t -60.83 -35.52 65.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.119 -0.697 . . . . 10.0 109.119 179.081 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 831' ' ' TYR . . . . . 0.629 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 87.0 t80 -58.68 -38.37 78.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.514 -0.766 . . . . 10.0 110.255 178.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -67.04 -58.49 4.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.958 -0.564 . . . . 10.0 111.444 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 1.3 m -61.27 -42.62 98.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.705 -0.68 . . . . 10.0 112.747 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 834' ' ' LEU . . . . . 0.674 HD11 HG21 ' D' ' 877' ' ' VAL . 0.5 OUTLIER -73.68 -24.14 59.92 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.96 0.356 . . . . 10.0 111.96 -179.273 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' D' D ' 835' ' ' ASP . . . . . 0.544 ' HB2' ' O ' ' D' ' 831' ' ' TYR . 35.1 t70 -59.45 -49.67 76.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.978 0.418 . . . . 10.0 110.605 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -60.69 -32.96 72.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.532 -0.758 . . . . 10.0 111.523 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -78.89 -33.4 45.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.774 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 90.1 mt -81.82 -43.79 17.8 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -179.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 5.3 mmtp -61.79 -36.71 81.88 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 -179.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 3.4 p -72.49 -14.19 16.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.063 0.459 . . . . 10.0 111.459 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 841' ' ' ARG . . . . . 0.423 HH22 ' HB3' ' B' ' 41' ' ' ARG . 1.2 mmt180 -105.02 -6.58 19.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.215 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 83.9 26.59 40.86 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.803 -0.713 . . . . 10.0 112.478 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 8.1 mp -117.5 158.5 24.42 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.101 -0.333 . . . . 10.0 110.101 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -123.99 164.27 19.69 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -79.32 50.07 1.05 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.897 0.38 . . . . 10.0 110.562 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -102.8 -74.57 0.63 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.462 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 75.3 m -87.03 -16.96 34.09 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.793 -0.639 . . . . 10.0 111.237 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 29.3 m -66.85 134.31 51.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.207 -0.452 . . . . 10.0 111.355 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 7.0 p -130.81 140.42 48.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.452 -0.573 . . . . 10.0 109.452 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 15.4 t -109.67 131.82 59.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.098 0.475 . . . . 10.0 111.584 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 851' ' ' TYR . . . . . 0.462 ' CE1' HG22 ' D' ' 860' ' ' VAL . 95.5 m-85 -117.48 157.21 26.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.356 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -110.35 153.79 24.44 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.021 -0.733 . . . . 10.0 109.021 178.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 853' ' ' LEU . . . . . 0.633 HD12 ' HB2' ' D' ' 874' ' ' GLU . 27.3 mt -105.04 51.86 0.75 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.853 0.359 . . . . 10.0 111.856 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 18.1 mt -72.29 86.95 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.398 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 855' ' ' LYS . . . . . 0.427 ' HA ' ' HD3' ' D' ' 855' ' ' LYS . 65.1 mmtt 67.29 41.16 2.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.963 -1.017 . . . . 10.0 112.377 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 86.42 -33.17 3.71 Favored Glycine 0 C--N 1.332 0.312 0 CA-C-N 115.914 -0.584 . . . . 10.0 113.852 178.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 23.1 mmt-85 -70.58 114.34 8.58 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.783 0.325 . . . . 10.0 111.376 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.94 100.14 0.7 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.804 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 1.4 m -97.38 112.73 24.43 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.105 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 860' ' ' VAL . . . . . 0.462 HG22 ' CE1' ' D' ' 851' ' ' TYR . 2.0 t -58.17 150.88 4.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.989 -0.551 . . . . 10.0 110.799 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 4.3 t -137.53 166.72 23.22 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.34 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -106.67 160.25 15.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.681 0.277 . . . . 10.0 110.701 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 863' ' ' TRP . . . . . 0.629 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 73.3 m95 -76.86 -27.65 55.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.014 0.435 . . . . 10.0 110.688 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.33 -36.44 82.19 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.385 -0.825 . . . . 10.0 111.688 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.52 142.16 40.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.928 -0.578 . . . . 10.0 111.53 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 866' ' ' ALA . . . . . 0.914 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -78.16 162.12 26.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.831 -0.433 . . . . 10.0 109.831 179.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 867' ' ' ILE . . . . . 0.617 ' HA ' HD23 ' D' ' 870' ' ' LEU . 8.3 tp -87.7 1.66 6.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.118 0.485 . . . . 10.0 111.242 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -60.17 -53.21 67.21 Favored Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 113.688 0.995 . . . . 10.0 113.688 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.68 18.29 1.0 Allowed 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.222 1.948 . . . . 10.0 112.974 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 870' ' ' LEU . . . . . 0.703 HD12 ' HG2' ' D' ' 873' ' ' GLU . 2.9 mm? -106.99 20.57 18.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.386 0.612 . . . . 10.0 110.585 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -67.0 107.68 2.34 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.902 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 89.96 15.13 58.29 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.877 -0.677 . . . . 10.0 112.214 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 873' ' ' GLU . . . . . 0.703 ' HG2' HD12 ' D' ' 870' ' ' LEU . 10.0 tp10 -102.11 148.91 24.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.511 0.196 . . . . 10.0 110.544 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 874' ' ' GLU . . . . . 0.633 ' HB2' HD12 ' D' ' 853' ' ' LEU . 24.8 mt-10 -105.88 109.38 21.31 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 62.3 mt -87.26 118.21 26.53 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.286 0.476 . . . . 10.0 112.286 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 32.3 mt -103.18 114.59 43.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.499 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 877' ' ' VAL . . . . . 0.674 HG21 HD11 ' D' ' 834' ' ' LEU . 18.6 t -102.83 126.31 57.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.978 -0.379 . . . . 10.0 109.978 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 878' ' ' GLU . . . . . 0.435 ' HA ' ' HB3' ' D' ' 815' ' ' PRO . 16.8 mm-40 -123.66 164.86 18.24 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.162 179.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 48.5 t -112.13 108.63 26.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.856 0.36 . . . . 10.0 110.182 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 68.3 mt . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.266 -0.873 . . . . 10.0 109.798 179.288 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 28.6 mt . . . . . 0 C--O 1.219 -0.517 0 CA-C-O 120.282 0.086 . . . . 10.0 110.96 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 59.5 mtt180 -66.96 -42.14 85.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.934 0.397 . . . . 10.0 110.141 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . 0.443 HE21 ' HB3' ' A' ' 241' ' ' GLN . 0.4 OUTLIER -67.47 -43.25 81.45 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.108 -0.701 . . . . 10.0 109.108 178.374 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -64.42 -44.95 89.62 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 115.441 -0.799 . . . . 10.0 109.965 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . 0.515 ' HA ' ' HB2' ' A' ' 246' ' ' ASP . 27.6 mmm -61.7 -30.48 70.78 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.337 179.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 70.7 m -63.91 -48.66 75.74 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 108.272 -1.01 . . . . 10.0 108.272 178.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -66.09 -44.55 84.07 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . 0.515 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.3 OUTLIER -54.07 -60.17 3.69 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 115.398 -0.819 . . . . 10.0 110.076 179.523 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 82.7 mt -61.64 -50.54 72.13 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.077 -0.51 . . . . 10.0 112.193 -179.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -57.28 -52.23 66.17 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.038 0.385 . . . . 10.0 112.038 -178.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -67.11 -42.19 84.94 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.63 0.233 . . . . 10.0 111.63 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . 0.511 HG22 ' HE1' ' C' ' 521' ' ' TYR . 24.5 t -65.37 -43.03 94.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.365 0 C-N-CA 121.156 -0.218 . . . . 10.0 111.215 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -66.6 -48.53 69.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.772 0.32 . . . . 10.0 110.806 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -60.28 -42.9 96.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.647 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -75.63 -29.06 59.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.41 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.459 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.8 OUTLIER -57.82 -31.85 41.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.593 179.623 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -60.75 -66.45 1.53 Allowed Pre-proline 0 N--CA 1.448 -0.525 0 CA-C-O 119.036 -0.506 . . . . 10.0 111.132 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.05 -31.95 83.79 Favored 'Trans proline' 0 C--N 1.357 0.998 0 C-N-CA 121.637 1.558 . . . . 10.0 112.053 178.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . 0.429 ' O ' ' HB2' ' A' ' 261' ' ' PHE . 5.5 m-30 -61.16 -50.3 73.74 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 120.741 0.305 . . . . 10.0 110.421 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 97.5 mt -80.63 -33.66 35.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.482 . . . . 10.0 111.179 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . 0.413 ' O ' ' HG3' ' A' ' 263' ' ' LYS . 15.1 t70 -64.31 -49.43 71.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.58 -0.282 . . . . 10.0 111.104 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -66.85 -39.19 87.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.06 0.457 . . . . 10.0 109.864 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' A' ' 257' ' ' TYR . 0.3 OUTLIER -64.35 -31.33 72.49 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.066 -0.716 . . . . 10.0 109.066 178.169 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -69.0 -40.81 78.48 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.006 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 259' ' ' ASP . 82.4 mttt -56.09 -48.05 76.87 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.093 -1.077 . . . . 10.0 108.093 178.246 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.413 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 14.5 mptt -63.86 -47.78 79.36 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.564 -1.198 . . . . 10.0 110.157 179.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -37.22 75.53 Favored 'General case' 0 N--CA 1.464 0.239 0 O-C-N 123.314 0.384 . . . . 10.0 111.204 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -62.99 -49.64 73.87 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.995 -0.743 . . . . 10.0 108.995 178.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -63.47 -38.35 90.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 10.0 109.667 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . 0.526 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 22.5 mt-10 -60.47 -52.93 63.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.522 179.114 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 81.0 mmm -66.18 -42.69 88.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.473 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -65.15 -48.73 72.5 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.549 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 45.5 mt -64.59 -35.85 82.31 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . 0.526 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 15.1 t80 -62.13 -49.93 73.9 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 54.8 mtt85 -65.34 -41.21 94.14 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.709 0.29 . . . . 10.0 110.415 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.39 -31.67 67.89 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.488 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.722 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 56.4 mttp -90.5 -42.25 10.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.021 178.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . 0.441 ' O ' ' HB2' ' A' ' 280' ' ' ARG . 5.6 t -53.53 -44.73 57.5 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.404 0 N-CA-C 112.255 0.465 . . . . 10.0 112.255 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -53.66 -62.0 4.34 Favored Pre-proline 0 CA--C 1.542 0.646 0 N-CA-C 112.556 0.576 . . . . 10.0 112.556 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . 0.506 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 29.3 Cg_endo -65.56 -36.84 31.93 Favored 'Trans proline' 0 C--N 1.353 0.816 0 C-N-CA 121.906 1.737 . . . . 10.0 112.287 178.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.868 HD22 ' HG2' ' C' ' 495' ' ' LYS . 58.1 mt -65.14 -34.22 77.87 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.098 0.475 . . . . 10.0 109.969 179.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 26.2 ttt180 -70.21 -35.13 73.69 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 108.065 -1.087 . . . . 10.0 108.065 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.75 -40.77 95.85 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.189 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 74.0 mt-10 -62.96 -43.04 99.89 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.704 -0.85 . . . . 10.0 108.704 178.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 63.9 mt -63.36 -37.62 87.99 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.429 -0.805 . . . . 10.0 109.918 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -68.3 -50.69 51.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.442 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -60.98 -43.53 98.67 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.37 -44.63 96.56 Favored Glycine 0 N--CA 1.438 -1.176 0 N-CA-C 110.486 -1.046 . . . . 10.0 110.486 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.82 -37.98 86.43 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 110.545 -0.169 . . . . 10.0 110.545 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -60.66 -42.26 96.66 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.765 -0.457 . . . . 10.0 109.765 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 11.1 tm0? -70.89 -49.82 41.72 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.751 -0.658 . . . . 10.0 109.713 178.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 46.8 mttt -56.68 -41.24 76.98 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.836 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 17.6 mt -70.52 -39.28 74.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.399 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.07 -41.23 99.4 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.4 -34.44 75.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.664 178.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 86.5 mt -75.51 -42.15 53.5 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.441 -0.799 . . . . 10.0 109.55 178.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -62.12 -39.19 91.7 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.393 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -77.5 14.98 0.86 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.745 178.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 23.8 mttp -133.07 -42.14 0.89 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.49 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . 0.41 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 93.3 mt -58.05 -32.67 68.23 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.361 179.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . 0.434 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 3.1 m -82.57 -62.32 0.31 Allowed Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . 0.434 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 18.1 Cg_endo -60.46 -49.92 8.02 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 121.832 1.688 . . . . 10.0 112.597 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.5 HD13 ' HG2' ' C' ' 473' ' ' LYS . 98.2 mt -75.8 -13.12 60.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.006 0.431 . . . . 10.0 110.271 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . 0.41 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -83.63 -47.92 5.46 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 109.815 -1.314 . . . . 10.0 109.815 178.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 57.5 mt-10 -61.1 -44.94 96.59 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . 0.518 ' O ' ' HG3' ' A' ' 308' ' ' ARG . 1.9 mt-10 -64.4 -39.15 93.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.366 179.243 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . 0.461 ' SD ' ' HE3' ' C' ' 473' ' ' LYS . 16.2 tpt -64.28 -39.3 93.65 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.228 -0.656 . . . . 10.0 109.228 178.477 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . 0.434 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 91.9 mtt180 -70.29 -39.83 74.62 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.284 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . 0.666 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 28.2 t70 -65.07 -43.71 91.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.958 0.408 . . . . 10.0 110.432 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . 1.13 ' CD ' HD21 ' C' ' 469' ' ' LEU . 11.7 mtp180 -69.92 -28.67 65.79 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.255 -0.646 . . . . 10.0 109.255 178.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . 0.629 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -71.81 -29.82 64.84 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 177.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . 0.666 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 77.9 mtt180 -62.58 -52.96 61.35 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.437 -0.949 . . . . 10.0 108.437 178.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -64.18 -35.36 80.53 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . 0.629 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.1 OUTLIER -57.08 -56.77 17.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.452 -0.794 . . . . 10.0 110.243 179.01 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 47.6 t -75.65 -39.69 39.76 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 CA-C-N 115.731 -0.668 . . . . 10.0 112.15 -179.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . 0.624 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 0.2 OUTLIER -59.96 -51.0 71.56 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 122.419 -0.176 . . . . 10.0 111.111 179.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -64.23 -26.43 68.5 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.351 -0.611 . . . . 10.0 109.351 178.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . 0.859 ' HG ' ' HE3' ' C' ' 462' ' ' LYS . 5.2 mt -71.79 -37.75 70.38 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . 0.624 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 79.7 mtt180 -63.27 -49.94 72.12 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.32 -11.83 45.74 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.779 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -98.34 -41.58 7.77 Favored 'General case' 0 C--O 1.223 -0.331 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 178.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 316' ' ' LEU . 86.4 mt -65.6 -34.24 77.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.973 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . 0.412 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -55.31 -61.66 5.67 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.498 -0.319 . . . . 10.0 111.587 179.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . 0.412 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 33.8 Cg_endo -66.86 -30.06 40.85 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.597 1.531 . . . . 10.0 111.541 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -63.79 -50.35 69.33 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 110.023 -0.362 . . . . 10.0 110.023 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . 0.497 ' HA ' ' HB2' ' A' ' 327' ' ' LEU . 18.7 p -70.64 -34.54 72.17 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 110.181 -0.304 . . . . 10.0 110.181 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -59.05 -53.84 53.82 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -70.09 -29.41 66.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.69 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . 0.497 ' HB2' ' HA ' ' A' ' 324' ' ' SER . 9.3 mt -63.2 -39.13 93.74 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.422 -0.585 . . . . 10.0 109.422 178.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 38.3 mtt180 -64.56 -35.26 80.4 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 109.492 -0.559 . . . . 10.0 109.492 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -69.84 -45.63 67.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.832 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . 0.537 ' HD3' ' OD2' ' C' ' 444' ' ' ASP . 9.6 ttm180 -63.5 -44.54 94.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.785 -0.643 . . . . 10.0 109.879 179.34 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 60.2 mt -65.31 -36.93 85.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.046 178.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -64.43 -44.84 89.91 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.22 -0.659 . . . . 10.0 109.22 178.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -60.45 -44.42 95.84 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.944 178.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . 0.488 ' HA ' ' HG2' ' C' ' 440' ' ' GLU . 3.6 mtt180 -63.33 -52.14 63.09 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-N 115.773 -0.648 . . . . 10.0 110.335 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 79.5 mt -60.25 -36.73 78.43 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.853 0.358 . . . . 10.0 111.054 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . 0.683 ' HA ' ' HE3' ' A' ' 339' ' ' LYS . 36.0 tt0 -67.39 -44.39 78.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.243 179.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.51 -46.66 72.22 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . 0.534 ' HA ' ' HB3' ' A' ' 341' ' ' ASN . 82.8 mt -63.99 -19.54 65.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.16 179.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . 0.683 ' HE3' ' HA ' ' A' ' 336' ' ' GLU . 12.9 ttmt -67.56 -48.15 67.77 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.671 -0.863 . . . . 10.0 108.671 178.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -77.87 -41.99 34.94 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . 0.664 HD21 ' HA ' ' C' ' 433' ' ' GLU . 27.7 t-20 -56.93 -48.97 77.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.804 -1.089 . . . . 10.0 109.629 179.282 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -76.77 -35.79 39.04 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.496 -0.775 . . . . 10.0 111.693 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.25 -47.94 88.6 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.761 -0.733 . . . . 10.0 111.329 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . 0.532 ' O ' ' HG2' ' A' ' 348' ' ' GLU . . . -66.97 -38.78 86.71 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 -61.43 -41.71 97.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.116 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 75.6 mt -63.4 -40.9 98.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.905 -0.589 . . . . 10.0 109.725 179.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -65.47 -41.08 93.72 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 344' ' ' ALA . 75.5 mm-40 -60.48 -53.28 59.4 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.575 -0.739 . . . . 10.0 109.537 178.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -63.92 -28.92 70.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.444 -0.798 . . . . 10.0 111.636 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.91 -50.42 29.29 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.112 -0.329 . . . . 10.0 110.112 179.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.99 98.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.957 0.408 . . . . 10.0 110.09 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . 0.595 ' HG2' HG22 ' C' ' 422' ' ' VAL . 8.1 mtmm -70.13 -23.55 63.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.066 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -70.09 -39.69 75.4 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -38.3 90.58 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.04 -0.726 . . . . 10.0 109.04 178.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -66.87 -38.0 85.5 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.18 -0.674 . . . . 10.0 109.18 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -62.68 -49.49 74.93 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 115.623 -0.717 . . . . 10.0 109.494 178.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 84.5 mt -61.13 -39.65 90.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.343 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . 0.415 ' O ' ' HG3' ' A' ' 362' ' ' GLU . 50.3 m -63.46 -52.87 59.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.534 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . 0.43 ' HA ' ' OE1' ' A' ' 362' ' ' GLU . 3.2 p -67.15 -26.0 66.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.206 0.527 . . . . 10.0 110.751 179.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 20.6 tp -74.11 -37.63 64.07 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 72.6 m -64.63 -29.88 70.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.11 0.481 . . . . 10.0 109.982 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . 0.43 ' OE1' ' HA ' ' A' ' 359' ' ' THR . 46.4 mt-10 -70.05 -7.54 42.02 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.122 178.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.476 ' HD3' HG23 ' C' ' 411' ' ' THR . 34.0 mttp -115.92 -32.87 5.29 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.709 -0.678 . . . . 10.0 109.356 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.38 -24.78 63.01 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.664 -0.698 . . . . 10.0 111.105 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.905 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 94.9 mttt -106.79 -71.72 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 112.134 0.42 . . . . 10.0 112.134 179.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.905 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 39.4 Cg_exo -59.11 -53.87 3.22 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 122.194 1.93 . . . . 10.0 113.028 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -62.77 -48.16 80.36 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.824 0.305 . . . . 10.0 111.824 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . 0.546 HD23 HD12 ' A' ' 371' ' ' LEU . 9.9 mt -62.04 -37.29 84.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.804 0.335 . . . . 10.0 110.731 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . 0.643 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 41.9 tt0 -65.35 -44.62 87.11 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 178.478 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.51 -37.61 88.15 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . 0.546 HD12 HD23 ' A' ' 368' ' ' LEU . 42.0 mt -63.32 -43.6 97.34 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 57.7 mtt180 -64.93 -38.21 90.22 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 108.359 -0.978 . . . . 10.0 108.359 178.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.643 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.5 mt-30 -65.61 -21.57 66.59 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.205 -0.907 . . . . 20.0 112.157 179.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -93.15 -37.35 5.69 Favored Glycine 0 CA--C 1.523 0.594 0 N-CA-C 108.75 -1.74 . . . . 10.0 108.75 178.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 49.1 mt -59.45 -37.8 79.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.811 -0.195 . . . . 10.0 111.433 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 75.8 mt -56.09 -62.43 4.75 Favored Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 112.038 0.384 . . . . 10.0 112.038 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -64.1 -34.81 56.44 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 121.983 1.789 . . . . 10.0 112.037 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 25.3 t -63.66 -54.57 30.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.517 0.199 . . . . 10.0 110.811 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 36.3 mt -63.35 -35.84 81.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.637 0.256 . . . . 10.0 110.921 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . 0.467 ' O ' HG23 ' A' ' 384' ' ' VAL . 14.1 tt0 -64.5 -51.01 65.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.554 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 12.6 p -65.28 -36.95 85.68 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.768 0.318 . . . . 10.0 110.879 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -68.31 -36.24 79.02 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.69 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 49.6 mttt -65.8 -37.2 85.63 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.682 -0.488 . . . . 10.0 109.682 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 380' ' ' GLU . 87.2 t -63.49 -44.24 98.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.084 178.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.35 -37.91 71.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.086 -0.507 . . . . 10.0 110.907 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . 0.459 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 1.6 m-85 -67.68 -45.9 73.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.516 -0.311 . . . . 10.0 111.139 179.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 34.6 mt -59.97 -45.38 92.88 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.998 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 77.4 p -70.76 -28.86 65.0 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.715 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -69.2 -38.45 78.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.087 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 95.8 mt -57.51 -40.98 79.92 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.478 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -60.63 -46.02 91.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.667 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . 0.681 ' HA ' ' HD2' ' A' ' 395' ' ' LYS . 0.0 OUTLIER -61.68 -41.51 97.67 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.341 -0.845 . . . . 10.0 111.666 -179.58 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -60.85 -44.29 97.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.063 0.459 . . . . 10.0 109.788 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 8.9 m -60.46 -39.3 87.08 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.487 -0.779 . . . . 10.0 111.45 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . 0.681 ' HD2' ' HA ' ' A' ' 392' ' ' GLU . 87.2 mttt . . . . . 0 N--CA 1.465 0.278 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.738 -179.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 11.3 mt . . . . . 0 CA--C 1.521 -0.144 0 CA-C-O 120.757 0.313 . . . . 10.0 110.799 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 77.0 mt -62.61 -42.09 99.38 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -71.03 -31.75 68.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.962 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . 0.489 ' O ' HG23 ' C' ' 408' ' ' VAL . 14.5 t-20 -64.88 -48.23 75.0 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.637 -0.875 . . . . 10.0 108.637 178.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 47.4 m0 -63.72 -37.01 85.75 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.522 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.18 -45.61 87.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.551 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 31.0 m -63.81 -36.63 84.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.738 -0.664 . . . . 10.0 109.997 178.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . 0.489 HG23 ' O ' ' C' ' 404' ' ' ASN . 89.3 t -67.46 -33.74 64.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 24.2 m -66.17 -40.17 90.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.736 -0.665 . . . . 10.0 109.215 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . 0.446 ' O ' ' HG2' ' C' ' 414' ' ' LYS . 7.4 m -66.78 -37.17 84.04 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.494 -0.928 . . . . 10.0 108.494 177.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . 0.476 HG23 ' HD3' ' A' ' 363' ' ' LYS . 76.6 m -63.18 -44.32 95.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.158 -0.928 . . . . 10.0 109.671 178.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . 0.438 ' HA ' HD12 ' C' ' 415' ' ' LEU . 1.1 m-85 -61.26 -38.35 86.41 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.306 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 32.2 m -62.33 -41.84 98.89 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.802 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' C' ' 410' ' ' SER . 73.4 mmtt -66.11 -31.86 72.97 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.778 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' C' ' 411' ' ' THR . 95.4 mt -69.16 -40.23 78.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.059 -0.519 . . . . 10.0 109.688 178.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -66.55 -44.85 81.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.338 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -64.92 -25.61 67.95 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.956 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' C' ' 414' ' ' LYS . 0.0 OUTLIER -79.22 -51.86 8.91 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.69 179.213 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 84.4 mt -52.69 -40.0 62.51 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.637 -0.711 . . . . 10.0 112.523 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -48.24 -79.3 0.07 OUTLIER Glycine 0 CA--C 1.523 0.543 0 O-C-N 123.6 0.563 . . . . 10.0 113.679 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -60.14 -35.87 90.8 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.621 2.214 . . . . 10.0 112.212 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . 0.595 HG22 ' HG2' ' A' ' 352' ' ' LYS . 35.9 t -60.56 -49.49 84.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 N-CA-C 112.132 0.419 . . . . 10.0 112.132 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 51.5 p -70.39 -34.58 72.74 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 121.097 -0.241 . . . . 10.0 111.118 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -60.13 -50.6 73.03 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -74.09 -24.72 59.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.511 179.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . 0.431 ' HB2' ' O ' ' C' ' 422' ' ' VAL . 48.8 t80 -68.59 -46.14 70.16 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.276 -0.639 . . . . 10.0 109.276 178.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -37.35 87.09 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 108.72 -0.844 . . . . 10.0 108.72 178.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -64.5 -44.45 90.91 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.63 -0.878 . . . . 10.0 108.63 177.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.88 -37.06 86.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.495 178.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 44.7 mt -63.13 -41.06 99.25 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . 0.539 ' HA ' ' OG1' ' C' ' 434' ' ' THR . 4.7 mm-40 -68.18 -35.06 77.42 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.969 -0.559 . . . . 10.0 110.403 178.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 38.0 mttp -62.56 -36.65 83.32 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.861 -1.163 . . . . 10.0 107.861 177.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . 0.664 ' HA ' HD21 ' A' ' 341' ' ' ASN . 38.2 tt0 -69.66 -48.75 58.71 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 114.96 -1.018 . . . . 10.0 110.172 179.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . 0.539 ' OG1' ' HA ' ' C' ' 431' ' ' GLU . 0.3 OUTLIER -64.2 -36.01 82.67 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 116.792 -0.185 . . . . 10.0 110.736 179.727 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -63.93 -35.12 79.62 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.686 -0.487 . . . . 10.0 109.686 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -69.38 -45.39 60.75 Favored Glycine 0 N--CA 1.445 -0.748 0 N-CA-C 108.807 -1.717 . . . . 10.0 108.807 177.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 87.5 mt -64.32 -24.6 67.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.373 -0.413 . . . . 10.0 110.796 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 39.8 mtt180 -74.77 -3.49 31.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.24 0.543 . . . . 10.0 110.341 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -118.04 -38.37 3.23 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.112 -1.069 . . . . 10.0 108.112 177.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . 0.488 ' HG2' ' HA ' ' A' ' 334' ' ' ARG . 40.3 mt-10 -72.22 -59.8 2.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.092 -0.958 . . . . 10.0 110.73 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . 0.46 ' HA ' ' HB3' ' C' ' 444' ' ' ASP . 93.3 mmm -66.43 -31.35 72.05 Favored 'General case' 0 C--O 1.225 -0.236 0 N-CA-C 112.908 0.706 . . . . 10.0 112.908 -178.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.3 p -62.66 -52.08 64.73 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 179.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -66.73 -40.23 88.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.996 -0.742 . . . . 10.0 108.996 178.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . 0.537 ' OD2' ' HD3' ' A' ' 330' ' ' ARG . 15.5 t70 -55.07 -53.83 50.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.705 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . 0.505 ' HA ' HG12 ' C' ' 448' ' ' VAL . 96.6 mt -63.88 -47.09 82.01 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.552 0.575 . . . . 10.0 112.552 -179.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -65.31 -38.46 90.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.903 0.382 . . . . 10.0 110.999 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . 0.486 ' O ' ' HG2' ' C' ' 451' ' ' LYS . 0.8 OUTLIER -72.79 -42.56 63.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.447 179.295 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . 0.505 HG12 ' HA ' ' C' ' 445' ' ' LEU . 2.3 p -65.55 -35.59 75.62 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.189 0 CA-C-N 116.656 -0.247 . . . . 10.0 110.981 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -66.0 -37.76 86.74 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.779 -0.823 . . . . 10.0 108.779 178.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -72.98 -11.46 60.58 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.322 -0.854 . . . . 10.0 110.033 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . 0.486 ' HG2' ' O ' ' C' ' 447' ' ' GLU . 35.9 mmtm -94.66 -40.16 9.96 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . 0.478 HG23 ' O ' ' C' ' 448' ' ' VAL . 59.5 t -59.62 -42.25 87.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.727 -0.67 . . . . 10.0 111.654 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . 0.892 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 18.5 mt-30 -54.32 -61.54 5.35 Favored Pre-proline 0 CA--C 1.537 0.468 0 O-C-N 122.97 0.169 . . . . 10.0 111.403 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . 0.892 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 23.9 Cg_exo -66.78 -28.99 42.99 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 122.171 1.914 . . . . 10.0 111.605 178.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -64.49 -52.02 60.01 Favored 'General case' 0 C--O 1.222 -0.367 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 43.3 mt -65.64 -43.52 89.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.358 179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -58.72 -51.45 69.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.99 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -71.97 -32.17 67.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.766 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -67.7 -48.03 67.7 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 178.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -68.04 -29.58 68.6 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . 0.406 ' HB2' ' HE3' ' C' ' 461' ' ' LYS . 5.0 ttmt -65.23 -46.69 79.6 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.539 -0.911 . . . . 10.0 108.539 177.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . 0.859 ' HE3' ' HG ' ' A' ' 316' ' ' LEU . 19.2 mttm -69.37 -38.75 78.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.432 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . 0.426 ' O ' ' HB2' ' C' ' 467' ' ' MET . 0.0 OUTLIER -62.75 -31.8 72.82 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 178.628 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -69.77 -45.59 67.69 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 0.832 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 59.2 mt-10 -55.66 -43.55 76.39 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . 0.458 ' HA ' HD12 ' C' ' 469' ' ' LEU . 19.3 mt-10 -73.47 -34.1 65.19 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 115.275 -0.875 . . . . 10.0 110.884 179.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . 0.426 ' HB2' ' O ' ' C' ' 463' ' ' TRP . 0.0 OUTLIER -62.45 -42.32 99.38 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.553 -0.906 . . . . 10.0 108.553 178.619 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -66.1 -47.21 74.97 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 107.894 -1.15 . . . . 10.0 107.894 177.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 1.13 HD21 ' CD ' ' A' ' 308' ' ' ARG . 96.2 mt -55.82 -44.62 78.05 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 115.217 -0.901 . . . . 20.0 111.489 178.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -62.6 -41.44 98.97 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 116.361 -0.381 . . . . 10.0 110.135 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 27.0 mtm180 -69.84 -36.93 75.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.964 0.412 . . . . 10.0 110.528 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -79.97 2.76 22.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.092 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . 0.5 ' HG2' HD13 ' A' ' 301' ' ' LEU . 29.3 mttm -120.51 -57.71 1.89 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.367 -0.378 . . . . 10.0 110.55 178.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 84.0 t -62.47 -42.77 97.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 112.752 0.649 . . . . 10.0 112.752 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -61.28 -58.19 20.57 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 112.378 0.51 . . . . 10.0 112.378 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -60.48 -33.86 93.48 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 121.663 1.575 . . . . 10.0 110.51 178.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 12.2 mt -66.61 -44.11 82.96 Favored 'General case' 0 C--O 1.213 -0.828 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . 0.474 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 65.4 mtt180 -54.89 -41.39 70.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.886 0.374 . . . . 10.0 110.177 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -67.48 -56.78 8.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.523 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . 0.421 ' CD ' ' HZ1' ' A' ' 297' ' ' LYS . 0.1 OUTLIER -67.64 -34.61 77.32 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.148 0.796 . . . . 10.0 113.148 -179.211 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 30.5 mt -68.6 -35.26 77.09 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . 0.474 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 1.3 mt-30 -69.95 -36.84 75.59 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 177.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -67.8 -41.26 83.41 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.609 -0.886 . . . . 10.0 108.609 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -67.58 -35.04 85.62 Favored Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 110.061 -1.215 . . . . 10.0 110.061 177.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -70.32 -38.41 74.92 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 45.8 mtt180 -64.57 -39.4 93.68 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 108.484 -0.932 . . . . 10.0 108.484 177.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . 0.463 ' O ' ' HG3' ' C' ' 491' ' ' GLU . 10.9 mm-40 -63.81 -48.65 75.98 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.801 -0.815 . . . . 10.0 108.801 177.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -64.8 -35.83 82.37 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.583 179.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 17.4 mt -68.37 -43.27 77.73 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 178.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -62.04 -40.82 97.05 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 107.496 -1.298 . . . . 10.0 107.496 178.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . 0.725 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 30.6 mt-10 -60.59 -59.63 5.09 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.448 -0.945 . . . . 10.0 108.448 177.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 80.8 mt -52.04 -50.95 60.45 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 115.52 -0.764 . . . . 10.0 112.468 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -61.57 -41.77 97.87 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.689 0.255 . . . . 10.0 111.689 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -75.05 -12.98 60.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.674 0.273 . . . . 10.0 111.429 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.868 ' HG2' HD22 ' A' ' 279' ' ' LEU . 13.5 mttm -97.09 -44.09 7.12 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 178.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 95.1 mt -71.11 -29.66 65.54 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.937 0.717 . . . . 10.0 112.937 -179.096 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 49.3 m -61.21 -60.4 10.69 Favored Pre-proline 0 CA--C 1.537 0.462 0 C-N-CA 120.422 -0.511 . . . . 10.0 111.327 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -65.0 -35.38 43.32 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 121.717 1.611 . . . . 10.0 111.074 178.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 16.2 mt -67.91 -35.35 78.31 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 116.334 -0.393 . . . . 10.0 110.461 179.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -65.43 -45.3 90.95 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.212 -1.155 . . . . 10.0 110.212 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -64.41 -42.88 95.82 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . 0.497 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 23.2 tt0 -62.31 -43.83 97.91 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.586 178.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . 0.524 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 65.8 mmm -62.29 -38.04 87.84 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.135 -0.484 . . . . 10.0 109.826 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 89.9 mtt180 -63.99 -42.46 97.19 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.45 -41.64 88.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.711 -0.677 . . . . 10.0 109.763 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.524 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 46.5 mtt180 -62.23 -43.49 98.71 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 108.586 -0.894 . . . . 10.0 108.586 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -61.53 -44.22 97.45 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.236 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' C' ' 508' ' ' ARG . 50.6 mtt180 -63.65 -42.02 98.17 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -75.9 10.91 1.59 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.192 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . 0.41 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 2.5 m-70 -128.97 -55.68 1.2 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.718 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 79.9 t -69.17 -46.41 77.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.826 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.646 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 13.6 t70 -66.81 -35.64 80.52 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 179.044 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.81 -39.2 90.67 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.052 -1.092 . . . . 10.0 108.052 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . 0.729 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 32.3 mt -68.67 -23.2 64.37 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.314 178.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . 0.646 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 68.2 mtt180 -64.68 -39.82 94.33 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.641 -0.874 . . . . 10.0 108.641 178.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -93.19 7.9 42.39 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.474 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . 0.729 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 32.3 m170 -113.74 -53.07 2.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.037 -0.528 . . . . 10.0 111.011 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 95.8 mt -77.42 -34.56 54.66 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.7 0.63 . . . . 10.0 112.7 -178.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -57.27 -57.18 26.66 Favored Pre-proline 0 CA--C 1.532 0.26 0 C-N-CA 120.52 -0.472 . . . . 10.0 110.945 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -67.48 -28.84 38.22 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 121.403 1.402 . . . . 10.0 110.628 178.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . 0.581 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 19.9 t80 -63.76 -48.38 77.22 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.004 179.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 9.1 p -71.01 -29.97 66.07 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.625 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -68.08 -44.0 77.26 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.958 -0.756 . . . . 10.0 108.958 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -66.15 -44.13 85.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.089 177.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 37.7 mt -61.64 -38.36 87.42 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 115.852 -0.613 . . . . 10.0 109.836 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -61.81 -38.99 90.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.141 -0.481 . . . . 10.0 109.911 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -67.81 -39.66 83.93 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 178.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 62.6 mtt180 -68.6 -37.2 79.6 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 178.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 75.0 mt -69.49 -34.98 75.12 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.124 -0.695 . . . . 10.0 109.124 178.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . 0.47 ' O ' ' HG2' ' C' ' 534' ' ' GLU . . . -64.04 -45.5 88.58 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 178.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.33 -40.88 98.54 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 178.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 8.2 ttm180 -60.97 -40.67 94.28 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.273 -0.876 . . . . 10.0 108.884 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 74.7 mt -68.53 -36.15 78.45 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.114 178.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . 0.483 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 5.6 mm-40 -59.38 -44.02 92.82 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 178.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -68.25 -46.56 70.13 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.356 -0.838 . . . . 10.0 109.445 178.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 58.6 mt -58.57 -30.05 66.87 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.393 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . 0.483 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 49.1 mtmt -74.89 -49.85 18.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.66 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -67.02 -49.57 64.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.861 0.362 . . . . 10.0 110.943 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -66.0 -36.6 83.74 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -67.52 -41.8 89.69 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 110.853 -0.899 . . . . 10.0 110.853 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -63.94 -37.65 94.93 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 110.215 -1.154 . . . . 10.0 110.215 178.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -67.89 -44.9 75.93 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.614 -0.884 . . . . 10.0 108.614 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 34.3 mtt180 -56.77 -39.98 75.01 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 115.522 -0.763 . . . . 10.0 110.542 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' C' ' 548' ' ' HIS . 81.7 mt -62.61 -41.29 98.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.408 179.14 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -69.47 -45.08 69.86 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.457 -0.571 . . . . 10.0 109.457 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -59.84 -49.33 78.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.097 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -64.0 -39.21 93.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.985 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . 0.49 ' HB2' ' O ' ' C' ' 544' ' ' LEU . 1.7 t-80 -65.68 -42.96 90.66 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.172 0.511 . . . . 10.0 110.314 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -64.52 -51.82 60.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.616 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -33.77 74.57 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.373 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.41 -45.94 88.69 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.392 -0.595 . . . . 10.0 109.392 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 4.4 m -66.49 -38.1 86.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.726 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -68.96 -25.97 64.81 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.605 -0.725 . . . . 10.0 110.649 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . 0.466 ' HA ' ' OG1' ' C' ' 557' ' ' THR . 3.2 m-70 -87.5 -34.24 18.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.766 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 49.0 mt -63.6 -32.45 73.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.856 0.36 . . . . 10.0 110.413 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 1.1 p -76.4 -41.32 48.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.117 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . 0.466 ' OG1' ' HA ' ' C' ' 554' ' ' HIS . 2.1 p -73.88 -12.75 60.76 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.336 0.588 . . . . 10.0 110.853 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 28.8 mt -91.31 -39.61 11.95 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.056 -0.72 . . . . 10.0 109.056 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . 0.469 ' HA ' ' HB3' ' C' ' 562' ' ' ALA . 2.5 p -69.46 -24.88 63.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.784 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . 0.513 ' HG3' ' HD3' ' C' ' 561' ' ' LYS . 7.6 pt-20 -64.11 -19.97 65.64 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.337 0.589 . . . . 10.0 109.967 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . 0.513 ' HD3' ' HG3' ' C' ' 560' ' ' GLU . 13.2 mptt -114.53 -29.77 6.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.222 178.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . 0.469 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -73.8 -5.7 42.45 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.143 0.423 . . . . 10.0 112.143 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . 0.922 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 87.8 mttt -119.87 -70.11 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.583 0 CA-C-O 119.446 -0.312 . . . . 10.0 111.323 178.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . 0.922 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 32.4 Cg_exo -61.6 -51.72 3.83 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.08 1.853 . . . . 10.0 112.242 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -63.6 -40.73 97.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.463 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . 0.514 HD23 HD12 ' C' ' 569' ' ' LEU . 6.9 mt -63.96 -41.79 97.47 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 110.063 -0.347 . . . . 10.0 110.063 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . 0.706 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 36.9 mt-10 -63.56 -38.55 91.54 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 178.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.31 -38.77 81.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.153 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . 0.514 HD12 HD23 ' C' ' 566' ' ' LEU . 36.4 mt -62.55 -41.01 98.63 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -68.84 -30.92 69.56 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.468 -0.567 . . . . 10.0 109.468 178.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . 0.706 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.9 mt-30 -70.63 -14.42 62.47 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.337 -0.847 . . . . 20.0 110.47 178.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -98.6 -37.6 4.19 Favored Glycine 0 CA--C 1.523 0.568 0 N-CA-C 108.659 -1.776 . . . . 10.0 108.659 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 73.5 mt -56.34 -45.03 80.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.529 -0.335 . . . . 10.0 111.602 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 86.8 mt -56.97 -62.0 5.96 Favored Pre-proline 0 CA--C 1.537 0.448 0 N-CA-C 112.508 0.559 . . . . 10.0 112.508 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -61.22 -36.97 77.52 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 121.964 1.776 . . . . 10.0 111.948 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 9.6 t -64.38 -45.34 96.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.637 0.256 . . . . 10.0 110.372 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 29.8 mt -62.75 -38.0 88.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.777 0.322 . . . . 10.0 110.145 179.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . 0.426 ' O ' HG23 ' C' ' 582' ' ' VAL . 62.4 mt-10 -65.72 -48.55 71.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.176 178.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 26.9 m -63.41 -39.91 95.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.152 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -65.91 -38.31 88.37 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 178.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . 0.445 ' O ' ' HG ' ' C' ' 585' ' ' LEU . 64.6 mttt -61.73 -39.49 91.72 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.858 -0.61 . . . . 10.0 109.744 178.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . 0.426 HG23 ' O ' ' C' ' 578' ' ' GLU . 69.6 t -59.8 -48.83 86.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 108.82 -0.808 . . . . 10.0 108.82 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 12.0 m -61.47 -41.98 98.07 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.386 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -63.47 -47.37 82.08 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.082 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' C' ' 581' ' ' LYS . 80.1 mt -57.9 -46.28 85.17 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.306 -0.407 . . . . 10.0 110.406 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 14.7 m -65.33 -44.53 87.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.216 179.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -58.03 -50.5 73.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.285 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.5 mt -56.63 -44.65 81.44 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 116.185 -0.462 . . . . 10.0 110.816 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -63.61 -52.55 60.39 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.065 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . 0.431 ' HA ' ' HE2' ' C' ' 593' ' ' LYS . 55.9 mt-10 -58.78 -39.33 80.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.897 -0.592 . . . . 10.0 112.234 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -73.26 -44.13 59.87 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.001 0.371 . . . . 10.0 112.001 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 14.2 p -64.75 -27.98 69.27 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.507 0.558 . . . . 10.0 112.507 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . 0.431 ' HE2' ' HA ' ' C' ' 590' ' ' GLU . 45.0 mtmt -65.61 -33.18 75.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.894 0.378 . . . . 10.0 110.924 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 24.0 mttt -85.48 -34.85 21.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.348 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 91.3 mt -85.77 49.46 1.77 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.456 0.646 . . . . 10.0 109.604 178.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.246 0.915 0 CA-C-N 115.487 -0.778 . . . . 10.0 110.123 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.26 0 CA-C-O 120.606 0.241 . . . . 10.0 111.165 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -115.96 125.25 52.28 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 179.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -119.05 101.01 7.71 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.027 0.441 . . . . 10.0 111.165 -179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.448 ' HA ' ' O ' ' B' ' 54' ' ' ASP . 5.5 mtpp -81.95 102.71 11.1 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.305 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 21.2 mt -100.92 138.41 38.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.553 -178.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 46.0 t -112.55 126.73 69.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.794 0.33 . . . . 10.0 110.742 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.534 HG12 ' HD2' ' B' ' 16' ' ' LYS . 57.1 t -95.87 118.3 41.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.724 -0.473 . . . . 10.0 109.724 179.189 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.418 ' HB ' ' CD1' ' B' ' 96' ' ' TYR . 35.9 m -112.33 163.21 9.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.773 0.32 . . . . 10.0 110.802 -179.528 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 148.99 167.49 13.91 Favored Glycine 0 N--CA 1.447 -0.632 0 N-CA-C 111.378 -0.689 . . . . 10.0 111.378 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.59 158.32 35.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.924 0.392 . . . . 10.0 111.724 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.65 92.4 1.0 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 121.019 -0.61 . . . . 10.0 111.867 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 151.12 -10.98 0.77 Allowed Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 111.645 -0.582 . . . . 10.0 111.645 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 17.5 m -73.42 -18.91 17.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.857 0.36 . . . . 10.0 111.666 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 89.59 44.7 4.83 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.82 -0.705 . . . . 10.0 112.927 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . 0.534 ' HD2' HG12 ' B' ' 8' ' ' VAL . 53.8 mtmt -62.26 -49.73 74.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.544 0.211 . . . . 10.0 111.226 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.0 p -62.43 -31.23 71.91 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.686 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.38 98.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.286 -0.415 . . . . 10.0 110.312 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 94.2 mt -68.37 -35.75 78.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.98 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.87 -47.42 53.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.84 0.352 . . . . 10.0 110.953 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 97.5 mt -63.93 -35.75 74.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.766 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.576 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 6.4 tp-100 -69.58 -14.83 63.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.081 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 15.0 tp -102.23 -34.81 9.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.869 0.366 . . . . 10.0 110.659 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . 0.453 HG13 ' CD2' ' B' ' 40' ' ' TYR . 49.3 mm -79.73 -64.21 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.905 -179.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . 0.732 ' NE2' ' HA ' ' D' ' 840' ' ' VAL . 19.1 mt-30 -93.21 -13.56 28.2 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.724 -178.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 95.3 m-20 64.48 40.66 6.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.654 -179.14 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -130.65 136.2 48.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.047 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -88.21 137.61 32.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.779 0.323 . . . . 10.0 110.774 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 1.7 m -99.69 151.96 4.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.361 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -121.17 -21.94 6.24 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.183 0.516 . . . . 10.0 111.363 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -77.0 157.22 31.33 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.358 0.599 . . . . 10.0 111.243 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.51 68.23 5.68 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.035 179.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.3 134.62 70.21 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.747 -0.66 . . . . 10.0 110.753 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -80.11 -164.72 0.29 Allowed 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.857 2.371 . . . . 10.0 111.783 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -173.33 141.47 0.92 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.279 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.902 HD11 HG21 ' D' ' 809' ' ' THR . 63.8 mt -121.92 -66.56 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 108.217 -1.031 . . . . 10.0 108.217 178.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.502 ' O ' HG23 ' D' ' 821' ' ' VAL . 1.8 tm-20 -148.11 93.43 2.17 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.702 -0.851 . . . . 10.0 108.702 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . 0.623 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 52.0 m-20 -114.61 160.56 19.16 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.551 -179.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.1 p -147.28 142.83 27.59 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.715 0.293 . . . . 10.0 111.608 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . 0.661 ' CE2' HG22 ' D' ' 840' ' ' VAL . 40.7 m-85 -131.56 141.06 49.62 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.245 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . 0.635 ' HB3' ' ND2' ' D' ' 816' ' ' ASN . 0.4 OUTLIER -120.34 131.04 54.68 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.573 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 58.1 tttp -139.93 144.15 36.95 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.23 -0.441 . . . . 10.0 109.962 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -113.44 118.23 33.94 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.971 -0.381 . . . . 10.0 109.971 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -143.65 169.09 11.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.012 0.434 . . . . 10.0 111.271 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 19.1 t -107.09 112.85 41.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 179.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . 0.41 HD13 HG21 ' B' ' 160' ' ' VAL . 50.3 mt -109.92 112.37 40.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.824 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 61.27 34.52 18.59 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.304 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.88 -8.73 78.91 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.927 -0.654 . . . . 10.0 112.791 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -100.52 113.43 26.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.833 0.349 . . . . 10.0 111.267 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 5.3 t -78.83 121.28 24.61 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.489 -0.93 . . . . 10.0 108.489 178.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -140.39 166.68 24.05 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.286 0.565 . . . . 10.0 112.47 -178.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 25.5 tp -107.02 122.1 45.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.256 -0.884 . . . . 10.0 109.112 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.449 ' O ' ' HA ' ' B' ' 41' ' ' ARG . 77.7 mt -99.98 117.35 34.08 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.284 -0.416 . . . . 10.0 111.561 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.448 ' O ' ' HA ' ' B' ' 5' ' ' LYS . 4.8 t70 -104.53 89.55 3.25 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.354 -1.35 . . . . 10.0 107.354 178.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 14.8 mt -82.69 136.58 22.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.641 -0.709 . . . . 10.0 112.306 -177.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.435 HD12 ' O ' ' B' ' 38' ' ' ASP . 47.3 tp -110.3 120.89 43.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.606 -0.725 . . . . 10.0 111.124 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.623 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 6.0 t0 -99.36 96.76 7.94 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.072 -0.714 . . . . 10.0 109.072 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . 0.445 HG22 ' CE1' ' B' ' 71' ' ' TYR . 32.0 p -81.02 162.41 23.82 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.373 -0.83 . . . . 10.0 112.342 -178.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . 0.493 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -76.51 156.47 32.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.905 178.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -84.31 -67.49 1.43 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.436 -0.888 . . . . 10.0 111.767 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -83.15 102.43 11.86 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.328 0.585 . . . . 20.0 111.257 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.418 ' OE1' ' HD2' ' B' ' 68' ' ' ARG . 0.4 OUTLIER -142.59 163.83 31.76 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.374 179.509 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -118.67 -161.46 0.84 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.698 -0.683 . . . . 10.0 109.312 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -80.44 110.27 15.74 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.982 0.42 . . . . 10.0 110.173 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 44.2 t -135.56 137.4 41.97 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.028 -0.533 . . . . 10.0 109.933 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.85 -38.46 78.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.055 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . 0.5 ' HA ' ' NE2' ' B' ' 70' ' ' GLN . 90.4 mmm -60.81 -40.74 93.87 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.407 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.676 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 56.3 ttt85 -66.58 -48.43 69.61 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.482 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.479 ' O ' ' HG3' ' B' ' 73' ' ' ARG . 0.1 OUTLIER -59.88 -32.6 70.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.582 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.5 ' NE2' ' HA ' ' B' ' 67' ' ' MET . 7.1 mt-30 -61.35 -56.3 21.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.98 -0.554 . . . . 10.0 111.523 179.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . 0.676 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 5.4 p90 -72.55 -27.83 62.46 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.436 0.902 . . . . 10.0 113.436 -178.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . 0.462 ' HB3' HG21 ' B' ' 103' ' ' VAL . 59.7 mtp -68.57 -21.27 64.54 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.939 0.348 . . . . 10.0 111.939 -179.478 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' B' ' 69' ' ' ASP . 66.9 mtt-85 -95.6 11.74 32.11 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.859 0.318 . . . . 10.0 111.859 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.3 m -113.01 18.16 18.29 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.408 0.623 . . . . 10.0 110.749 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -115.94 144.26 18.37 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.521 -0.847 . . . . 10.0 112.693 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -84.99 -67.9 0.76 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.214 -0.291 . . . . 10.0 110.214 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -105.19 152.4 17.27 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 111.149 -0.78 . . . . 10.0 111.149 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -124.75 127.46 47.26 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.116 0.484 . . . . 10.0 111.677 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.754 ' HG ' HD22 ' B' ' 159' ' ' LEU . 55.5 mt -95.33 113.43 25.1 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.883 -0.598 . . . . 10.0 110.03 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 3.2 m -87.37 86.31 7.23 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.934 -0.395 . . . . 10.0 109.934 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.462 ' HA ' ' HB ' ' B' ' 114' ' ' VAL . 28.6 t -88.31 126.3 41.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.138 0.494 . . . . 10.0 111.837 -178.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.644 ' HB3' HD11 ' B' ' 93' ' ' ILE . 29.4 p90 -133.14 157.9 44.17 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.114 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -94.16 121.71 35.94 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . 0.471 ' CD1' ' HA ' ' B' ' 118' ' ' CYS . 12.6 pt -68.46 -11.23 14.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 112.129 0.418 . . . . 10.0 112.129 -179.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -100.97 12.06 38.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.911 0.386 . . . . 10.0 110.963 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -137.6 113.13 9.45 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.0 0.428 . . . . 10.0 110.861 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.39 -37.71 88.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.908 -0.587 . . . . 10.0 112.321 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 17.3 tptp -63.79 -30.68 71.75 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.987 0.422 . . . . 10.0 110.878 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 15.2 t -66.42 -40.37 89.5 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.791 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -65.62 -35.67 81.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.356 0.598 . . . . 10.0 110.195 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -80.93 -1.72 44.75 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.679 -0.692 . . . . 10.0 111.574 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.19 -12.1 33.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.146 0.498 . . . . 10.0 110.024 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . 0.644 HD11 ' HB3' ' B' ' 82' ' ' PHE . 43.8 mm -60.26 -42.74 91.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.398 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -64.4 -37.79 88.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.26 -0.427 . . . . 10.0 109.871 179.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -59.03 -43.83 91.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.414 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . 0.418 ' CD1' ' HB ' ' B' ' 9' ' ' VAL . 2.9 m-85 -77.6 -34.92 53.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.95 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -55.17 -50.58 68.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.406 -0.361 . . . . 10.0 111.335 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -69.46 -35.79 75.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.081 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -63.9 -48.33 77.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.658 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . 0.502 ' HA ' HG22 ' B' ' 103' ' ' VAL . 65.2 mt -66.92 -38.05 80.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.273 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.84 -37.34 78.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.097 0.475 . . . . 10.0 110.422 179.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 64.3 ttp85 -71.43 -42.9 67.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.664 -0.698 . . . . 10.0 111.918 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' B' ' 100' ' ' ILE . 28.3 m -72.83 -30.0 31.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 N-CA-C 112.288 0.477 . . . . 10.0 112.288 -179.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 19.8 mmmt -88.0 -22.29 24.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.549 0.214 . . . . 10.0 111.169 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 26.0 t0 57.84 30.32 18.87 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.725 0.774 . . . . 10.0 110.782 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 3.0 m -127.44 143.28 51.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.381 -0.827 . . . . 10.0 109.756 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -75.06 -41.64 58.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.199 0.523 . . . . 10.0 110.487 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -106.24 109.03 20.84 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.573 0.701 . . . . 10.0 110.775 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.417 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 78.5 t -118.92 131.67 24.24 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.256 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 32.9 Cg_exo -59.63 101.76 0.15 Allowed 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.718 2.279 . . . . 10.0 111.381 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . 0.565 ' HB2' HG21 ' B' ' 139' ' ' ILE . 65.8 mtt -127.16 149.67 49.86 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.154 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . 0.518 ' HB ' HD23 ' B' ' 79' ' ' LEU . 98.0 t -132.36 122.57 48.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 12.9 tp -76.87 115.68 16.87 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.274 -0.639 . . . . 10.0 109.274 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . 0.462 ' HB ' ' HA ' ' B' ' 81' ' ' VAL . 49.3 t -110.58 112.41 40.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.04 0.448 . . . . 10.0 111.425 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -95.56 95.51 1.85 Allowed Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.319 -1.112 . . . . 10.0 110.319 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -85.18 163.48 18.69 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -178.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . 0.51 ' HB3' HD12 ' B' ' 120' ' ' LEU . 92.5 mttt 72.13 33.19 1.62 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 115.38 -0.827 . . . . 10.0 112.208 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . 0.471 ' HA ' ' CD1' ' B' ' 84' ' ' ILE . 20.4 p -67.31 -17.0 64.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.761 0.315 . . . . 10.0 111.723 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -84.07 -8.93 58.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.464 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . 0.51 HD12 ' HB3' ' B' ' 117' ' ' LYS . 34.2 mt -84.7 124.65 72.77 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 120.762 0.315 . . . . 10.0 111.429 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -75.77 42.67 0.97 Allowed 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.111 2.541 . . . . 10.0 112.248 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 26.7 m -134.75 30.49 3.42 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.899 -0.778 . . . . 10.0 108.899 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 40.8 ttm-85 -57.63 108.93 0.62 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.379 -0.828 . . . . 10.0 111.989 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 2.5 m -98.87 -27.6 13.84 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.635 -0.711 . . . . 10.0 109.151 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 40.4 t -106.96 114.24 45.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.187 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -76.98 154.36 33.62 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.34 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . 0.554 HG23 ' HE2' ' B' ' 141' ' ' PHE . 3.8 m -55.7 -41.06 73.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.921 -0.581 . . . . 10.0 111.517 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 11.0 ttpp -62.21 -45.11 94.81 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.803 0.335 . . . . 10.0 110.973 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -56.91 -46.8 81.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.583 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.77 -40.42 84.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.477 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -63.9 -40.44 96.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.524 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -60.7 -42.31 96.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.094 0.474 . . . . 10.0 110.44 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 42.0 tp -68.39 -44.68 74.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.415 179.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.58 -45.35 92.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.218 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -61.8 -36.01 79.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.255 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 22.9 m -67.66 -25.57 65.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.47 -179.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -95.29 -6.01 42.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.453 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 72.59 31.49 62.86 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.865 -0.684 . . . . 10.0 111.75 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . 0.565 HG21 ' HB2' ' B' ' 111' ' ' MET . 49.5 pt -126.25 153.05 74.48 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 110.295 -0.261 . . . . 10.0 110.295 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -81.14 158.05 20.26 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.586 2.191 . . . . 10.0 112.389 179.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.554 ' HE2' HG23 ' B' ' 127' ' ' THR . 45.0 t80 -122.8 129.51 51.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.535 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 32.3 mm -128.03 124.42 62.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.418 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -85.15 124.76 32.19 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.669 -0.863 . . . . 10.0 108.669 178.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 82.6 p -128.55 171.5 12.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.792 0.805 . . . . 10.0 112.974 -177.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 7.9 t -154.06 121.12 5.67 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.659 -1.155 . . . . 10.0 108.043 178.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.97 -17.79 62.64 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.864 0.364 . . . . 10.0 111.01 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 29.8 ttmt -81.55 -48.28 12.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.16 -0.473 . . . . 10.0 111.526 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 24.4 p -90.42 -12.8 36.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.802 0.334 . . . . 10.0 111.532 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . 0.576 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 40.2 ttt-85 70.04 20.22 6.56 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.694 -0.684 . . . . 10.0 111.531 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -75.7 131.93 40.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.604 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.9 -13.0 5.74 Favored Glycine 0 C--O 1.225 -0.436 0 N-CA-C 114.934 0.734 . . . . 10.0 114.934 177.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 59.7 t -53.55 -56.88 6.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -178.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -45.69 93.03 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.926 -179.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -66.62 -32.67 74.15 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.918 0.71 . . . . 10.0 112.918 -178.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.8 -46.52 84.52 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.074 0.464 . . . . 10.0 110.481 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -68.53 -37.41 79.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.713 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 21.4 m-30 -61.86 -45.3 94.36 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.315 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.519 ' HA ' ' HE ' ' B' ' 161' ' ' ARG . 12.2 m -61.71 -38.17 86.89 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.901 -0.591 . . . . 10.0 111.004 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.754 HD22 ' HG ' ' B' ' 79' ' ' LEU . 21.5 tp -61.53 -43.58 98.61 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . 0.41 HG21 HD13 ' B' ' 46' ' ' ILE . 67.0 t -65.7 -39.06 83.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.115 -0.493 . . . . 10.0 109.809 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . 0.519 ' HE ' ' HA ' ' B' ' 158' ' ' THR . 41.5 mtm-85 -61.6 -41.38 97.36 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.938 -0.574 . . . . 10.0 109.987 178.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -63.0 -40.5 97.97 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.202 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . 0.414 HG13 ' O ' ' B' ' 159' ' ' LEU . 93.1 mt -62.78 -42.07 94.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.444 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . 0.431 HH11 ' HD2' ' B' ' 164' ' ' ARG . 59.1 mtt180 -57.17 -52.23 66.16 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.783 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt -61.07 -39.38 89.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.666 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 -65.07 -36.92 85.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.009 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 7.8 mttt -73.63 -35.1 65.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.933 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 67.2 tt0 -69.15 -33.84 74.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.306 0.574 . . . . 10.0 109.574 179.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 16.2 tttp -64.59 -33.35 75.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.506 -0.77 . . . . 10.0 110.49 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 23.2 ttp -62.48 -25.42 67.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.704 -0.68 . . . . 10.0 112.067 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 39.0 m . . . . . 0 C--N 1.328 -0.347 0 CA-C-O 121.018 0.437 . . . . 10.0 111.299 179.715 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.595 0 N-CA-C 112.084 -0.406 . . . . 10.0 112.084 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' D' D ' 809' ' ' THR . . . . . 0.902 HG21 HD11 ' B' ' 36' ' ' ILE . 0.2 OUTLIER -137.2 134.2 36.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.686 0.279 . . . . 10.0 111.024 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' D' D ' 810' ' ' VAL . . . . . 0.601 HG23 HG22 ' D' ' 824' ' ' VAL . 75.3 t -106.14 133.4 50.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.122 -179.122 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 26.0 ttmt -87.27 110.31 20.11 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.419 -0.586 . . . . 10.0 109.419 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 57.5 t -99.2 125.4 52.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 120.894 0.378 . . . . 10.0 110.418 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -96.24 142.4 28.44 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.808 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 56.1 mt -107.96 150.09 39.91 Favored Pre-proline 0 C--N 1.318 -0.8 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.07 -179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -61.78 -16.87 51.72 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 123.178 2.585 . . . . 10.0 112.273 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 816' ' ' ASN . . . . . 0.635 ' ND2' ' HB3' ' B' ' 41' ' ' ARG . 4.0 t30 -85.84 34.94 0.61 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.984 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 817' ' ' LYS . . . . . 0.605 ' HB2' ' NH1' ' B' ' 41' ' ' ARG . 5.0 mtpm? 52.43 38.25 24.83 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.124 -0.944 . . . . 10.0 112.161 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 818' ' ' GLN . . . . . 0.465 HE22 ' C ' ' B' ' 40' ' ' TYR . 72.0 mt-30 -135.73 -170.5 2.63 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 112.838 0.681 . . . . 10.0 112.838 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.36 168.4 26.75 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.336 0.589 . . . . 10.0 112.148 -178.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 14.1 t -152.38 139.15 18.87 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 107.301 -1.37 . . . . 10.0 107.301 178.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 821' ' ' VAL . . . . . 0.595 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 2.9 t -108.05 114.53 46.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 C-N-CA 120.147 -0.621 . . . . 10.0 112.02 -178.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 3.7 t -110.29 148.33 13.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.939 -178.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.89 146.94 37.33 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.78 0.324 . . . . 10.0 111.564 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 824' ' ' VAL . . . . . 0.601 HG22 HG23 ' D' ' 810' ' ' VAL . 47.7 t -84.68 96.39 4.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.069 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 825' ' ' ARG . . . . . 0.444 ' HB2' ' SD ' ' D' ' 828' ' ' MET . 15.3 mtp85 -99.65 103.46 15.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.52 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -59.3 123.62 17.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.952 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 128.03 -41.67 1.55 Allowed Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 115.665 -0.698 . . . . 10.0 112.041 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 828' ' ' MET . . . . . 0.444 ' SD ' ' HB2' ' D' ' 825' ' ' ARG . 12.7 ptm -81.86 154.89 25.63 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.916 0.389 . . . . 10.0 110.854 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 829' ' ' SER . . . . . 0.474 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 2.1 m -96.72 168.9 10.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.203 -0.453 . . . . 10.0 111.334 -179.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 830' ' ' VAL . . . . . 0.477 ' O ' ' HB2' ' D' ' 834' ' ' LEU . 69.7 t -54.86 -42.53 63.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.714 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 831' ' ' TYR . . . . . 0.515 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 36.6 t80 -55.89 -33.07 64.29 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.365 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -73.73 -59.35 2.76 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.367 0.506 . . . . 10.0 112.367 -178.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.99 -39.17 93.51 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 -179.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 834' ' ' LEU . . . . . 0.665 ' HG ' HG21 ' D' ' 850' ' ' VAL . 4.0 mm? -75.47 -14.9 60.46 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.429 0.529 . . . . 10.0 112.429 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 835' ' ' ASP . . . . . 0.523 ' O ' ' HG2' ' D' ' 839' ' ' LYS . 12.8 t70 -60.15 -49.52 77.31 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 7.6 mmmm -63.65 -32.5 74.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.449 -0.796 . . . . 10.0 111.046 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 837' ' ' ALA . . . . . 0.582 ' O ' HG12 ' D' ' 840' ' ' VAL . . . -70.02 -28.49 65.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.139 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 838' ' ' LEU . . . . . 0.513 HD12 ' HG3' ' D' ' 845' ' ' GLN . 91.6 mt -87.83 -39.33 14.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.549 179.125 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 839' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' D' ' 835' ' ' ASP . 30.9 mmtp -64.99 -31.88 73.33 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.404 179.046 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 840' ' ' VAL . . . . . 0.732 ' HA ' ' NE2' ' B' ' 25' ' ' GLN . 2.0 p -58.33 -24.95 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-O 121.426 0.632 . . . . 10.0 111.441 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -100.78 -37.89 8.51 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.314 -0.857 . . . . 10.0 110.154 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 117.01 20.29 4.92 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 111.085 -0.806 . . . . 10.0 111.085 -178.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 59.1 mt -105.32 179.74 4.18 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.775 0.322 . . . . 10.0 110.346 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -140.7 164.47 30.11 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.651 -0.5 . . . . 10.0 109.651 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 845' ' ' GLN . . . . . 0.513 ' HG3' HD12 ' D' ' 838' ' ' LEU . 22.4 mp0 -72.86 64.87 0.7 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.087 0.47 . . . . 10.0 111.2 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -123.0 -78.13 0.6 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.614 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -92.47 14.27 17.2 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.324 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 14.8 m -111.13 143.74 41.37 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.29 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 7.1 p -138.14 143.56 32.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.383 -0.371 . . . . 10.0 110.489 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 850' ' ' VAL . . . . . 0.665 HG21 ' HG ' ' D' ' 834' ' ' LEU . 18.8 t -97.13 124.31 49.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.967 0.413 . . . . 10.0 111.618 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 851' ' ' TYR . . . . . 0.673 ' HD2' ' HB3' ' D' ' 858' ' ' LYS . 4.4 m-30 -101.96 130.61 48.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.111 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 852' ' ' ARG . . . . . 0.515 ' HG3' ' HB ' ' D' ' 861' ' ' THR . 20.0 mtm180 -96.79 146.54 24.81 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.719 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 853' ' ' LEU . . . . . 0.479 HD12 ' HB2' ' D' ' 874' ' ' GLU . 13.4 mt -90.26 89.33 7.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.103 -0.499 . . . . 10.0 111.876 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 73.5 mt -105.47 106.25 20.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 178.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt 63.35 21.56 12.86 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.161 0.505 . . . . 10.0 110.706 -178.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 93.61 -22.03 37.78 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.571 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 44.2 ttt-85 -81.25 122.45 27.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.718 0.294 . . . . 10.0 111.057 -179.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 858' ' ' LYS . . . . . 0.673 ' HB3' ' HD2' ' D' ' 851' ' ' TYR . 87.9 mttt -65.22 118.65 9.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.07 179.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 7.2 m -119.76 134.78 55.11 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.433 -0.349 . . . . 10.0 111.26 -179.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 17.4 t -71.03 137.17 24.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.833 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 861' ' ' THR . . . . . 0.515 ' HB ' ' HG3' ' D' ' 852' ' ' ARG . 3.0 t -127.1 164.71 20.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.091 179.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -90.84 159.13 16.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.756 0.312 . . . . 10.0 110.913 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 863' ' ' TRP . . . . . 0.515 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 96.5 m95 -79.53 -23.31 42.98 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.053 0.454 . . . . 10.0 110.801 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -79.75 -13.72 59.24 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.61 -179.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 865' ' ' THR . . . . . 0.408 ' O ' HG23 ' D' ' 830' ' ' VAL . 3.8 m -63.49 139.92 58.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.488 -0.324 . . . . 10.0 110.851 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 866' ' ' ALA . . . . . 0.474 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -74.94 147.42 40.91 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.293 -0.262 . . . . 10.0 110.293 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 867' ' ' ILE . . . . . 0.447 HD12 ' HG ' ' D' ' 870' ' ' LEU . 5.2 tp -83.75 4.87 2.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.912 0.387 . . . . 10.0 111.599 -179.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 868' ' ' ALA . . . . . 0.555 ' HB3' ' HD3' ' D' ' 869' ' ' PRO . . . -56.0 -58.01 18.7 Favored Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 113.595 0.961 . . . . 10.0 113.595 -179.112 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 869' ' ' PRO . . . . . 0.555 ' HD3' ' HB3' ' D' ' 868' ' ' ALA . 67.9 Cg_endo -86.56 33.95 0.45 Allowed 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.115 1.877 . . . . 10.0 112.597 -179.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 870' ' ' LEU . . . . . 0.447 ' HG ' HD12 ' D' ' 867' ' ' ILE . 3.1 mm? -105.07 -5.4 20.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.943 0.401 . . . . 10.0 111.724 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -70.48 131.97 44.84 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.762 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 103.51 -0.5 46.26 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.527 -0.844 . . . . 10.0 113.542 179.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -136.83 173.75 11.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.449 0.625 . . . . 10.0 111.733 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 874' ' ' GLU . . . . . 0.479 ' HB2' HD12 ' D' ' 853' ' ' LEU . 69.6 mt-10 -109.9 162.18 14.75 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.066 -0.516 . . . . 10.0 109.973 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 96.7 mt -131.13 119.5 22.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.43 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 876' ' ' ILE . . . . . 0.635 HD13 ' HE2' ' D' ' 858' ' ' LYS . 3.0 mp -106.65 124.61 62.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 877' ' ' VAL . . . . . 0.434 HG11 HD21 ' D' ' 838' ' ' LEU . 39.0 t -93.02 120.04 41.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 120.895 0.378 . . . . 10.0 110.828 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -106.48 153.73 21.87 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 94.7 t -118.37 118.68 58.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.834 -0.432 . . . . 10.0 109.834 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 37.9 mt . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.406 -0.806 . . . . 10.0 110.246 -179.488 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 26.0 mt . . . . . 0 C--O 1.22 -0.491 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 240' ' ' ARG . 45.4 mtt85 -72.43 -38.45 68.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.545 0.212 . . . . 10.0 111.364 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -65.12 -24.05 67.31 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.151 -0.685 . . . . 10.0 109.151 178.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . 0.541 ' OE1' ' HA ' ' C' ' 528' ' ' ARG . 8.3 mt-10 -89.83 -43.49 10.6 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.043 -0.98 . . . . 10.0 110.053 178.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . 0.612 ' HA ' ' HB2' ' A' ' 246' ' ' ASP . 75.4 mmm -59.38 -30.58 68.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.834 0.35 . . . . 10.0 111.114 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . 0.635 ' O ' ' HB2' ' A' ' 248' ' ' GLU . 1.4 p -66.05 -32.83 74.53 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 178.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 249' ' ' GLU . 42.1 mmtt -81.82 -43.69 17.94 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 108.695 -0.854 . . . . 10.0 108.695 178.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . 0.612 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.3 OUTLIER -52.47 -59.09 4.85 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.464 178.868 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 71.8 mt -65.19 -33.23 75.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.617 -0.719 . . . . 10.0 111.42 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . 0.635 ' HB2' ' O ' ' A' ' 244' ' ' SER . 28.3 tt0 -60.57 -54.78 41.27 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.924 -0.399 . . . . 10.0 109.924 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 245' ' ' LYS . 44.3 mt-10 -67.46 -37.82 83.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.511 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . 0.611 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 25.2 t -65.2 -46.41 90.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.618 -0.265 . . . . 10.0 111.246 179.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . 0.428 ' O ' HG12 ' A' ' 254' ' ' VAL . 97.7 mttt -71.67 -42.25 67.71 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.708 0.262 . . . . 10.0 111.708 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -65.19 -35.25 80.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.845 0.355 . . . . 10.0 110.658 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -88.33 -21.95 24.11 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.678 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.611 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -60.33 -27.83 40.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.743 0.306 . . . . 10.0 110.765 179.72 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -64.62 -63.9 3.25 Favored Pre-proline 0 N--CA 1.452 -0.337 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.587 178.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.29 -32.38 72.98 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 121.821 1.681 . . . . 10.0 111.841 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 5.8 m-30 -63.87 -51.12 66.05 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.769 0.319 . . . . 10.0 110.445 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 59.2 mt -73.87 -34.66 64.55 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.032 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . 0.411 ' HA ' HE21 ' A' ' 262' ' ' GLN . 32.3 t70 -64.06 -48.07 77.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.805 0.336 . . . . 10.0 110.737 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . 0.488 ' O ' ' HE2' ' A' ' 264' ' ' LYS . 38.3 t70 -60.72 -44.45 96.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.069 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -69.09 -34.8 75.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.649 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . 0.429 HE21 ' HB3' ' A' ' 262' ' ' GLN . 2.4 tt0 -63.57 -45.74 89.07 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 178.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . 0.519 ' O ' ' HG3' ' A' ' 267' ' ' GLU . 21.6 mttt -63.87 -42.66 97.45 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.044 -0.725 . . . . 10.0 109.044 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.526 ' HD2' ' HB1' ' C' ' 509' ' ' ALA . 0.1 OUTLIER -60.28 -48.7 80.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.438 178.565 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 1.6 m95 -60.75 -37.72 82.78 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.434 179.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -63.19 -50.41 70.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.86 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 13.0 mt-10 -62.25 -43.22 99.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 179.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . 0.455 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 26.6 mt-10 -60.74 -48.81 80.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.111 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 67.1 mmm -68.12 -40.48 82.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.499 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -62.69 -49.44 75.09 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.175 -0.305 . . . . 10.0 110.175 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 71.4 mt -64.73 -34.51 78.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.393 -0.595 . . . . 10.0 109.393 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . 0.427 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 11.9 t80 -64.5 -50.86 65.75 Favored 'General case' 0 C--O 1.217 -0.649 0 CA-C-N 115.495 -0.775 . . . . 10.0 109.753 178.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 273' ' ' ARG . 58.0 mtt180 -62.57 -42.35 99.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.926 0.393 . . . . 10.0 110.492 179.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -59.76 -25.44 64.89 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.956 -179.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.728 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 73.0 mttt -100.83 -36.45 9.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.435 179.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 3.0 t -51.92 -44.86 38.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 122.394 0.278 . . . . 10.0 111.17 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -60.37 -61.97 6.88 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 112.519 0.563 . . . . 10.0 112.519 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . 0.467 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 14.0 Cg_endo -59.53 -38.63 81.66 Favored 'Trans proline' 0 C--N 1.356 0.973 0 C-N-CA 121.886 1.724 . . . . 10.0 111.954 178.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.869 HD22 ' HG2' ' C' ' 495' ' ' LYS . 44.0 mt -65.66 -32.15 73.56 Favored 'General case' 0 N--CA 1.46 0.07 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -72.07 -33.92 68.3 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 177.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.22 -39.51 89.64 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 178.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 83.4 mt-10 -65.0 -45.88 83.75 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 108.78 -0.822 . . . . 10.0 108.78 178.046 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 47.8 mt -63.5 -37.82 88.76 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 115.364 -0.835 . . . . 10.0 109.946 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -66.41 -56.46 10.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.48 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -59.03 -46.21 88.79 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.737 -0.468 . . . . 10.0 109.737 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -59.72 -49.94 73.12 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 111.336 -0.706 . . . . 10.0 111.336 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.12 -40.51 94.05 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 110.596 -0.15 . . . . 10.0 110.596 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . 0.431 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 90.0 mtt180 -61.36 -42.18 98.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.57 -0.286 . . . . 10.0 110.233 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -64.9 -51.14 63.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.31 0.576 . . . . 10.0 109.656 178.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 50.9 mttt -60.2 -46.41 89.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.195 -0.912 . . . . 10.0 110.957 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 19.9 mt -67.05 -39.81 86.99 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.954 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . 0.431 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 20.2 t-160 -58.12 -46.55 85.4 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 297' ' ' LYS . 0.2 OUTLIER -65.3 -45.67 83.44 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.86 179.367 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . 0.435 ' O ' ' HG ' ' A' ' 298' ' ' LEU . 88.8 mt -64.5 -42.64 95.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.43 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -63.47 -42.5 98.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.7 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -77.8 -6.72 55.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.025 0.44 . . . . 10.0 110.932 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 293' ' ' GLU . 14.1 tptt -94.28 -37.04 11.71 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.19 -1.041 . . . . 10.0 108.19 177.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 294' ' ' LEU . 79.8 mt -62.93 -24.49 67.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.381 -0.827 . . . . 10.0 111.48 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . 0.522 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 0.7 OUTLIER -68.79 -65.12 1.4 Allowed Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 121.193 -0.203 . . . . 10.0 111.444 179.232 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . 0.522 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 30.8 Cg_endo -64.56 -42.86 14.95 Favored 'Trans proline' 0 C--N 1.358 1.047 0 C-N-CA 122.13 1.887 . . . . 10.0 111.894 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.813 HD22 ' HE2' ' C' ' 473' ' ' LYS . 45.0 mt -66.5 -29.98 70.21 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 179.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -72.73 -39.58 55.11 Favored Glycine 0 N--CA 1.445 -0.73 0 N-CA-C 110.265 -1.134 . . . . 10.0 110.265 178.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -61.27 -41.57 97.15 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.525 -0.917 . . . . 10.0 108.525 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' ' 308' ' ' ARG . 96.9 mt-10 -62.15 -49.38 76.06 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.27 -0.877 . . . . 10.0 108.905 178.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -59.22 -41.12 87.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.052 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 -62.62 -48.75 78.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.768 0.318 . . . . 10.0 110.332 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.35 -39.82 89.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.003 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . 1.25 ' HG3' ' CD1' ' C' ' 469' ' ' LEU . 2.4 mmt85 -66.9 -37.91 85.27 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.773 -0.455 . . . . 10.0 109.773 178.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -67.89 -36.78 80.84 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.376 -0.972 . . . . 10.0 108.376 177.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' A' ' 310' ' ' ARG . 36.0 ttm180 -61.67 -50.49 72.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.352 -0.84 . . . . 10.0 108.896 178.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.08 -41.12 95.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.146 0.498 . . . . 10.0 109.684 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . 0.416 ' HA ' ' HD3' ' C' ' 462' ' ' LYS . 0.8 OUTLIER -57.65 -56.21 24.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.487 179.314 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 83.6 t -69.68 -42.24 80.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.475 -0.784 . . . . 10.0 112.306 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . 0.563 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 0.5 OUTLIER -64.26 -43.2 95.58 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.518 -0.473 . . . . 10.0 111.493 -179.655 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 319' ' ' HIS . . . -65.06 -32.37 74.05 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.491 -0.929 . . . . 10.0 108.491 178.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 12.8 mt -70.5 -32.52 70.05 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.3 -0.864 . . . . 10.0 109.566 178.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . 0.563 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 95.3 mtt180 -64.69 -52.07 59.14 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 178.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.74 -11.31 58.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.829 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . 0.424 ' HB2' ' O ' ' A' ' 315' ' ' ALA . 0.1 OUTLIER -96.69 -47.47 5.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.975 178.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . 0.465 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 81.4 mt -67.71 -31.57 71.6 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.242 -0.436 . . . . 10.0 112.055 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . 0.409 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -55.86 -60.16 9.51 Favored Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 121.29 -0.164 . . . . 10.0 111.293 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . 0.409 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 42.5 Cg_endo -70.06 -30.86 20.23 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 121.492 1.461 . . . . 10.0 110.69 178.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . 0.465 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 3.7 m-30 -63.19 -43.03 99.37 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 116.544 -0.298 . . . . 10.0 111.379 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . 0.505 ' HA ' HD12 ' A' ' 327' ' ' LEU . 13.6 p -69.88 -30.83 68.38 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.087 -0.708 . . . . 10.0 109.087 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -68.5 -39.27 81.34 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.642 -0.873 . . . . 10.0 108.642 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 74.4 mt-10 -67.17 -36.29 81.48 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 107.859 -1.163 . . . . 10.0 107.859 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . 0.522 ' HA ' ' HG2' ' A' ' 330' ' ' ARG . 70.0 mt -61.82 -38.08 86.82 Favored 'General case' 0 C--O 1.222 -0.361 0 N-CA-C 108.681 -0.859 . . . . 10.0 108.681 178.02 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 328' ' ' ARG . 48.6 mtt180 -67.63 -33.28 74.65 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -67.17 -53.67 28.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.763 -0.653 . . . . 10.0 109.455 178.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . 0.539 ' O ' ' HG2' ' A' ' 334' ' ' ARG . 7.7 ptp180 -63.98 -39.46 94.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.915 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 19.0 mt -61.6 -43.55 98.65 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 178.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.82 -47.47 84.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.674 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.58 -47.37 85.84 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.348 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . 0.566 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 8.1 mmt180 -61.69 -44.67 96.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.336 179.273 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 63.5 mt -65.57 -44.05 87.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.775 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -61.5 -37.04 82.22 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.044 0.45 . . . . 10.0 110.354 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -74.53 -43.31 56.41 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.445 -0.576 . . . . 10.0 109.445 178.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 7.9 mt -63.8 -27.61 69.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.637 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -76.24 -40.35 52.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.893 0.378 . . . . 10.0 110.139 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -71.47 -53.96 12.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.064 -0.516 . . . . 10.0 109.633 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . 0.432 HD21 ' HA3' ' C' ' 436' ' ' GLY . 98.0 m-20 -65.89 -31.21 72.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.629 -0.714 . . . . 10.0 109.724 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -70.6 -42.61 62.71 Favored Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.141 -0.783 . . . . 10.0 111.141 178.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.18 -40.96 99.66 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 109.637 -1.385 . . . . 10.0 109.637 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -67.84 -43.01 80.5 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.157 -0.683 . . . . 10.0 109.157 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 20.9 mtt180 -54.55 -50.7 67.31 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.406 178.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 87.7 mt -58.98 -42.89 91.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.498 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -64.15 -45.79 86.9 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -60.36 -50.61 72.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.128 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -59.05 -43.72 91.72 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.062 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -68.74 -44.64 73.34 Favored 'General case' 0 C--N 1.33 -0.252 0 O-C-N 123.11 0.257 . . . . 10.0 111.434 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.57 -33.3 73.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.234 0.54 . . . . 10.0 110.688 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . 0.649 ' HG2' HG22 ' C' ' 422' ' ' VAL . 4.9 mtmm -86.75 -20.71 27.25 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.246 178.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -72.49 -38.74 68.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.086 -0.506 . . . . 10.0 109.764 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -40.63 94.79 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 178.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -69.16 -27.56 65.64 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.671 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -71.33 -47.77 54.52 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 108.159 -1.052 . . . . 10.0 108.159 177.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 84.9 mt -62.26 -43.2 99.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.124 -0.944 . . . . 10.0 111.984 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 10.0 p -60.43 -50.41 73.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.731 0.3 . . . . 10.0 111.095 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 7.5 p -66.38 -35.96 81.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.942 179.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 34.1 mt -67.27 -31.6 72.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.429 -0.35 . . . . 10.0 110.185 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 50.7 m -67.81 -29.34 68.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.147 0.499 . . . . 10.0 109.929 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . 0.45 ' C ' ' HD2' ' A' ' 366' ' ' PRO . 11.4 mt-10 -76.3 -5.18 45.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.526 0.679 . . . . 10.0 109.73 178.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.552 ' O ' ' HB3' ' A' ' 367' ' ' ALA . 39.6 mttm -109.13 -38.92 5.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.83 -0.804 . . . . 10.0 108.83 178.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -71.07 -21.12 62.28 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.502 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.817 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 99.5 mttt -105.62 -74.48 0.02 OUTLIER Pre-proline 0 CA--C 1.537 0.448 0 N-CA-C 112.457 0.54 . . . . 10.0 112.457 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.817 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 32.2 Cg_exo -59.63 -47.74 15.27 Favored 'Trans proline' 0 C--N 1.357 1.005 0 C-N-CA 122.27 1.98 . . . . 10.0 113.278 -179.273 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . 0.552 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -66.93 -43.19 83.9 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.912 -0.315 . . . . 10.0 111.327 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 1.1 mt -65.92 -39.05 90.18 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 121.03 -0.268 . . . . 10.0 110.901 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . 0.639 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 5.6 mm-40 -64.43 -38.55 91.42 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.036 -0.728 . . . . 10.0 109.036 178.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -63.37 -41.44 98.82 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 79.3 mt -62.82 -45.0 94.66 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.362 -0.836 . . . . 10.0 110.006 178.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 72.0 mtt180 -64.95 -40.11 94.52 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.583 -0.525 . . . . 10.0 109.583 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.639 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.5 mt-30 -63.54 -30.97 72.01 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.56 -0.745 . . . . 20.0 112.051 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -85.75 -34.85 12.43 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 109.481 -1.448 . . . . 10.0 109.481 178.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 13.9 mt -57.11 -41.88 79.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.652 -0.274 . . . . 10.0 111.51 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 72.8 mt -54.34 -62.98 3.14 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 112.491 0.552 . . . . 10.0 112.491 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -63.39 -37.52 48.87 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 121.836 1.691 . . . . 10.0 111.657 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 18.3 t -61.66 -49.39 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 O-C-N 122.986 0.179 . . . . 10.0 110.677 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 59.4 mt -61.38 -39.45 90.72 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.503 -0.554 . . . . 10.0 109.503 178.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . 0.499 ' O ' HG23 ' A' ' 384' ' ' VAL . 19.1 mt-10 -63.24 -49.28 74.75 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.678 178.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 5.1 p -63.02 -38.92 93.11 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 120.928 0.394 . . . . 10.0 110.541 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -65.42 -43.43 90.52 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.737 178.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . 0.441 ' O ' ' HG ' ' A' ' 387' ' ' LEU . 83.5 mttt -61.81 -40.25 94.59 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.357 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 380' ' ' GLU . 73.2 t -60.43 -44.99 97.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 13.5 m -63.73 -42.66 97.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.706 178.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -64.38 -41.13 96.84 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.941 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 383' ' ' LYS . 83.6 mt -60.1 -37.95 81.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.37 0.605 . . . . 10.0 110.372 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . 0.736 ' HB3' ' HE2' ' C' ' 594' ' ' LYS . 13.1 m -77.27 -41.11 42.22 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.681 -0.69 . . . . 10.0 110.002 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -62.83 -43.52 98.58 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.692 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 77.6 mt -65.54 -32.46 74.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.852 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -66.14 -49.04 68.84 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 179.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.49 -29.05 70.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.742 -0.663 . . . . 10.0 109.891 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -67.86 -20.87 65.18 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.48 0.712 . . . . 10.0 111.078 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.89 12.07 31.08 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 121.091 0.472 . . . . 10.0 110.705 -179.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . 0.403 ' HE3' ' HB2' ' A' ' 395' ' ' LYS . 46.3 mtmt . . . . . 0 C--N 1.316 -0.869 0 CA-C-O 121.09 0.471 . . . . 10.0 111.265 179.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.541 0.62 0 CA-C-O 120.783 0.325 . . . . 10.0 111.518 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 12.9 mt -78.08 -31.61 50.27 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.874 -0.417 . . . . 10.0 109.874 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -71.81 -47.87 50.29 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.009 -0.996 . . . . 10.0 111.51 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -62.91 -42.58 99.84 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 114.956 -1.02 . . . . 10.0 110.567 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -37.43 75.98 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 123.337 0.398 . . . . 10.0 110.563 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -62.18 -44.15 97.24 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.326 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 3.1 m -64.89 -36.11 83.3 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.331 0.586 . . . . 10.0 109.582 178.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 62.4 t -67.47 -46.95 82.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.06 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 52.6 m -60.83 -43.58 98.07 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.441 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 28.7 m -62.71 -40.41 97.05 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 120.846 0.355 . . . . 10.0 110.633 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 10.9 p -76.65 -11.23 59.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 10.0 111.057 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . 0.511 ' O ' ' HB2' ' C' ' 415' ' ' LEU . 45.8 t80 -85.6 -38.59 18.27 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 108.667 -0.864 . . . . 10.0 108.667 177.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 24.9 m -62.25 -39.91 94.42 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.616 -0.883 . . . . 10.0 108.616 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -66.49 -19.81 65.88 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.284 -0.871 . . . . 10.0 110.451 178.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . 0.511 ' HB2' ' O ' ' C' ' 412' ' ' PHE . 30.1 mt -76.37 -32.97 58.91 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 108.529 -0.915 . . . . 10.0 108.529 177.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 -74.16 -42.59 59.68 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 178.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -68.17 -14.09 62.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.624 -0.717 . . . . 10.0 109.852 178.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -94.67 -53.72 3.77 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.171 -0.922 . . . . 10.0 108.989 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . 0.419 ' HA ' ' HB ' ' C' ' 422' ' ' VAL . 43.5 mt -60.32 -28.92 68.52 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.711 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -54.19 -73.03 0.45 Allowed Glycine 0 CA--C 1.518 0.256 0 N-CA-C 111.37 -0.692 . . . . 10.0 111.37 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.32 -34.9 98.67 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.391 2.061 . . . . 10.0 111.177 178.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . 0.649 HG22 ' HG2' ' A' ' 352' ' ' LYS . 12.6 t -58.87 -50.0 81.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.273 -0.422 . . . . 10.0 111.08 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 18.4 p -70.22 -38.2 75.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.66 0.267 . . . . 10.0 110.805 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -60.52 -48.32 82.27 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.816 -0.439 . . . . 10.0 109.816 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -67.39 -37.75 83.61 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.077 -0.511 . . . . 10.0 109.624 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -63.19 -36.91 85.2 Favored 'General case' 0 C--O 1.225 -0.188 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 28.4 m95 -66.27 -42.9 87.79 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 178.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . 0.554 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 37.7 t70 -65.17 -37.31 86.98 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.972 -0.751 . . . . 10.0 108.972 178.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -65.28 -44.79 86.9 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.702 -0.851 . . . . 10.0 108.702 177.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 46.9 mt -62.38 -32.43 73.24 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.469 -0.787 . . . . 10.0 109.371 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -66.37 -41.6 89.23 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 178.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . 0.554 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 53.0 mttp -64.72 -45.27 87.22 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 108.423 -0.954 . . . . 10.0 108.423 178.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -61.2 -48.42 81.63 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.051 -0.977 . . . . 10.0 110.734 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 10.7 p -66.17 -38.6 88.44 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.826 -0.17 . . . . 10.0 111.195 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -61.59 -47.59 84.76 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.843 -0.799 . . . . 10.0 108.843 178.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . 0.432 ' HA3' HD21 ' A' ' 341' ' ' ASN . . . -63.87 -46.5 91.49 Favored Glycine 0 N--CA 1.443 -0.889 0 N-CA-C 110.048 -1.221 . . . . 10.0 110.048 177.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 34.6 mt -58.61 -33.26 69.81 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-O 120.517 0.199 . . . . 10.0 110.925 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -70.32 -38.29 74.9 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 178.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -71.39 -30.54 66.24 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.017 -0.735 . . . . 10.0 109.017 178.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . 0.566 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 37.4 mt-10 -75.29 -57.56 3.82 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.253 -0.885 . . . . 10.0 109.782 178.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 95.7 mmm -61.71 -29.21 69.95 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 113.743 1.016 . . . . 10.0 113.743 -178.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 5.5 p -63.15 -51.87 64.72 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -71.62 -36.23 70.71 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.587 -0.733 . . . . 10.0 109.531 178.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 5.7 t0 -57.29 -57.72 11.39 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.503 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 24.9 mt -64.18 -37.13 86.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.568 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -62.67 -49.94 73.16 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 178.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . 0.474 ' HB3' HH21 ' A' ' 330' ' ' ARG . 7.5 tt0 -66.14 -34.02 77.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.661 -0.7 . . . . 10.0 109.662 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . 0.534 HG23 HH22 ' A' ' 330' ' ' ARG . 2.6 t -60.96 -46.93 95.63 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.232 0 N-CA-C 109.367 -0.605 . . . . 10.0 109.367 178.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 83.9 mttt -67.21 -38.38 85.21 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 178.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -70.35 -11.69 61.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.318 178.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . 0.637 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 43.3 mttm -98.76 -50.1 4.35 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 63.0 t -58.22 -41.71 81.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.688 -0.687 . . . . 10.0 111.998 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -53.95 -63.52 2.57 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 112.213 0.449 . . . . 10.0 112.213 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . 0.418 ' HG2' ' OH ' ' A' ' 323' ' ' TYR . 43.1 Cg_endo -70.98 -20.9 28.5 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 121.643 1.562 . . . . 10.0 111.789 179.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . 0.637 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.4 OUTLIER -70.0 -50.85 37.4 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 179.1 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . 0.457 ' O ' ' HB2' ' C' ' 460' ' ' GLN . 17.5 mt -69.47 -36.31 76.45 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.061 -0.518 . . . . 10.0 109.915 179.154 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . 0.426 ' O ' ' HG3' ' C' ' 461' ' ' LYS . 7.7 t70 -62.13 -40.45 95.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.286 0.565 . . . . 10.0 110.558 179.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -79.33 -42.67 25.16 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.621 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . 0.444 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 1.0 OUTLIER -63.31 -40.89 98.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.662 179.377 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' C' ' 456' ' ' LEU . 6.6 mt-30 -62.44 -36.61 82.97 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.446 179.02 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . 0.426 ' HG3' ' O ' ' C' ' 457' ' ' ASP . 17.9 mttp -67.35 -40.6 85.84 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.054 -0.721 . . . . 10.0 109.054 178.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' C' ' 466' ' ' GLU . 15.5 mtmm -65.7 -43.74 88.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.324 178.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . 0.499 ' O ' ' HB2' ' C' ' 467' ' ' MET . 23.6 m0 -66.39 -34.4 77.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.15 178.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . 0.553 ' O ' ' HG3' ' C' ' 468' ' ' GLU . 15.6 mt-30 -67.0 -53.03 35.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.281 179.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 0.979 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 4.1 pt-20 -63.3 -31.61 72.8 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.076 0.465 . . . . 10.0 110.295 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . 0.506 ' HA ' HD12 ' C' ' 469' ' ' LEU . 6.9 tt0 -73.83 -37.82 64.72 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.188 -0.671 . . . . 10.0 109.188 178.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . 0.499 ' HB2' ' O ' ' C' ' 463' ' ' TRP . 0.0 OUTLIER -63.64 -45.73 88.9 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.743 -0.836 . . . . 10.0 108.743 178.609 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . 0.553 ' HG3' ' O ' ' C' ' 464' ' ' GLN . 46.4 mt-10 -62.42 -40.45 96.58 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.498 -0.927 . . . . 10.0 108.498 178.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 1.25 ' CD1' ' HG3' ' A' ' 308' ' ' ARG . 96.4 mt -61.92 -40.16 94.53 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 115.169 -0.923 . . . . 20.0 110.0 178.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 13.8 m-30 -67.23 -41.26 86.0 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.501 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -60.82 -48.57 81.21 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . 0.453 HE21 ' HB3' ' C' ' 472' ' ' GLN . 0.0 OUTLIER -82.34 28.12 0.47 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.595 179.596 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . 0.813 ' HE2' HD22 ' A' ' 301' ' ' LEU . 0.0 OUTLIER -134.99 -62.78 0.71 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.383 -0.826 . . . . 10.0 109.028 178.675 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 61.8 t -65.66 -39.11 83.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.26 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -62.42 -58.62 16.18 Favored Pre-proline 0 CA--C 1.535 0.394 0 N-CA-C 112.061 0.393 . . . . 10.0 112.061 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -63.52 -37.88 45.39 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 121.649 1.566 . . . . 10.0 111.389 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' C' ' 477' ' ' LEU . 29.2 mt -66.98 -31.38 71.91 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.49 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -63.56 -36.19 82.98 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -70.89 -43.31 68.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.492 178.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.95 -43.61 95.29 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 59.1 mt -68.95 -30.48 68.94 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.551 -0.75 . . . . 10.0 110.195 178.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -66.97 -47.54 71.27 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -69.26 -34.27 74.51 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -68.21 -40.94 87.56 Favored Glycine 0 N--CA 1.445 -0.724 0 N-CA-C 109.873 -1.291 . . . . 10.0 109.873 177.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.41 76.72 Favored 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 44.8 mtt180 -61.73 -41.56 97.8 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . 0.542 ' O ' ' HG3' ' C' ' 491' ' ' GLU . 0.0 OUTLIER -63.69 -44.22 94.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.363 178.007 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . 0.402 ' O ' ' HG ' ' C' ' 492' ' ' LEU . 83.0 tttt -67.14 -40.4 86.74 Favored 'General case' 0 C--N 1.33 -0.249 0 O-C-N 123.276 0.36 . . . . 10.0 110.355 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 45.6 mt -64.76 -44.51 89.83 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.349 -0.611 . . . . 10.0 109.349 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.04 -39.19 91.48 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 108.795 -0.817 . . . . 10.0 108.795 178.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . 0.726 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 36.7 mt-10 -61.71 -49.97 74.31 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 108.133 -1.062 . . . . 10.0 108.133 177.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' C' ' 488' ' ' LYS . 90.3 mt -58.89 -37.34 76.36 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.872 -0.603 . . . . 10.0 110.674 179.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -63.69 -37.05 85.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.91 0.386 . . . . 10.0 110.151 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -88.93 -0.88 57.78 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.626 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.869 ' HG2' HD22 ' A' ' 279' ' ' LEU . 12.3 mttm -113.37 -55.75 2.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.817 0.341 . . . . 10.0 110.998 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 90.8 mt -64.96 -31.52 72.8 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.913 0.709 . . . . 10.0 112.913 -178.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 12.8 m -68.14 -59.09 6.69 Favored Pre-proline 0 CA--C 1.537 0.459 0 C-N-CA 120.722 -0.391 . . . . 10.0 112.005 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -62.63 -36.63 62.8 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.745 1.63 . . . . 10.0 110.866 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 34.5 mt -71.04 -34.96 71.77 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.095 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -65.7 -49.56 58.96 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 110.725 -0.95 . . . . 10.0 110.725 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.11 -41.63 97.03 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 178.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . 0.474 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 25.0 tt0 -64.84 -47.61 77.34 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.493 -0.776 . . . . 10.0 109.819 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . 0.786 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 62.9 mmm -59.44 -38.05 79.7 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.752 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 20.5 mtt85 -64.98 -40.47 95.03 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 178.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . 0.519 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 0.4 OUTLIER -70.63 -36.1 73.27 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 178.599 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.786 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 44.3 mtt180 -62.87 -45.86 90.57 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 107.442 -1.318 . . . . 10.0 107.442 177.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -62.21 -38.73 90.29 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 114.857 -1.065 . . . . 10.0 109.361 178.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . 0.519 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 78.7 mtt180 -58.3 -53.57 56.81 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . 0.526 ' HB1' ' HD2' ' A' ' 264' ' ' LYS . . . -60.08 -36.14 76.73 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.485 -0.78 . . . . 10.0 111.144 179.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . 0.5 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 16.2 m-70 -74.47 -49.64 21.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.577 0.227 . . . . 10.0 111.549 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 79.2 t -65.74 -41.67 90.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 120.715 0.293 . . . . 10.0 110.509 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.403 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 3.3 t70 -63.97 -37.41 87.32 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.48 -44.78 86.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.344 -0.984 . . . . 10.0 108.344 177.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 89.2 mt -58.99 -32.67 69.89 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.372 178.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . 0.403 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 66.4 mtt180 -65.04 -34.7 79.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.326 178.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.3 5.19 46.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.684 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 44.2 m170 -117.22 -43.97 2.81 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.848 0.314 . . . . 10.0 111.848 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 92.1 mt -90.07 -47.83 7.57 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.409 0.522 . . . . 10.0 112.409 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . 0.411 ' N ' ' HD2' ' C' ' 520' ' ' PRO . . . -50.54 -55.37 26.68 Favored Pre-proline 0 N--CA 1.468 0.472 0 N-CA-C 112.904 0.705 . . . . 10.0 112.904 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . 0.411 ' HD2' ' N ' ' C' ' 519' ' ' ALA . 29.7 Cg_endo -64.91 -31.8 56.0 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 121.692 1.595 . . . . 10.0 110.701 178.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -64.11 -43.85 94.06 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.725 -0.67 . . . . 10.0 109.786 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.85 -31.24 71.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.001 0.429 . . . . 10.0 109.968 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . 0.688 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 30.3 t70 -70.02 -39.14 75.97 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.425 -0.583 . . . . 10.0 109.425 178.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -72.38 -33.23 67.05 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 177.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . 0.741 HD23 ' HD2' ' C' ' 528' ' ' ARG . 25.3 mt -66.89 -29.13 68.94 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.541 -0.754 . . . . 10.0 109.23 177.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . 0.688 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 63.5 mtt180 -60.91 -38.62 86.37 Favored 'General case' 0 C--O 1.224 -0.249 0 N-CA-C 109.681 -0.489 . . . . 10.0 109.681 178.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . 0.434 HE21 ' HB2' ' C' ' 527' ' ' GLN . 15.5 mt-30 -66.95 -44.47 80.5 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.831 -0.803 . . . . 10.0 108.831 178.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . 0.741 ' HD2' HD23 ' C' ' 525' ' ' LEU . 77.6 mtt180 -63.85 -41.77 97.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 114.849 -1.069 . . . . 10.0 110.662 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 62.1 mt -68.09 -43.18 79.08 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.256 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.87 -43.51 98.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.922 179.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.3 -45.1 77.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.361 -0.381 . . . . 10.0 110.153 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . 0.569 ' NH2' ' HB3' ' C' ' 528' ' ' ARG . 1.1 ttm180 -61.9 -40.58 95.96 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' C' ' 537' ' ' LYS . 18.9 mt -64.29 -36.6 84.64 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.021 178.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -66.37 -40.92 90.02 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.839 -0.43 . . . . 10.0 109.839 178.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.26 -45.8 86.49 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 178.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 91.6 mt -69.94 -19.05 63.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.539 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . 0.501 ' HB2' ' O ' ' C' ' 533' ' ' LEU . 64.7 tttt -82.23 -44.37 16.42 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.662 -0.496 . . . . 10.0 109.662 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -68.6 -50.23 53.17 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -67.97 -37.58 81.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.727 -0.669 . . . . 10.0 109.388 179.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . 0.517 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -65.75 -43.04 94.84 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.251 -0.74 . . . . 10.0 111.251 179.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -63.18 -42.54 99.39 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 110.399 -1.08 . . . . 10.0 110.399 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -64.3 -42.69 96.24 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . 0.401 ' HD2' HH11 ' C' ' 543' ' ' ARG . 44.4 mtt85 -60.14 -39.54 86.71 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.367 179.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 79.8 mt -58.62 -42.23 87.76 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 178.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.92 -45.33 74.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.754 -0.657 . . . . 10.0 109.437 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -60.0 -48.49 81.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.318 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -59.72 -39.84 86.03 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.261 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 40.5 m170 -65.98 -43.26 88.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.449 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.48 -44.8 85.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.091 -0.504 . . . . 10.0 109.876 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . 0.473 ' HA ' ' OE1' ' C' ' 553' ' ' GLU . 0.2 OUTLIER -67.85 -27.33 66.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.256 179.345 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.62 -44.7 73.66 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.163 -0.68 . . . . 10.0 109.163 178.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.94 -38.19 85.71 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.702 -0.481 . . . . 10.0 109.702 178.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . 0.473 ' OE1' ' HA ' ' C' ' 550' ' ' LYS . 85.2 mt-10 -63.86 -36.71 84.83 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -72.05 -45.65 59.97 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.105 178.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 63.1 mt -61.68 -38.74 88.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.099 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 33.9 m -64.4 -46.35 83.68 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.5 -0.318 . . . . 10.0 110.38 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 1.1 p -69.47 -26.94 64.81 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.103 0.477 . . . . 10.0 110.694 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 54.2 mt -77.91 -25.84 48.68 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.391 178.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 56.7 m -64.59 -41.24 96.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.042 0.449 . . . . 10.0 111.112 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -72.96 -11.47 60.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.176 0.512 . . . . 10.0 111.005 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . 0.51 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 11.3 mptt -104.51 -28.13 11.48 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.792 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -83.96 -18.49 37.09 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.433 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . 0.853 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 50.0 mtmt -112.29 -74.9 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.348 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . 0.853 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 74.7 Cg_exo -52.92 -49.19 18.45 Favored 'Trans proline' 0 C--N 1.359 1.081 0 C-N-CA 122.171 1.914 . . . . 10.0 112.517 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -64.07 -40.18 95.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.698 0.285 . . . . 10.0 110.923 179.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 49.5 tp -66.78 -38.87 87.41 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.579 -0.282 . . . . 10.0 110.46 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . 0.928 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 4.0 mm-40 -59.06 -45.56 90.46 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -68.91 -41.59 77.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.449 178.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 43.6 mt -58.98 -44.93 91.66 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.837 0.351 . . . . 10.0 110.123 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . 0.454 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 60.1 mtt180 -68.85 -35.54 77.07 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.576 -0.528 . . . . 10.0 109.576 178.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . 0.928 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.6 mt-30 -66.28 -30.68 71.16 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.447 -0.797 . . . . 20.0 111.346 179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -84.02 -35.76 14.73 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 109.429 -1.468 . . . . 10.0 109.429 178.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 17.8 mt -62.28 -34.47 76.63 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 122.044 0.138 . . . . 10.0 111.302 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . 0.6 ' O ' ' HG3' ' C' ' 578' ' ' GLU . 91.4 mt -55.63 -63.25 3.34 Favored Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 112.003 0.372 . . . . 10.0 112.003 179.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . 0.428 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 36.5 Cg_endo -67.38 -29.25 38.34 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.877 1.718 . . . . 10.0 111.708 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 4.7 t -64.9 -45.21 95.49 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 N-CA-C 109.343 -0.614 . . . . 10.0 109.343 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' C' ' 581' ' ' LYS . 26.7 mt -64.5 -39.51 93.93 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.614 -0.513 . . . . 10.0 109.614 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . 0.6 ' HG3' ' O ' ' C' ' 574' ' ' LEU . 48.2 mt-10 -63.17 -51.19 67.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.056 179.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 4.7 p -62.19 -41.33 98.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.779 0.323 . . . . 10.0 110.343 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -61.7 -48.27 81.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.072 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' C' ' 577' ' ' LEU . 41.8 mtmt -58.75 -46.77 86.7 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.406 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.95 -48.49 83.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.887 0.375 . . . . 10.0 110.286 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 16.2 m -61.62 -44.06 97.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.109 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -66.97 -41.18 87.3 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.521 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' C' ' 581' ' ' LYS . 73.2 mt -59.28 -51.28 70.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.875 0.369 . . . . 10.0 110.483 179.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 13.1 m -63.87 -35.23 79.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.652 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -67.8 -45.35 75.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.574 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 86.2 mt -65.11 -37.03 86.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.011 0.434 . . . . 10.0 110.311 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -66.6 -29.77 69.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.461 179.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -79.5 -44.66 20.81 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.046 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -63.59 -41.89 98.32 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.805 0.669 . . . . 10.0 112.805 -179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . 0.457 ' O ' ' HB2' ' C' ' 596' ' ' ASN . 2.1 p -60.69 -28.59 68.74 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.836 0.31 . . . . 10.0 111.836 -179.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -69.19 -40.21 78.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.043 0.449 . . . . 10.0 110.499 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . 0.736 ' HE2' ' HB3' ' A' ' 388' ' ' SER . 5.1 mptt -76.68 -37.61 55.9 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.96 -0.564 . . . . 10.0 111.105 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 90.1 mt -85.36 34.53 0.57 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.649 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . 0.457 ' HB2' ' O ' ' C' ' 592' ' ' THR . 9.2 t-20 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.515 -0.755 . . . . 10.0 110.007 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 14.6 t . . . . . 0 C--O 1.237 0.405 0 CA-C-O 120.774 0.321 . . . . 10.0 110.601 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . 0.441 ' HA ' ' O ' ' B' ' 52' ' ' LEU . 24.9 tt0 -116.29 101.37 8.62 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.884 -0.413 . . . . 10.0 109.884 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -73.7 144.49 45.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.676 -178.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.419 ' HB3' ' HA2' ' B' ' 75' ' ' GLY . 4.0 mptt -100.37 113.91 27.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.493 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.62 HD22 HD23 ' B' ' 159' ' ' LEU . 34.3 mt -110.01 108.9 19.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.49 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 58.8 t -101.89 115.09 43.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-O 120.961 0.41 . . . . 10.0 110.918 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 21.3 t -91.73 117.74 35.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.537 ' HB ' ' CE1' ' B' ' 96' ' ' TYR . 26.8 m -112.88 165.45 7.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 120.995 0.426 . . . . 10.0 111.327 -179.477 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 151.07 174.23 21.8 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.21 -0.756 . . . . 10.0 111.21 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.16 177.29 6.01 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.922 0.391 . . . . 10.0 111.271 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.84 125.64 8.48 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.873 -0.679 . . . . 10.0 111.775 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 115.24 -12.98 19.19 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.775 -0.726 . . . . 10.0 112.514 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 20.9 m -72.54 -31.73 38.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 112.003 0.371 . . . . 10.0 112.003 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 93.65 43.4 3.94 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.54 -0.838 . . . . 10.0 113.204 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 42.0 mtmt -62.13 -46.88 87.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.854 0.359 . . . . 10.0 111.64 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.5 p -63.26 -36.52 83.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.465 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.48 -47.15 82.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.653 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 45.1 mt -62.69 -44.27 96.67 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.918 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 12.7 m -64.88 -50.15 67.67 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.672 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 97.4 mt -65.43 -28.26 43.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-O 120.782 0.325 . . . . 10.0 110.999 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.644 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 6.5 tp-100 -68.29 -22.62 64.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.153 0.501 . . . . 10.0 110.8 179.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.7 tp -96.93 -41.48 8.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.306 0.574 . . . . 10.0 110.481 179.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . 0.644 ' HA ' ' HD2' ' B' ' 42' ' ' LYS . 51.1 mm -73.88 -49.16 35.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.691 -0.686 . . . . 10.0 112.506 -178.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . 0.517 ' NE2' ' HA ' ' D' ' 840' ' ' VAL . 5.8 mt-30 -107.83 -18.92 13.69 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.092 0.404 . . . . 10.0 112.092 -178.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.552 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 33.1 m-80 66.61 35.22 5.45 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.468 -0.938 . . . . 10.0 108.468 -177.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -124.53 130.99 53.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 114.183 -1.371 . . . . 10.0 109.628 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -93.51 134.76 35.45 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.456 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 16.7 m -100.43 138.41 24.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.996 0.427 . . . . 10.0 111.031 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -103.46 -26.57 12.82 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.508 0.671 . . . . 10.0 109.838 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -78.38 148.31 33.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.384 -0.826 . . . . 10.0 110.726 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -91.47 77.64 5.74 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.651 -0.5 . . . . 10.0 109.651 178.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.85 134.91 68.06 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.094 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.49 177.17 3.48 Favored 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 123.081 2.521 . . . . 10.0 112.849 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -166.72 135.37 2.82 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.199 0.523 . . . . 10.0 112.163 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.823 HD11 HG21 ' D' ' 809' ' ' THR . 4.3 mt -119.98 -67.01 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 108.551 -0.907 . . . . 10.0 108.551 179.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.453 ' O ' HG23 ' D' ' 821' ' ' VAL . 4.0 tt0 -146.08 92.39 2.19 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.372 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . 0.711 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 57.7 m-20 -111.79 160.84 16.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.379 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . 0.415 ' HA ' ' O ' ' B' ' 55' ' ' ILE . 1.7 p -148.1 139.89 23.88 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.643 -0.253 . . . . 10.0 111.594 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . 0.659 ' CE2' HG22 ' D' ' 840' ' ' VAL . 24.3 m-85 -125.53 145.28 50.18 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -178.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . 0.459 ' NH1' ' HD3' ' D' ' 817' ' ' LYS . 1.2 ttp180 -126.81 127.98 45.85 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.754 0.311 . . . . 10.0 111.561 -178.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . 0.644 ' HD2' ' HA ' ' B' ' 24' ' ' ILE . 37.9 tttp -151.24 150.69 30.87 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.589 178.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -114.07 125.2 53.71 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 110.326 -0.249 . . . . 10.0 110.326 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 10.3 m -136.19 158.83 38.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.965 0.412 . . . . 10.0 110.848 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 47.2 t -99.77 107.11 20.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.414 -0.587 . . . . 10.0 109.414 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 72.7 mt -106.19 120.01 56.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.82 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.88 16.1 7.71 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.808 0.67 . . . . 10.0 112.808 178.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.21 -9.03 45.64 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.755 -0.736 . . . . 10.0 112.666 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -106.97 124.33 49.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.037 0.446 . . . . 10.0 110.665 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 9.5 t -85.75 128.1 34.71 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.101 -0.499 . . . . 10.0 109.742 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 1.6 p -144.71 163.05 35.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.866 0.365 . . . . 10.0 111.42 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' B' ' 3' ' ' GLU . 15.1 tp -97.5 135.75 38.91 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.09 -0.708 . . . . 10.0 109.09 179.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 90.6 mt -113.6 122.72 48.06 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 111.986 0.365 . . . . 10.0 111.986 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -103.53 102.33 12.23 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.103 -1.073 . . . . 10.0 108.103 177.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.566 HD12 HD11 ' B' ' 24' ' ' ILE . 44.8 mt -93.58 129.52 43.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.447 -178.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.406 HD21 ' CD1' ' B' ' 71' ' ' TYR . 53.4 tp -105.94 116.0 31.2 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.943 -0.572 . . . . 10.0 111.206 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.711 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 7.3 t0 -92.97 93.2 8.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.236 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 48.7 p -72.61 162.71 29.13 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.203 -0.908 . . . . 10.0 112.155 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.6 159.07 32.68 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.232 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -80.05 -32.07 37.03 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.747 -0.739 . . . . 10.0 111.918 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -139.24 128.45 23.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.618 0.247 . . . . 20.0 110.541 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -169.92 142.88 2.46 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.591 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -100.98 -141.33 0.34 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.252 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -68.22 122.43 18.3 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . 0.4 ' HB3' ' HB3' ' B' ' 68' ' ' ARG . 13.5 t -144.99 125.08 13.61 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.172 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.27 -31.79 72.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.111 0.482 . . . . 10.0 109.909 179.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 40.7 mmm -70.86 -44.52 66.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.691 -0.686 . . . . 10.0 109.599 179.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.554 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 47.9 ttt85 -63.27 -44.86 93.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.71 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.446 ' O ' ' HB2' ' B' ' 73' ' ' ARG . 0.1 OUTLIER -59.25 -20.84 57.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.677 -0.692 . . . . 10.0 111.593 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.93 -47.92 6.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.114 179.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . 0.554 ' CE2' ' HA ' ' B' ' 68' ' ' ARG 0.253 0.5 OUTLIER -66.01 -28.52 68.94 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 113.121 0.786 . . . . 10.0 113.121 -178.968 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 2.7 mtp -91.82 4.07 53.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.185 0.517 . . . . 10.0 110.609 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' B' ' 69' ' ' ASP . 11.7 ttm180 -98.33 -28.35 13.7 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.135 0.493 . . . . 10.0 110.402 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.6 -5.7 53.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.615 -0.72 . . . . 10.0 112.119 -179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . 0.419 ' HA2' ' HB3' ' B' ' 5' ' ' LYS . . . -83.15 144.16 22.46 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.552 -0.832 . . . . 10.0 112.701 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -96.68 -49.28 5.16 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.033 0.444 . . . . 10.0 110.005 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -112.19 139.61 15.73 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 111.203 -0.759 . . . . 10.0 111.203 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.403 ' O ' ' HA ' ' B' ' 111' ' ' MET . 62.2 m-85 -121.25 123.58 42.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.166 0.507 . . . . 10.0 111.999 -179.079 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.921 ' HG ' HD22 ' B' ' 159' ' ' LEU . 45.0 mt -95.4 108.72 20.94 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.107 179.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 11.4 m -84.58 88.93 7.36 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.991 -0.374 . . . . 10.0 109.991 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.497 HG22 ' HB ' ' B' ' 114' ' ' VAL . 43.7 t -90.52 127.72 42.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.78 -178.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.7 ' HB3' HD11 ' B' ' 93' ' ' ILE . 29.2 p90 -132.78 159.38 39.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.108 178.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.409 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -96.04 119.86 35.29 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.993 -0.373 . . . . 10.0 109.993 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . 0.737 HD11 ' HA ' ' B' ' 118' ' ' CYS . 13.1 pt -69.6 -5.45 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 112.231 0.456 . . . . 10.0 112.231 -179.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . 0.409 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 4.4 p-10 -94.33 -1.8 53.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.984 0.421 . . . . 10.0 110.949 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -138.86 112.34 8.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.244 -0.434 . . . . 10.0 110.693 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . 0.456 ' O ' ' HG3' ' B' ' 91' ' ' GLU . 0.2 OUTLIER -60.18 -33.73 72.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.024 -0.535 . . . . 10.0 111.939 -179.519 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 38.6 tptt -62.07 -34.56 76.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.108 0.48 . . . . 10.0 110.368 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 31.8 t -67.27 -30.21 70.03 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.091 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . 0.418 ' CE1' ' HA ' ' B' ' 130' ' ' ALA . 68.6 t80 -80.72 -38.6 28.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.372 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' B' ' 87' ' ' THR . 40.5 mt-10 -72.02 -23.26 61.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.833 -179.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . 0.456 ' O ' ' HB3' ' B' ' 95' ' ' HIS . 0.4 OUTLIER -81.43 -3.57 53.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.525 -0.307 . . . . 10.0 111.549 -179.749 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . 0.7 HD11 ' HB3' ' B' ' 82' ' ' PHE . 22.4 mm -61.48 -39.73 83.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.278 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 28.9 t60 -64.16 -33.57 76.1 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . 0.456 ' HB3' ' O ' ' B' ' 92' ' ' ASP . 5.1 t-160 -60.95 -39.91 91.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.443 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . 0.537 ' CE1' ' HB ' ' B' ' 9' ' ' VAL . 1.9 m-85 -74.66 -39.84 61.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.654 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -56.2 -44.57 79.58 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.185 -0.462 . . . . 10.0 110.359 179.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -66.34 -40.27 89.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.883 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -64.81 -47.9 76.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.482 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 58.6 mt -62.89 -44.71 99.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.883 0.373 . . . . 10.0 110.25 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . 0.815 ' HD2' ' HG3' ' B' ' 107' ' ' GLU . 13.1 tttp -59.37 -37.84 78.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.302 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 65.4 ttp85 -67.5 -47.21 70.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.779 -0.646 . . . . 10.0 112.109 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 34.1 m -71.35 -25.85 25.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 112.672 0.619 . . . . 10.0 112.672 -178.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -95.14 -10.28 31.07 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 25.8 t0 58.79 22.88 10.59 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.486 0.66 . . . . 10.0 111.309 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 4.6 m -144.47 151.88 39.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.85 -0.613 . . . . 10.0 110.647 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . 0.815 ' HG3' ' HD2' ' B' ' 101' ' ' LYS . 3.7 mp0 -92.76 -38.49 11.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.147 0.498 . . . . 10.0 110.895 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -81.43 62.54 5.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.459 0.647 . . . . 10.0 112.382 -178.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.413 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 49.1 t -101.46 132.92 21.22 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.74 -0.664 . . . . 10.0 109.243 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 49.4 Cg_exo -57.11 104.7 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.94 2.426 . . . . 10.0 112.382 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . 0.403 ' HA ' ' O ' ' B' ' 78' ' ' PHE . 43.2 mtt -130.88 143.63 50.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.881 -0.599 . . . . 10.0 109.695 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . 0.561 ' HB ' HD23 ' B' ' 79' ' ' LEU . 92.4 t -128.29 127.67 67.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.612 -0.514 . . . . 10.0 109.612 179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 18.9 tp -81.0 120.91 25.38 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . 0.497 ' HB ' HG22 ' B' ' 81' ' ' VAL . 40.3 t -118.52 117.66 55.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.904 0.383 . . . . 10.0 111.426 -178.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.71 99.59 2.1 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 110.237 -1.145 . . . . 10.0 110.237 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -88.9 163.71 15.49 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.889 0.329 . . . . 10.0 111.889 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 30.4 mtpt 70.83 38.87 1.12 Allowed 'General case' 0 C--O 1.231 0.096 0 CA-C-N 115.257 -0.883 . . . . 10.0 112.258 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . 0.737 ' HA ' HD11 ' B' ' 84' ' ' ILE . 28.2 p -76.21 2.0 14.37 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.077 -0.511 . . . . 10.0 111.441 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -95.18 -4.58 45.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.458 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 46.7 mt -80.89 139.21 49.87 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.846 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -68.72 -27.81 31.39 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.757 2.305 . . . . 10.0 112.583 -179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 2.1 m -85.07 59.01 5.36 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.388 0.514 . . . . 10.0 112.388 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . 0.664 ' HG3' HD12 ' B' ' 84' ' ' ILE . 36.7 ttm-85 -72.11 100.62 2.57 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.217 -0.66 . . . . 10.0 109.217 178.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.7 m -88.75 -31.54 18.36 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.618 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 25.0 t -102.08 117.59 47.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.051 179.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -79.35 151.34 31.06 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.366 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . 0.493 HG23 ' HE2' ' B' ' 141' ' ' PHE . 6.7 m -56.84 -37.12 70.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.416 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -64.29 -42.24 96.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.86 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -62.04 -47.75 83.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.202 0.525 . . . . 10.0 110.305 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . 0.418 ' HA ' ' CE1' ' B' ' 90' ' ' PHE . . . -62.98 -44.49 95.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.653 -0.703 . . . . 10.0 111.269 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.531 ' HG3' ' HD2' ' B' ' 141' ' ' PHE . 11.0 mt-30 -68.15 -33.1 73.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.539 -0.3 . . . . 10.0 111.427 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.94 -43.0 99.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.392 0.615 . . . . 10.0 109.852 178.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 14.5 tp -67.21 -46.76 72.89 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.476 -0.784 . . . . 10.0 110.014 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.51 -43.06 99.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.833 -0.621 . . . . 10.0 110.844 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -60.59 -34.14 73.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.947 -0.569 . . . . 10.0 110.8 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 20.7 m -73.14 -27.13 61.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.47 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -90.41 -14.52 32.76 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.131 0.491 . . . . 10.0 110.957 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 79.97 32.33 36.49 Favored Glycine 0 N--CA 1.446 -0.661 0 N-CA-C 111.351 -0.699 . . . . 10.0 111.351 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 45.8 pt -127.38 153.98 77.2 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 110.164 -0.31 . . . . 10.0 110.164 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -79.49 157.26 25.33 Favored 'Trans proline' 0 CA--C 1.531 0.351 0 C-N-CA 122.593 2.195 . . . . 10.0 112.408 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.531 ' HD2' ' HG3' ' B' ' 131' ' ' GLN . 36.4 t80 -127.27 126.72 43.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.373 179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 34.4 mm -121.19 124.69 72.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.317 -0.402 . . . . 10.0 110.164 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -86.63 125.44 33.84 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 107.525 -1.287 . . . . 10.0 107.525 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . 0.449 HG22 ' HA3' ' B' ' 151' ' ' GLY . 71.5 p -134.96 173.82 11.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.51 0.93 . . . . 10.0 113.51 -176.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 13.3 t -155.97 108.39 2.62 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.347 -1.297 . . . . 10.0 108.054 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -61.85 -27.07 68.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.275 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -68.69 -41.69 78.82 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.457 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 27.3 p -98.57 -4.83 33.24 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.869 0.322 . . . . 10.0 111.869 -178.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . 0.644 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 26.5 ttt-85 66.33 14.37 9.65 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.904 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.11 116.72 16.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.563 -178.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . 0.449 ' HA3' HG22 ' B' ' 144' ' ' THR . . . 82.53 5.29 89.64 Favored Glycine 0 N--CA 1.452 -0.299 0 N-CA-C 114.517 0.567 . . . . 10.0 114.517 177.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 67.8 t -58.83 -50.71 78.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 117.187 0.494 . . . . 10.0 111.713 -179.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -69.71 -42.33 74.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.789 0.328 . . . . 10.0 110.362 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.52 -45.48 69.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.726 -0.67 . . . . 10.0 112.235 -178.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.84 -50.58 73.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.833 0.349 . . . . 10.0 111.652 -179.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -67.48 -42.49 82.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.264 -0.426 . . . . 10.0 111.609 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -61.99 -40.25 94.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.845 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 46.9 m -66.61 -36.39 82.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.615 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.921 HD22 ' HG ' ' B' ' 79' ' ' LEU . 32.8 tp -60.46 -48.56 81.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.353 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . 0.426 ' HA ' HD12 ' B' ' 163' ' ' ILE . 46.6 t -62.55 -35.83 72.03 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.153 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 22.7 ttm-85 -63.77 -45.32 90.33 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.609 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -63.09 -39.33 94.4 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.997 0.427 . . . . 10.0 110.343 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . 0.452 HG13 ' O ' ' B' ' 159' ' ' LEU . 85.9 mt -61.21 -49.32 85.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.172 179.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -62.51 -46.67 87.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.895 -0.593 . . . . 10.0 111.957 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -59.12 -43.58 91.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.976 0.417 . . . . 10.0 110.937 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 48.5 t-80 -63.92 -40.92 97.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.704 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -66.14 -43.36 87.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.372 -0.376 . . . . 10.0 111.031 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -62.48 -37.3 85.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.034 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 41.4 tttp -65.73 -35.11 79.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.055 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 80.1 mtp -64.81 -23.82 67.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.183 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 1.9 m . . . . . 0 C--N 1.331 -0.234 0 CA-C-O 121.376 0.608 . . . . 10.0 109.88 179.127 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.506 0 N-CA-C 112.291 -0.323 . . . . 10.0 112.291 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' D' D ' 809' ' ' THR . . . . . 0.823 HG21 HD11 ' B' ' 36' ' ' ILE . 1.5 p -132.91 164.82 26.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.461 0.172 . . . . 10.0 110.593 -179.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 810' ' ' VAL . . . . . 0.606 HG23 HG22 ' D' ' 824' ' ' VAL . 91.5 t -118.64 123.23 71.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 120.756 0.312 . . . . 10.0 110.488 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 811' ' ' LYS . . . . . 0.737 ' HE3' ' HG3' ' D' ' 819' ' ' ARG . 72.5 tttt -87.95 107.88 18.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.278 -0.419 . . . . 10.0 109.883 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 43.5 t -94.9 129.33 45.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.477 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -96.3 136.24 37.04 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.61 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 58.4 mt -107.32 153.23 41.3 Favored Pre-proline 0 C--N 1.319 -0.73 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.155 -178.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 815' ' ' PRO . . . . . 0.747 ' HD3' ' HB ' ' D' ' 877' ' ' VAL . 72.4 Cg_endo -74.82 56.64 4.2 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.929 2.419 . . . . 10.0 111.111 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 816' ' ' ASN . . . . . 0.411 HD22 ' HA ' ' D' ' 816' ' ' ASN . 0.2 OUTLIER -157.2 32.6 0.29 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.227 -0.897 . . . . 10.0 109.998 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D ' 817' ' ' LYS . . . . . 0.459 ' HD3' ' NH1' ' B' ' 41' ' ' ARG . 9.8 ttpt 58.29 28.31 16.49 Favored 'General case' 0 CA--C 1.529 0.163 0 O-C-N 123.788 0.68 . . . . 10.0 110.311 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 818' ' ' GLN . . . . . 0.408 ' NE2' ' HB2' ' B' ' 39' ' ' SER . 79.3 mt-30 -138.44 -177.58 4.91 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 114.421 1.267 . . . . 10.0 114.421 -177.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 819' ' ' ARG . . . . . 0.737 ' HG3' ' HE3' ' D' ' 811' ' ' LYS . 0.0 OUTLIER -151.88 171.11 18.28 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.01 -0.996 . . . . 10.0 112.01 -177.634 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 14.6 t -152.22 138.81 18.69 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 107.449 -1.315 . . . . 10.0 107.449 178.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 821' ' ' VAL . . . . . 0.555 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 4.0 t -104.53 114.2 43.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 120.059 -0.656 . . . . 10.0 111.553 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 35.2 m -103.31 162.38 4.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.761 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 5.2 m -96.23 140.4 30.97 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.532 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 824' ' ' VAL . . . . . 0.606 HG22 HG23 ' D' ' 810' ' ' VAL . 6.4 t -68.17 121.65 17.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 110.132 -0.322 . . . . 10.0 110.132 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -126.34 113.01 16.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.451 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -67.27 145.55 55.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.285 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 90.29 -38.99 3.14 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.827 -0.701 . . . . 10.0 112.08 -179.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 57.6 ttm -68.39 144.82 54.6 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.651 0.262 . . . . 10.0 110.702 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 829' ' ' SER . . . . . 0.667 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.0 OUTLIER -99.77 162.8 12.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.556 -0.293 . . . . 10.0 111.279 -179.838 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D ' 830' ' ' VAL . . . . . 0.509 ' O ' ' HB2' ' D' ' 834' ' ' LEU . 86.0 t -55.17 -41.51 60.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.186 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 831' ' ' TYR . . . . . 0.488 ' O ' ' HB2' ' D' ' 835' ' ' ASP . 67.5 t80 -56.35 -32.99 65.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.941 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -75.87 -57.49 3.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.502 -0.317 . . . . 10.0 111.634 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.44 -42.72 99.66 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.688 -179.106 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 834' ' ' LEU . . . . . 0.548 ' HG ' HG21 ' D' ' 850' ' ' VAL . 2.2 mm? -74.24 -17.78 60.83 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 113.089 0.774 . . . . 10.0 113.089 -179.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 835' ' ' ASP . . . . . 0.488 ' HB2' ' O ' ' D' ' 831' ' ' TYR . 28.0 t70 -61.71 -50.12 73.73 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.641 -0.424 . . . . 10.0 109.973 179.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 35.4 tttt -68.46 -26.96 65.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.648 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 837' ' ' ALA . . . . . 0.435 ' HB3' HD13 ' D' ' 834' ' ' LEU . . . -77.22 -22.27 52.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.07 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 838' ' ' LEU . . . . . 0.65 HD21 HG11 ' D' ' 877' ' ' VAL . 37.3 mt -94.52 -43.85 8.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.044 0.449 . . . . 10.0 110.452 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -63.91 -18.39 64.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.857 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 840' ' ' VAL . . . . . 0.659 HG22 ' CE2' ' B' ' 40' ' ' TYR . 3.2 p -52.69 -22.96 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 O-C-N 123.801 0.688 . . . . 10.0 112.321 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 15.9 ptp180 -139.15 17.09 2.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.01 0.433 . . . . 10.0 111.809 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 82.05 35.89 19.95 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.955 -0.641 . . . . 10.0 114.592 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 98.7 mt -99.78 149.64 23.15 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 117.427 0.614 . . . . 10.0 110.326 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -119.53 148.55 43.16 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.04 0.448 . . . . 10.0 111.661 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -67.29 -9.1 37.43 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.454 -0.794 . . . . 10.0 112.835 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -94.87 -2.55 50.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.026 0.441 . . . . 10.0 111.901 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 91.3 m -129.17 5.16 5.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.237 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 67.5 m -142.84 147.83 36.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.697 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 12.8 p -130.01 151.05 35.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 850' ' ' VAL . . . . . 0.548 HG21 ' HG ' ' D' ' 834' ' ' LEU . 17.4 t -108.07 134.06 51.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.059 0.456 . . . . 10.0 111.764 -179.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 851' ' ' TYR . . . . . 0.777 ' HE1' ' HB3' ' D' ' 878' ' ' GLU . 91.8 m-85 -109.22 141.97 40.72 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.816 -0.629 . . . . 10.0 109.721 178.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 852' ' ' ARG . . . . . 0.719 ' HD2' HD11 ' D' ' 870' ' ' LEU . 31.7 mtm-85 -98.67 135.12 40.63 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.968 -0.752 . . . . 10.0 108.968 178.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 853' ' ' LEU . . . . . 0.428 ' HG ' HD11 ' D' ' 876' ' ' ILE . 1.7 mt -82.25 81.39 8.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.92 0.39 . . . . 10.0 111.702 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 37.7 mt -88.08 87.78 2.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.549 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 855' ' ' LYS . . . . . 0.464 ' HA ' ' HD3' ' D' ' 855' ' ' LYS . 23.0 mmtt 50.83 55.89 8.84 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.438 0.903 . . . . 10.0 113.438 179.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 86.53 -0.77 87.05 Favored Glycine 0 CA--C 1.518 0.255 0 C-N-CA 120.84 -0.695 . . . . 10.0 114.116 178.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 857' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' D' ' 857' ' ' ARG . 29.6 mmt180 -115.11 135.76 53.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 117.406 0.603 . . . . 10.0 111.011 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 858' ' ' LYS . . . . . 0.735 ' HE2' HD13 ' D' ' 876' ' ' ILE . 94.5 mttt -92.92 99.69 12.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.528 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 4.5 m -98.34 134.0 41.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.702 -0.226 . . . . 10.0 110.744 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 43.0 t -66.19 130.5 31.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.643 0.258 . . . . 10.0 110.845 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 861' ' ' THR . . . . . 0.41 ' HB ' ' HG3' ' D' ' 852' ' ' ARG . 1.8 t -108.12 153.05 23.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.857 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 862' ' ' ALA . . . . . 0.463 ' HB3' ' OG1' ' D' ' 865' ' ' THR . . . -88.53 149.84 23.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.155 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 863' ' ' TRP . . . . . 0.505 ' HZ3' ' HB3' ' D' ' 834' ' ' LEU . 99.8 m95 -73.5 -30.06 62.89 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.655 0.613 . . . . 10.0 112.655 -179.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -80.3 -10.65 59.76 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.821 0.675 . . . . 10.0 112.821 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 865' ' ' THR . . . . . 0.463 ' OG1' ' HB3' ' D' ' 862' ' ' ALA . 5.3 m -67.89 143.79 55.55 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.15 -0.315 . . . . 10.0 110.15 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 866' ' ' ALA . . . . . 0.667 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -74.93 149.56 39.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.74 0.305 . . . . 10.0 110.684 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 867' ' ' ILE . . . . . 0.441 ' HA ' HD23 ' D' ' 870' ' ' LEU . 7.9 tp -88.16 2.62 5.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.615 0.721 . . . . 10.0 110.498 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -63.53 -51.54 66.18 Favored Pre-proline 0 CA--C 1.539 0.543 0 N-CA-C 113.162 0.801 . . . . 10.0 113.162 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -76.53 14.44 1.21 Allowed 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.162 1.908 . . . . 10.0 112.961 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 870' ' ' LEU . . . . . 0.719 HD11 ' HD2' ' D' ' 852' ' ' ARG . 3.9 mm? -98.18 33.0 2.28 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.368 0.604 . . . . 10.0 110.761 179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -72.41 116.55 13.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.809 -0.632 . . . . 10.0 111.2 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 73.52 32.0 60.18 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 121.039 -0.6 . . . . 10.0 112.5 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -119.89 152.85 36.72 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.19 -0.3 . . . . 10.0 110.19 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -108.69 135.18 50.36 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.007 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 77.3 mt -113.55 127.47 56.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.55 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 876' ' ' ILE . . . . . 0.735 HD13 ' HE2' ' D' ' 858' ' ' LYS . 6.3 mt -118.4 117.63 55.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.107 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 877' ' ' VAL . . . . . 0.747 ' HB ' ' HD3' ' D' ' 815' ' ' PRO . 12.9 t -87.89 137.69 20.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 109.96 -0.385 . . . . 10.0 109.96 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 878' ' ' GLU . . . . . 0.777 ' HB3' ' HE1' ' D' ' 851' ' ' TYR . 37.5 tt0 -135.0 154.98 51.54 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.371 -0.603 . . . . 10.0 109.371 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 10.3 m -80.56 153.58 4.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 116.537 -0.302 . . . . 10.0 110.291 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 50.8 mt . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.365 -0.826 . . . . 10.0 110.863 -179.85 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . 0.593 ' O ' ' HB2' ' A' ' 243' ' ' MET . 85.5 mt . . . . . 0 C--O 1.219 -0.524 0 CA-C-O 120.39 0.138 . . . . 10.0 111.172 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 29.8 mtm180 -70.65 -42.0 71.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.995 0.426 . . . . 10.0 110.818 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -71.04 -32.93 69.8 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.459 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . 0.811 ' HB3' HH21 ' C' ' 532' ' ' ARG . 20.2 mt-10 -80.64 -41.98 22.93 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.712 -0.677 . . . . 10.0 111.011 179.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . 0.593 ' HB2' ' O ' ' A' ' 239' ' ' LEU . 1.6 mmm -63.24 -33.49 75.61 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.62 0.248 . . . . 10.0 111.176 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.8 p -65.36 -41.53 93.75 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.106 -0.701 . . . . 10.0 109.106 178.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -71.44 -43.96 65.72 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.7 -0.852 . . . . 10.0 108.7 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . 0.483 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.2 OUTLIER -53.77 -57.69 9.95 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.419 -0.81 . . . . 10.0 109.564 178.926 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 47.1 mt -60.33 -44.74 95.21 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.738 -0.665 . . . . 10.0 111.459 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -59.78 -52.32 65.97 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.475 0.178 . . . . 10.0 111.319 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -63.1 -45.66 91.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.365 -0.38 . . . . 10.0 110.389 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . 0.705 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 36.1 t -61.92 -44.33 98.73 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.399 0 CA-C-N 116.447 -0.342 . . . . 10.0 111.455 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . 0.451 ' O ' HG12 ' A' ' 254' ' ' VAL . 95.7 mttt -70.54 -48.02 57.52 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.811 0.3 . . . . 10.0 111.811 -179.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -60.52 -40.61 92.06 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.913 0.387 . . . . 10.0 110.829 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt -82.55 -22.33 34.99 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.156 -0.474 . . . . 10.0 111.719 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.705 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -64.91 -26.08 39.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 C-N-CA 121.152 -0.219 . . . . 10.0 110.842 179.904 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . 0.506 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 20.5 mt-30 -63.08 -61.62 7.06 Favored Pre-proline 0 CA--C 1.531 0.225 0 CA-C-N 116.257 -0.429 . . . . 10.0 109.865 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . 0.506 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 18.7 Cg_endo -62.32 -30.56 81.15 Favored 'Trans proline' 0 C--N 1.359 1.092 0 C-N-CA 121.778 1.652 . . . . 10.0 110.96 177.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . 0.422 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 6.8 m-30 -61.74 -54.21 45.62 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.225 0.536 . . . . 10.0 109.7 178.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 79.6 mt -67.95 -46.32 71.75 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 115.397 -0.82 . . . . 10.0 111.207 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -60.18 -39.77 87.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.822 0.344 . . . . 10.0 111.766 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -62.07 -50.63 71.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.112 0.482 . . . . 10.0 110.021 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . 0.405 ' O ' ' HB2' ' A' ' 265' ' ' TRP . 14.3 m-85 -69.71 -30.38 68.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.819 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -66.15 -48.08 71.95 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.582 179.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 11.4 mtmt -59.21 -43.08 92.28 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.206 -0.665 . . . . 10.0 109.206 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.436 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 16.6 mttt -65.64 -46.39 79.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.234 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . 0.405 ' HB2' ' O ' ' A' ' 261' ' ' PHE . 0.0 OUTLIER -60.73 -34.61 74.66 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.535 -0.302 . . . . 10.0 110.404 179.386 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -65.17 -49.3 70.35 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.058 -0.719 . . . . 10.0 109.058 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -61.7 -41.77 98.03 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . 0.518 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 41.3 mt-10 -61.68 -46.63 88.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.767 179.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 5.6 mmt -65.05 -43.87 90.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.652 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . 0.521 ' O ' ' HB2' ' A' ' 274' ' ' GLN . 79.8 mt-10 -62.01 -48.6 79.59 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.738 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 66.3 mt -66.61 -35.1 79.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.667 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . 0.518 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 2.2 t80 -63.43 -52.34 61.9 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . 0.423 ' HA ' ' HB ' ' A' ' 276' ' ' VAL . 46.6 mtt180 -63.12 -39.52 94.94 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . 0.521 ' HB2' ' O ' ' A' ' 270' ' ' GLU . 3.1 tt0 -56.55 -32.93 65.64 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.472 -0.786 . . . . 10.0 110.096 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.615 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 59.0 mttp -90.0 -35.23 15.64 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.478 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . 0.423 ' HB ' ' HA ' ' A' ' 273' ' ' ARG . 7.6 t -54.45 -40.5 49.49 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.168 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . 0.494 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 35.5 mt-10 -57.58 -63.29 3.95 Favored Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 111.966 0.358 . . . . 10.0 111.966 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . 0.554 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 23.6 Cg_endo -63.42 -37.23 50.46 Favored 'Trans proline' 0 C--N 1.357 1.018 0 C-N-CA 121.956 1.77 . . . . 10.0 111.798 178.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.689 HD22 ' HG2' ' C' ' 495' ' ' LYS . 29.4 mt -65.69 -36.55 83.97 Favored 'General case' 0 C--N 1.334 -0.088 0 C-N-CA 121.052 -0.259 . . . . 10.0 110.676 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -71.53 -34.67 70.26 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.124 -1.065 . . . . 10.0 108.124 178.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -63.83 -41.91 97.75 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.38 -0.97 . . . . 10.0 108.38 177.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 35.5 mt-10 -61.22 -46.19 91.45 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.064 -0.717 . . . . 10.0 109.064 177.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 97.0 mt -60.9 -43.62 98.26 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.163 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -63.03 -53.49 52.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.172 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -57.95 -51.12 70.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.287 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -60.53 -46.4 94.47 Favored Glycine 0 N--CA 1.443 -0.837 0 CA-C-N 115.604 -0.726 . . . . 10.0 112.248 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.96 -38.76 89.73 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.644 0.222 . . . . 10.0 110.573 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . 0.685 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 88.0 mtt180 -59.25 -42.97 92.35 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 178.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . 0.448 ' O ' ' HG2' ' A' ' 293' ' ' GLU . 38.9 mt-30 -71.87 -55.6 7.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.614 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . 0.511 ' HE3' ' OE1' ' C' ' 487' ' ' GLN . 34.4 mttt -54.87 -46.6 74.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.922 -0.581 . . . . 10.0 111.957 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . 0.671 HD23 HD12 ' A' ' 294' ' ' LEU . 78.4 mt -70.8 -32.37 69.43 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 121.259 -0.176 . . . . 10.0 111.023 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . 0.685 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 0.3 OUTLIER -65.25 -41.51 94.23 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.82 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 289' ' ' GLN . 21.5 mm-40 -64.44 -35.15 79.99 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.852 -0.796 . . . . 10.0 108.852 178.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . 0.671 HD12 HD23 ' A' ' 291' ' ' LEU . 79.2 mt -68.43 -38.54 81.3 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.585 -0.734 . . . . 10.0 109.923 178.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -63.18 -37.75 88.47 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.217 -0.661 . . . . 10.0 109.217 178.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -72.23 5.65 2.7 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.094 -0.957 . . . . 10.0 111.117 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . 0.52 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 39.9 mttp -125.02 -36.55 2.53 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.254 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . 0.441 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 76.8 mt -60.53 -41.81 95.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.399 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . 0.824 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 19.5 m -81.38 -64.38 0.28 Allowed Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . 0.824 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 53.5 Cg_exo -55.7 -58.35 1.15 Allowed 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 122.306 2.004 . . . . 10.0 112.853 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.52 ' HB2' ' O ' ' A' ' 297' ' ' LYS . 81.3 mt -67.36 -31.16 71.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.699 0.285 . . . . 10.0 110.673 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . 0.441 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -65.95 -44.7 91.21 Favored Glycine 0 N--CA 1.449 -0.479 0 N-CA-C 111.334 -0.706 . . . . 10.0 111.334 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -60.63 -37.79 82.63 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 300' ' ' PRO . 93.7 mt-10 -64.25 -44.9 90.35 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 178.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 5.6 tpt -62.96 -42.97 99.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.222 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 94.6 mtt180 -64.56 -38.13 89.94 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 109.122 -0.696 . . . . 10.0 109.122 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . 0.57 ' HA ' ' CD ' ' A' ' 310' ' ' ARG . 33.2 t70 -66.56 -43.66 84.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.196 179.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . 0.802 ' HG3' HD11 ' C' ' 469' ' ' LEU . 11.3 mmt180 -68.76 -26.75 65.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.736 -0.665 . . . . 10.0 109.361 178.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . 0.551 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -69.97 -32.0 70.0 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 177.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . 0.57 ' CD ' ' HA ' ' A' ' 307' ' ' ASP . 15.6 mtp180 -62.89 -46.4 88.0 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 107.906 -1.146 . . . . 10.0 107.906 178.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -66.85 -41.11 87.91 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.434 -0.803 . . . . 10.0 109.633 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . 0.558 ' HA ' ' HD3' ' C' ' 462' ' ' LYS . 0.7 OUTLIER -56.14 -49.1 74.9 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.123 178.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 97.2 t -73.91 -39.76 52.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 115.762 -0.653 . . . . 10.0 111.419 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . 0.428 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 0.7 OUTLIER -60.87 -42.88 98.76 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.249 0.547 . . . . 10.0 110.232 179.717 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . 0.57 ' O ' ' HB2' ' A' ' 319' ' ' HIS . . . -65.1 -33.39 75.91 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.212 178.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 40.5 mt -71.15 -37.66 72.23 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.712 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 81.1 mtt180 -61.02 -53.41 57.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.138 0.494 . . . . 10.0 110.207 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.98 2.69 6.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.337 -0.847 . . . . 10.0 112.245 -179.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . 0.57 ' HB2' ' O ' ' A' ' 315' ' ' ALA . 0.1 OUTLIER -117.42 -51.64 2.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.65 0.262 . . . . 10.0 110.771 179.793 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 91.5 mt -65.04 -35.82 82.4 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.374 -0.375 . . . . 10.0 111.547 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -57.19 -60.4 9.78 Favored Pre-proline 0 CA--C 1.536 0.432 0 C-N-CA 121.138 -0.225 . . . . 10.0 111.316 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -65.0 -33.36 51.51 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 121.603 1.535 . . . . 10.0 111.214 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -62.25 -50.58 71.17 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-N 116.594 -0.276 . . . . 10.0 110.866 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . 0.441 ' HA ' HD12 ' A' ' 327' ' ' LEU . 21.1 p -68.8 -34.25 75.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.356 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -66.03 -41.01 91.5 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . 0.401 ' CD ' ' HZ1' ' C' ' 451' ' ' LYS . 27.4 mt-10 -68.87 -36.0 77.58 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.315 -0.995 . . . . 10.0 108.315 177.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . 0.441 HD12 ' HA ' ' A' ' 324' ' ' SER . 29.3 mt -60.72 -35.05 75.36 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 109.302 -0.629 . . . . 10.0 109.302 178.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 -63.56 -40.81 97.95 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.941 -0.763 . . . . 10.0 108.941 178.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -70.22 -41.98 72.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.027 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . 0.469 ' HA ' ' HE3' ' C' ' 443' ' ' LYS . 13.6 mtp180 -63.89 -45.75 87.95 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.8 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 64.6 mt -65.85 -37.56 86.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.1 179.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.9 -46.73 88.09 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -60.83 -44.98 96.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.956 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 20.5 mtt180 -62.86 -47.73 82.1 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.144 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . 0.491 ' O ' ' HB2' ' A' ' 339' ' ' LYS . 68.1 mt -64.39 -33.82 76.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 10.0 111.432 -179.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -69.81 -44.05 70.81 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.913 -0.403 . . . . 10.0 109.913 178.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.73 -44.33 77.86 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 71.0 mt -66.09 -20.89 66.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.765 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 335' ' ' LEU . 31.0 tttt -75.58 -49.06 19.71 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 178.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -67.59 -39.06 84.83 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . 0.859 HD21 ' HA ' ' C' ' 433' ' ' GLU . 36.3 t-20 -67.22 -42.61 83.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.285 -0.87 . . . . 10.0 108.921 178.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -62.16 -42.94 99.73 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.564 -0.744 . . . . 10.0 111.566 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.93 -40.75 97.28 Favored Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 110.445 -1.062 . . . . 10.0 110.445 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -67.78 -42.85 81.02 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 178.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 23.5 mtt180 -62.86 -43.54 98.54 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.736 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 13.5 mt -65.02 -46.64 80.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.504 -0.317 . . . . 10.0 110.861 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.02 -43.99 97.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.036 0.446 . . . . 10.0 110.105 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . 0.409 ' HB3' ' HE2' ' A' ' 352' ' ' LYS . 17.6 mt-10 -67.09 -47.48 71.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.142 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -62.05 -33.48 74.46 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 121.115 -0.234 . . . . 10.0 110.445 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.22 -40.84 86.46 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.818 -0.808 . . . . 10.0 108.818 178.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . 0.572 ' O ' ' HG2' ' A' ' 355' ' ' GLU . . . -66.13 -46.16 78.49 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.426 178.492 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . 0.409 ' HE2' ' HB3' ' A' ' 348' ' ' GLU . 19.4 mttm -63.3 -29.51 70.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.761 -0.654 . . . . 10.0 109.946 178.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.95 -46.37 74.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.988 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.8 -37.17 85.65 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 121.015 0.436 . . . . 10.0 109.891 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' ' 351' ' ' ALA . 20.3 mm-40 -67.74 -41.54 83.25 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -60.63 -48.29 82.45 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 108.841 -0.8 . . . . 10.0 108.841 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 84.3 mt -59.62 -37.81 79.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.986 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 53.9 m -61.87 -56.78 15.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.231 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 17.8 m -63.17 -35.35 79.99 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.41 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 19.7 mt -65.89 -36.4 83.31 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.453 -0.34 . . . . 10.0 110.24 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 70.2 m -65.76 -31.53 72.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.095 0.474 . . . . 10.0 110.524 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -73.93 -8.16 55.05 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 121.377 0.608 . . . . 10.0 109.928 179.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' A' ' 367' ' ' ALA . 44.7 mttm -107.93 -38.31 5.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.104 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.74 -26.01 63.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.564 -0.743 . . . . 10.0 111.897 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.793 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 58.1 mttp -106.46 -74.29 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 112.794 0.664 . . . . 10.0 112.794 179.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.793 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 52.2 Cg_exo -56.91 -53.17 5.36 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 122.115 1.876 . . . . 10.0 113.175 -178.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . 0.459 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -61.56 -43.77 98.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.674 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . 0.485 HD23 ' HA ' ' A' ' 368' ' ' LEU . 6.5 mt -65.57 -36.26 83.26 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.979 -0.288 . . . . 10.0 110.791 179.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . 0.551 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 19.6 mt-10 -63.36 -41.4 98.84 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.188 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.88 -39.84 94.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.352 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . 0.405 HD12 HD23 ' A' ' 368' ' ' LEU . 84.9 mt -65.63 -40.73 92.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.406 178.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -67.28 -40.78 86.17 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.551 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.7 mt-30 -66.2 -26.73 67.53 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.22 -0.9 . . . . 20.0 111.222 178.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -81.67 -40.3 11.03 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 109.261 -1.536 . . . . 10.0 109.261 178.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 14.2 mt -61.55 -31.65 71.69 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.963 0.357 . . . . 10.0 111.963 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . 0.478 ' HB2' ' HD3' ' A' ' 377' ' ' PRO . 38.3 mt -54.55 -64.62 1.81 Allowed Pre-proline 0 CA--C 1.537 0.479 0 O-C-N 122.969 0.168 . . . . 10.0 111.027 179.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' A' ' 376' ' ' LEU . 40.9 Cg_endo -69.26 -32.45 20.64 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.866 1.711 . . . . 10.0 111.364 178.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 3.9 t -59.38 -49.11 84.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.721 -0.218 . . . . 10.0 110.453 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 37.1 mt -63.92 -31.82 73.13 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.179 -0.464 . . . . 10.0 109.92 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . 0.439 ' O ' HG23 ' A' ' 384' ' ' VAL . 11.8 mt-10 -67.41 -50.91 57.46 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 1.2 p -59.99 -34.86 73.9 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 120.952 0.406 . . . . 10.0 110.06 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 5.9 m-30 -69.71 -44.7 69.84 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 115.892 -0.594 . . . . 10.0 110.043 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -61.81 -42.46 99.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.491 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 380' ' ' GLU . 74.7 t -59.58 -43.31 90.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.745 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.4 p -75.04 -37.87 61.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.582 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 14.3 m-30 -66.42 -44.21 83.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.691 0.282 . . . . 10.0 110.489 179.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.485 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 51.5 mt -59.17 -43.07 92.12 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.549 179.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 1.8 p -71.33 -46.63 60.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.229 -0.442 . . . . 10.0 110.769 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -56.66 -41.15 76.74 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.143 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 58.4 mt -59.33 -41.53 89.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.016 0.436 . . . . 10.0 110.378 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 17.8 mt-10 -71.78 -37.91 70.38 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.78 -46.16 78.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.442 178.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -65.59 -44.37 86.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.112 0.482 . . . . 10.0 110.432 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 55.8 m -60.17 -45.14 94.11 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.641 -0.709 . . . . 10.0 111.81 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 30.1 mtmt . . . . . 0 CA--C 1.531 0.228 0 N-CA-C 112.678 0.622 . . . . 10.0 112.678 -178.753 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . 0.427 ' HG ' ' CD1' ' C' ' 405' ' ' TRP . 15.6 tp . . . . . 0 C--O 1.228 -0.055 0 N-CA-C 111.802 0.297 . . . . 10.0 111.802 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 92.2 mt -61.32 -44.18 97.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.995 0.426 . . . . 10.0 110.078 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -74.87 -38.51 61.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.748 179.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -58.01 -47.0 84.35 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.959 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . 0.427 ' CD1' ' HG ' ' C' ' 401' ' ' LEU . 13.0 m95 -59.59 -36.26 75.92 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.478 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -64.42 -46.9 81.21 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 109.483 -0.562 . . . . 10.0 109.483 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.16 -40.65 90.65 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.862 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.05 -37.93 81.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.74 178.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 63.0 m -64.44 -49.5 71.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.238 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 7.3 m -63.74 -25.39 68.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.911 0.386 . . . . 10.0 111.799 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 18.0 p -92.74 -5.36 51.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.829 0.347 . . . . 10.0 111.029 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -98.37 -37.72 9.51 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.92 -0.77 . . . . 10.0 108.92 178.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 2.5 p -62.58 -47.32 84.35 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 109.151 -0.685 . . . . 10.0 109.151 178.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 23.3 mttm -63.18 -29.25 70.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.551 -0.749 . . . . 10.0 110.33 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 9.0 mt -66.5 -43.3 85.71 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -69.14 -40.67 78.1 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.628 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . 0.587 ' O ' ' HD2' ' C' ' 421' ' ' PRO . 36.9 mt-10 -58.81 -42.8 90.0 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -43.23 74.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.459 -0.791 . . . . 10.0 109.953 178.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 37.7 mt -57.5 -33.14 67.73 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.893 -0.594 . . . . 10.0 112.062 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -53.09 -78.52 0.11 Allowed Glycine 0 CA--C 1.521 0.455 0 C-N-CA 121.34 -0.457 . . . . 10.0 112.079 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . 0.61 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 9.9 Cg_endo -53.42 -38.14 82.5 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 122.941 2.427 . . . . 10.0 111.829 178.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 16.0 t -58.96 -46.86 91.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-N 116.548 -0.297 . . . . 10.0 111.342 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 27.9 p -72.49 -33.5 66.99 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 120.84 -0.344 . . . . 10.0 110.459 179.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -56.51 -54.38 46.5 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.033 0.444 . . . . 10.0 109.825 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . 0.61 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 7.2 pt-20 -71.47 -31.31 67.0 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.43 179.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -62.6 -39.1 92.66 Favored 'General case' 0 N--CA 1.461 0.114 0 N-CA-C 109.433 -0.58 . . . . 10.0 109.433 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 23.2 m95 -67.95 -35.48 78.46 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.021 -0.733 . . . . 10.0 109.021 178.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -67.85 -35.4 78.5 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.454 -0.943 . . . . 10.0 108.454 177.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . 0.687 ' HA ' ' HD2' ' C' ' 432' ' ' LYS . 12.5 t-20 -66.5 -39.96 88.97 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.312 -0.996 . . . . 10.0 108.312 177.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.68 -33.47 75.71 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.689 -0.856 . . . . 10.0 108.689 177.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . 0.414 ' HA ' ' OG1' ' C' ' 434' ' ' THR . 12.7 mt-10 -70.01 -41.01 74.89 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.193 -0.669 . . . . 10.0 109.193 177.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . 0.687 ' HD2' ' HA ' ' C' ' 429' ' ' ASN . 18.0 mttt -61.68 -40.25 94.31 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.325 -0.991 . . . . 10.0 108.325 177.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . 0.859 ' HA ' HD21 ' A' ' 341' ' ' ASN . 31.1 tt0 -68.51 -48.8 63.45 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.94 -1.027 . . . . 10.0 111.022 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . 0.51 ' HB ' ' CZ ' ' C' ' 438' ' ' ARG . 3.3 p -64.01 -47.5 80.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.787 -0.188 . . . . 10.0 111.118 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . 0.408 ' OE1' ' HD2' ' C' ' 438' ' ' ARG . 6.2 mm-40 -61.23 -41.26 96.57 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 110.448 -0.204 . . . . 10.0 110.448 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -66.3 -47.88 68.13 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.481 -1.048 . . . . 10.0 110.481 178.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 20.2 mt -63.89 -28.66 69.99 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 115.734 -0.233 . . . . 10.0 110.603 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . 0.51 ' CZ ' ' HB ' ' C' ' 434' ' ' THR . 37.4 mtt180 -67.98 -33.42 74.6 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 178.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -72.9 -42.79 63.19 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 108.382 -0.97 . . . . 10.0 108.382 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.48 -55.35 16.02 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.159 -0.928 . . . . 10.0 110.957 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 69.5 mmm -58.18 -41.5 84.04 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 113.57 0.952 . . . . 10.0 113.57 -178.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 10.9 p -61.14 -52.54 64.45 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.513 -0.475 . . . . 10.0 109.934 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . 0.469 ' HE3' ' HA ' ' A' ' 330' ' ' ARG . 0.6 OUTLIER -62.99 -41.44 99.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.594 -0.73 . . . . 10.0 109.869 179.069 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . 0.507 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 5.0 t70 -60.08 -50.81 72.23 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.393 -0.821 . . . . 10.0 110.29 179.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . 0.503 ' HA ' HG12 ' C' ' 448' ' ' VAL . 43.5 mt -64.55 -46.29 83.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.941 -0.572 . . . . 10.0 112.153 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -59.5 -47.97 83.44 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.94 -0.304 . . . . 10.0 111.004 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . 0.619 ' O ' ' HB2' ' C' ' 451' ' ' LYS . 73.1 mt-10 -74.9 -17.33 60.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.921 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.5 OUTLIER -86.06 -37.6 11.88 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 C-N-CA 120.899 -0.321 . . . . 10.0 110.715 178.899 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -68.65 -38.35 80.37 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.079 -0.711 . . . . 10.0 109.079 178.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -77.1 -0.87 26.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.526 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . 0.621 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 0.0 OUTLIER -107.0 -35.15 6.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.372 -0.831 . . . . 10.0 109.451 179.451 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . 0.448 HG23 ' O ' ' C' ' 448' ' ' VAL . 41.8 t -67.31 -37.08 78.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.069 179.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . 0.411 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 22.9 mt-30 -56.09 -60.19 9.59 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.788 178.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . 0.411 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 36.6 Cg_endo -68.52 -20.6 41.16 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.572 1.514 . . . . 10.0 111.323 178.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . 0.621 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.1 OUTLIER -70.06 -50.75 38.02 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.983 -0.747 . . . . 10.0 108.983 178.749 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' C' ' 460' ' ' GLN . 57.1 mt -66.45 -39.13 88.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.415 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -62.28 -49.13 76.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.247 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -67.06 -41.41 86.49 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.681 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . 0.504 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 0.1 OUTLIER -62.89 -47.64 82.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 10.0 109.939 179.271 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . 0.573 ' HA ' ' HB2' ' C' ' 463' ' ' TRP . 0.7 OUTLIER -68.36 -26.04 65.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.326 -0.397 . . . . 10.0 111.177 179.747 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . 0.456 ' HB2' ' HE3' ' C' ' 461' ' ' LYS . 20.1 ttmt -67.92 -46.32 71.89 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.121 -1.066 . . . . 10.0 108.121 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . 0.558 ' HD3' ' HA ' ' A' ' 312' ' ' HIS . 20.8 mtmm -71.59 -36.64 70.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.108 -0.951 . . . . 10.0 109.781 178.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . 0.573 ' HB2' ' HA ' ' C' ' 460' ' ' GLN . 1.1 m0 -63.48 -44.0 95.65 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.575 -0.738 . . . . 10.0 109.927 179.05 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -65.7 -40.28 92.13 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 178.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 1.188 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 31.9 tt0 -58.19 -48.37 80.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.489 -0.778 . . . . 10.0 109.697 178.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . 0.637 ' HA ' HD12 ' C' ' 469' ' ' LEU . 16.4 mt-10 -72.51 -36.49 68.37 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.388 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 3.8 mmt -61.66 -51.77 67.08 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 110.285 -0.265 . . . . 10.0 110.285 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.76 -39.08 93.39 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.618 -0.882 . . . . 10.0 108.618 178.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 1.188 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 96.5 mt -57.7 -50.09 74.34 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.369 -0.832 . . . . 20.0 109.602 178.251 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 18.3 m-30 -60.71 -40.04 90.79 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.132 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -64.51 -31.95 73.38 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.541 -0.299 . . . . 10.0 111.211 179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -92.93 -2.03 56.18 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.988 0.366 . . . . 10.0 111.988 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 53.8 mttm -114.28 -45.66 3.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.898 0.38 . . . . 10.0 111.213 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 88.0 t -69.23 -32.44 53.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.519 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . 0.436 ' HB3' ' CD ' ' C' ' 476' ' ' PRO . 35.2 tt0 -59.44 -59.98 12.05 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 121.066 -0.254 . . . . 10.0 110.723 179.089 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . 0.436 ' CD ' ' HB3' ' C' ' 475' ' ' GLU . 18.6 Cg_endo -62.0 -31.95 84.18 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 121.589 1.526 . . . . 10.0 110.458 177.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 8.0 mt -65.7 -37.89 87.71 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -64.81 -41.57 95.67 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 108.577 -0.897 . . . . 10.0 108.577 178.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.57 89.87 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.846 -0.616 . . . . 10.0 109.616 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.18 -41.58 98.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.67 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 22.9 mt -69.26 -30.32 68.42 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.993 -0.548 . . . . 10.0 109.837 178.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 -69.64 -60.07 2.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.09 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -62.95 -35.24 79.49 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -66.61 -43.21 92.63 Favored Glycine 0 N--CA 1.446 -0.666 0 N-CA-C 110.949 -0.86 . . . . 10.0 110.949 178.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -70.82 -35.76 72.62 Favored 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 109.308 -0.627 . . . . 10.0 109.308 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 66.1 mtt180 -62.45 -41.48 98.77 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 109.453 -0.573 . . . . 10.0 109.453 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . 0.511 ' OE1' ' HE3' ' A' ' 290' ' ' LYS . 1.3 tt0 -66.44 -46.67 75.66 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.809 -0.812 . . . . 10.0 108.809 178.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -63.47 -37.63 88.02 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.654 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . 0.6 ' O ' ' HG3' ' C' ' 493' ' ' GLN . 37.2 mt -68.46 -43.96 75.9 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 178.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -62.93 -37.6 87.69 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.408 -0.96 . . . . 10.0 108.408 178.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . 0.61 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 28.9 mt-10 -62.04 -50.24 72.8 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 107.711 -1.218 . . . . 10.0 107.711 176.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 48.2 mt -58.01 -33.14 68.62 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 115.424 -0.807 . . . . 10.0 111.152 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . 0.6 ' HG3' ' O ' ' C' ' 489' ' ' LEU . 29.6 mt-30 -65.06 -40.88 95.35 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.936 -0.764 . . . . 10.0 108.936 178.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.54 7.61 16.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.291 179.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.689 ' HG2' HD22 ' A' ' 279' ' ' LEU . 16.1 mttm -116.88 -48.74 2.65 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 178.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 95.4 mt -71.58 -37.26 71.03 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.65 0.611 . . . . 10.0 112.65 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 4.9 m -65.51 -58.86 10.7 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 112.17 0.433 . . . . 10.0 112.17 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -62.93 -45.65 12.52 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 122.113 1.875 . . . . 10.0 111.621 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . 0.579 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 18.7 mt -67.49 -35.01 78.32 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 121.1 -0.24 . . . . 10.0 110.656 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.67 -48.35 62.62 Favored Glycine 0 N--CA 1.451 -0.314 0 N-CA-C 110.317 -1.113 . . . . 10.0 110.317 178.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -61.26 -38.21 85.89 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . 0.688 ' HG2' ' HE ' ' C' ' 506' ' ' ARG . 25.7 tt0 -68.29 -45.57 72.71 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.387 -0.824 . . . . 10.0 109.674 178.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . 0.631 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 78.3 mmm -60.17 -34.43 73.58 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.887 -0.412 . . . . 10.0 109.887 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -66.63 -39.9 88.5 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.56 -0.533 . . . . 10.0 109.56 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -69.01 -42.09 76.91 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.787 -0.82 . . . . 10.0 108.787 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.688 ' HE ' ' HG2' ' C' ' 502' ' ' GLU . 45.0 mtt180 -61.84 -44.7 96.31 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.341 -0.845 . . . . 10.0 108.858 178.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.9 -44.77 94.07 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.063 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' C' ' 508' ' ' ARG . 46.3 mtt85 -62.08 -44.41 96.72 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -69.15 -19.62 64.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.711 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 8.9 m170 -94.23 -57.81 2.4 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.94 0.4 . . . . 10.0 111.225 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 25.8 t -66.37 -43.36 91.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.985 -0.552 . . . . 10.0 112.375 -178.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.764 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 3.0 t70 -66.17 -33.0 74.77 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 120.194 -0.602 . . . . 10.0 109.919 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.65 -37.5 84.93 Favored 'General case' 0 C--O 1.222 -0.344 0 N-CA-C 107.606 -1.257 . . . . 10.0 107.606 177.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 84.6 mt -67.73 -27.93 67.22 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.566 178.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . 0.764 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 86.0 mtt180 -70.56 -33.53 71.22 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.564 -0.532 . . . . 10.0 109.564 178.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.32 3.78 54.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.817 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 62.7 m170 -119.61 -49.72 2.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.844 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 79.7 mt -77.48 -36.34 52.82 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.46 0.541 . . . . 10.0 112.46 -179.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -57.37 -57.17 26.89 Favored Pre-proline 0 C--N 1.331 -0.211 0 C-N-CA 120.747 -0.381 . . . . 10.0 110.973 179.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -62.96 -34.36 71.33 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.21 1.273 . . . . 10.0 110.166 177.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . 0.502 ' HA ' ' OE1' ' C' ' 524' ' ' GLU . 35.2 t80 -61.55 -45.81 92.59 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.767 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . 0.49 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 12.1 p -63.86 -34.75 78.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.969 0.414 . . . . 10.0 110.392 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . 0.424 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 2.6 t0 -70.79 -40.22 72.68 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.455 -0.572 . . . . 10.0 109.455 178.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . 0.502 ' OE1' ' HA ' ' C' ' 521' ' ' TYR . 69.0 mt-10 -64.26 -40.3 95.7 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 108.451 -0.944 . . . . 10.0 108.451 178.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 35.6 mt -62.89 -38.53 91.27 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 115.3 -0.864 . . . . 10.0 109.655 178.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . 0.49 ' HG3' ' O ' ' C' ' 522' ' ' SER . 78.6 mtt180 -58.3 -40.2 81.38 Favored 'General case' 0 C--O 1.226 -0.174 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.322 178.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -64.94 -49.35 70.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.979 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 44.4 mtt180 -64.25 -39.95 95.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.109 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 60.0 mt -70.22 -30.34 67.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.055 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -61.89 -48.09 82.04 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.78 -40.69 92.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.422 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . 0.811 HH21 ' HB3' ' A' ' 242' ' ' GLU . 8.5 ttm180 -59.44 -46.76 87.84 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.669 -0.696 . . . . 10.0 109.94 178.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 65.1 mt -66.15 -39.77 90.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.813 -0.631 . . . . 10.0 110.125 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -62.57 -39.41 93.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 10.0 109.935 178.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.41 -42.72 92.26 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.669 -0.863 . . . . 10.0 108.669 177.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.5 -24.45 67.14 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.1 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -79.18 -45.63 19.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.843 178.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -63.22 -52.17 63.3 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 54.2 m-20 -68.34 -30.71 69.73 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.569 -0.741 . . . . 10.0 109.519 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . 0.483 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -65.79 -51.91 42.61 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.21 -0.756 . . . . 10.0 111.21 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -60.48 -38.25 94.55 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 110.734 -0.947 . . . . 10.0 110.734 178.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -63.42 -54.28 39.04 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.845 -0.798 . . . . 10.0 108.845 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' C' ' 543' ' ' ARG . 50.0 mtt180 -55.14 -41.76 72.16 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.61 179.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 55.8 mt -56.57 -50.43 71.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.667 0.27 . . . . 10.0 110.808 179.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.85 -47.53 68.69 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.023 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -60.72 -44.52 96.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.879 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -69.85 -37.89 76.3 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.015 -0.365 . . . . 10.0 110.015 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.4 m170 -63.5 -46.64 85.15 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.864 -0.421 . . . . 10.0 109.864 179.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . 0.501 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -63.1 -45.6 91.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.978 -0.556 . . . . 10.0 109.527 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . 0.449 ' HA ' ' HD3' ' C' ' 550' ' ' LYS . 0.1 OUTLIER -63.12 -35.57 80.71 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.772 179.304 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -67.57 -36.8 81.63 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.28 -0.637 . . . . 10.0 109.28 178.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 18.1 m -63.06 -48.19 79.71 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 108.174 -1.047 . . . . 10.0 108.174 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . 0.501 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 39.8 mt-10 -59.47 -43.49 93.24 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.023 178.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . 0.504 ' O ' ' HB2' ' C' ' 558' ' ' LEU . 39.6 t-80 -63.87 -31.79 73.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.63 -0.714 . . . . 10.0 111.397 179.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 60.4 mt -73.72 -49.02 27.71 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.167 -0.308 . . . . 10.0 110.167 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 5.5 m -62.12 -33.73 75.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.033 0.444 . . . . 10.0 110.629 179.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 33.2 p -83.45 -9.7 58.83 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.107 0.479 . . . . 10.0 110.944 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . 0.504 ' HB2' ' O ' ' C' ' 554' ' ' HIS . 0.2 OUTLIER -86.51 -47.75 8.98 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.459 -1.311 . . . . 10.0 107.459 177.806 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . 0.706 ' HB2' ' HE2' ' C' ' 563' ' ' LYS . 1.7 p -67.83 -23.22 65.14 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.442 -0.947 . . . . 10.0 108.442 177.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -57.92 -25.69 61.22 Favored 'General case' 0 CA--C 1.524 -0.045 0 CA-C-N 114.907 -1.042 . . . . 10.0 109.505 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . 0.443 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 47.4 mttp -112.4 -33.94 6.03 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.571 -0.741 . . . . 10.0 110.35 179.306 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . 0.612 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -61.16 -11.47 9.12 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.948 0.404 . . . . 10.0 111.896 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . 0.706 ' HE2' ' HB2' ' C' ' 559' ' ' SER . 62.9 mttm -98.09 -67.07 0.06 OUTLIER Pre-proline 0 C--N 1.325 -0.496 0 C-N-CA 120.913 -0.315 . . . . 10.0 111.316 178.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . 0.572 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 55.8 Cg_endo -69.92 -40.92 4.53 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 121.887 1.725 . . . . 10.0 113.467 -179.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . 0.443 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -68.07 -42.78 79.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.496 0.189 . . . . 10.0 110.702 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' C' ' 562' ' ' ALA . 8.0 mt -64.01 -39.44 94.11 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.723 -0.391 . . . . 10.0 109.958 178.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -68.96 -33.32 73.51 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.855 -0.424 . . . . 10.0 109.855 178.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.04 -44.93 91.0 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.341 -0.985 . . . . 10.0 108.341 178.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 83.2 mt -67.19 -38.17 84.89 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.131 -0.94 . . . . 10.0 110.356 178.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -64.25 -38.18 90.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.452 0.644 . . . . 10.0 109.605 178.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -81.69 -10.31 59.42 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.408 -0.815 . . . . 20.0 111.285 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -92.23 -47.96 3.18 Favored Glycine 0 CA--C 1.521 0.432 0 N-CA-C 108.993 -1.643 . . . . 10.0 108.993 178.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . 0.434 ' HA ' ' HB ' ' C' ' 576' ' ' VAL . 75.0 mt -61.54 -25.03 67.03 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.572 -0.314 . . . . 10.0 111.45 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 4.7 mt -60.07 -66.34 1.55 Allowed Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 121.191 -0.204 . . . . 10.0 111.038 178.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.98 -28.73 57.76 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 121.711 1.607 . . . . 10.0 111.094 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . 0.434 ' HB ' ' HA ' ' C' ' 573' ' ' LEU . 5.7 t -64.39 -47.07 91.05 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 178.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 34.0 mt -67.38 -34.93 78.3 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.919 -0.4 . . . . 10.0 109.919 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -62.9 -47.85 81.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.315 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 4.2 p -71.21 -36.57 71.92 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.917 -0.401 . . . . 10.0 109.917 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.7 -43.65 98.44 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 178.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -62.06 -44.99 95.49 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 178.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 50.8 t -59.29 -44.24 91.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.204 0.526 . . . . 10.0 109.624 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 15.2 m -65.98 -45.18 82.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.706 -0.679 . . . . 10.0 111.05 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -69.68 -40.91 76.09 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.375 0.509 . . . . 10.0 112.375 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 52.7 mt -61.29 -40.27 93.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.865 0.364 . . . . 10.0 110.049 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . 0.478 ' O ' ' HG3' ' C' ' 590' ' ' GLU . 19.1 m -73.47 -37.43 65.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.078 -0.712 . . . . 10.0 109.078 178.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -58.89 -50.52 73.71 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.674 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.9 mt -62.82 -37.61 87.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.29 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . 0.409 ' HG2' ' HE3' ' C' ' 593' ' ' LYS . 3.5 tt0 -62.64 -46.5 87.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.337 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' C' ' 586' ' ' SER . 55.2 mt-10 -63.81 -40.99 97.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.78 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -64.54 -42.99 95.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.879 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 1.6 p -69.49 -21.93 63.65 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.562 0.579 . . . . 10.0 112.562 -179.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . 0.409 ' HE3' ' HG2' ' C' ' 589' ' ' GLU . 90.5 mttt -84.94 -14.86 46.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.306 0.574 . . . . 10.0 110.586 179.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.19 -48.98 4.22 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.76 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 89.2 mt -94.2 48.94 1.27 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.143 0.497 . . . . 10.0 110.478 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 . . . . . 0 C--O 1.251 1.146 0 CA-C-O 118.652 -0.69 . . . . 10.0 110.825 -179.067 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 120.643 0.258 . . . . 10.0 110.749 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . 0.728 ' HG2' ' HB2' ' B' ' 52' ' ' LEU . 0.0 OUTLIER -145.63 138.84 26.21 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.878 -0.786 . . . . 10.0 108.878 -179.423 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -140.16 127.28 20.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.061 0.457 . . . . 10.0 111.91 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.453 ' HG3' ' HB3' ' B' ' 54' ' ' ASP . 14.3 mptt -93.22 117.9 30.61 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.846 -0.798 . . . . 10.0 108.846 178.538 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 68.8 mt -110.69 118.24 35.64 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.206 0.527 . . . . 10.0 111.663 -178.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.402 HG13 HD23 ' B' ' 56' ' ' LEU . 39.6 t -95.71 112.05 27.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.437 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 38.6 t -94.32 116.0 34.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 109.596 -0.52 . . . . 10.0 109.596 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 21.2 m -105.33 167.54 2.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.425 -0.352 . . . . 10.0 111.336 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 150.56 165.69 12.92 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 111.458 -0.657 . . . . 10.0 111.458 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.26 169.06 14.15 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.726 0.298 . . . . 10.0 111.025 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -77.75 61.32 3.67 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.298 -0.477 . . . . 10.0 112.373 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -153.83 -32.06 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 111.027 -0.829 . . . . 10.0 111.027 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 21.4 m -77.2 166.68 2.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 110.205 -0.294 . . . . 10.0 110.205 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -83.77 54.96 5.0 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.756 -0.735 . . . . 10.0 113.498 -179.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 18.5 mtmt -60.62 -61.99 2.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.989 0.423 . . . . 10.0 111.204 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . 0.415 ' O ' HG13 ' B' ' 21' ' ' ILE . 1.8 p -63.99 -36.27 83.41 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.82 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.58 -50.0 75.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.113 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 63.8 mt -61.31 -42.68 99.07 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.831 0.348 . . . . 10.0 110.767 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 13.7 m -61.24 -49.21 78.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.953 -0.567 . . . . 10.0 111.002 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . 0.415 HG13 ' O ' ' B' ' 17' ' ' SER . 67.4 mt -67.39 -32.49 57.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.79 0.328 . . . . 10.0 110.591 179.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.527 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 5.5 tp-100 -67.68 -18.61 65.0 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.121 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.8 tp -99.11 -37.88 9.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.208 0.528 . . . . 10.0 110.656 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 45.8 mm -76.04 -68.92 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.408 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . 0.556 ' NE2' ' HA ' ' D' ' 840' ' ' VAL . 39.6 mt-30 -85.89 -21.55 27.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.061 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.527 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 27.9 m-80 66.97 34.53 5.17 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.971 -178.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -127.45 126.97 43.29 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.252 -0.886 . . . . 10.0 109.277 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . 0.443 ' HB2' HE22 ' B' ' 22' ' ' GLN . 52.9 t80 -78.19 133.44 37.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.93 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 3.4 m -107.62 123.71 63.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.762 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -89.08 -29.32 19.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.589 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -68.31 135.01 51.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.463 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -87.33 94.42 9.67 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.979 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 2.0 t70 -98.11 130.68 28.0 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 109.486 -0.561 . . . . 10.0 109.486 179.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 31.0 Cg_exo -64.14 178.08 1.69 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.97 2.447 . . . . 10.0 112.454 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.2 m -163.69 141.73 7.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.225 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.794 HD11 HG21 ' D' ' 809' ' ' THR . 5.3 mt -118.7 -65.19 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 108.654 -0.869 . . . . 10.0 108.654 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.48 ' O ' HG23 ' D' ' 821' ' ' VAL . 14.1 tt0 -148.77 93.45 2.12 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.093 -0.706 . . . . 10.0 109.093 179.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . 0.718 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 56.6 m-20 -114.13 160.95 18.38 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.654 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . 0.406 ' HB2' ' HB3' ' D' ' 818' ' ' GLN . 4.5 m -146.53 140.41 26.14 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.971 0.415 . . . . 10.0 112.021 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . 0.592 ' CE2' HG22 ' D' ' 840' ' ' VAL . 2.8 m-85 -129.67 152.43 49.19 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 109.336 -0.616 . . . . 10.0 109.336 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . 0.602 HH12 ' HD3' ' D' ' 817' ' ' LYS . 11.7 ttp180 -141.47 137.25 31.99 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 122.076 -0.39 . . . . 10.0 110.826 -178.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -155.92 147.51 22.87 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -102.16 125.62 48.9 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.782 -0.451 . . . . 10.0 109.782 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 15.6 m -136.97 158.26 36.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.847 0.356 . . . . 10.0 111.074 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.613 ' HA ' ' HA ' ' B' ' 50' ' ' THR . 24.7 t -95.63 101.71 12.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 109.179 -0.674 . . . . 10.0 109.179 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . 0.528 HD11 HD11 ' B' ' 53' ' ' LEU . 54.5 mt -92.26 105.28 16.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.453 -178.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 57.25 36.63 27.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.5 -0.773 . . . . 10.0 111.728 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.1 -15.32 62.67 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.772 -0.728 . . . . 10.0 113.611 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -106.13 109.05 20.86 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.874 0.337 . . . . 10.0 111.07 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.613 ' HA ' ' HA ' ' B' ' 45' ' ' VAL . 11.1 t -76.04 143.52 41.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.561 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 1.4 p -165.0 162.41 20.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.378 -179.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.728 ' HB2' ' HG2' ' B' ' 3' ' ' GLU . 17.6 mt -95.06 129.49 42.13 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 179.053 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.528 HD11 HD11 ' B' ' 46' ' ' ILE . 89.6 mt -110.03 122.09 46.77 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.958 -0.297 . . . . 10.0 111.552 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.453 ' HB3' ' HG3' ' B' ' 5' ' ' LYS . 7.8 t70 -99.25 100.9 12.05 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.067 -1.086 . . . . 10.0 108.067 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 32.1 mt -88.86 126.02 41.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.346 -178.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.402 HD23 HG13 ' B' ' 7' ' ' VAL . 33.0 tp -101.1 116.31 32.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.778 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.718 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 9.1 t0 -92.48 98.94 11.78 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 40.1 p -77.92 164.92 24.7 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 113.004 0.742 . . . . 10.0 113.004 -178.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.63 163.59 23.41 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.219 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.63 -32.04 47.77 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.73 -0.747 . . . . 10.0 112.675 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -150.28 131.85 14.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.823 0.344 . . . . 20.0 111.218 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.429 ' OE2' ' HD2' ' B' ' 68' ' ' ARG . 36.6 mt-10 -133.46 158.35 43.32 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.527 -0.546 . . . . 10.0 109.527 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -92.68 -74.38 0.52 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.127 0.489 . . . . 10.0 109.722 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -162.99 61.01 0.19 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.364 -0.834 . . . . 10.0 109.096 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.49 126.82 31.58 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.415 -0.812 . . . . 10.0 111.486 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.07 -37.44 87.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.255 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 7.9 tmm? -63.11 -34.32 77.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.287 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.685 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 32.3 ttt85 -61.86 -46.7 88.31 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.396 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.61 -24.65 67.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.633 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -78.54 -44.4 24.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.767 -0.651 . . . . 10.0 111.115 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . 0.685 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 1.4 p90 -70.95 -29.27 65.24 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 120.363 -0.535 . . . . 10.0 112.183 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 76.5 mtp -79.42 -15.22 58.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 10.0 109.996 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . 0.789 ' HD3' ' HB ' ' B' ' 103' ' ' VAL . 2.9 tpp180 -74.01 -27.01 60.75 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.18 -179.262 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 m -82.8 -33.2 27.32 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.689 0.625 . . . . 10.0 112.689 -178.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -57.29 148.28 33.7 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 114.445 0.538 . . . . 10.0 114.445 -178.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . 0.491 ' O ' ' HD2' ' B' ' 110' ' ' PRO . 13.6 tt0 -111.21 -39.71 4.65 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-O 121.112 0.482 . . . . 10.0 109.8 178.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -118.51 138.11 13.47 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 110.998 -0.841 . . . . 10.0 110.998 179.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.403 ' O ' ' HA ' ' B' ' 111' ' ' MET . 85.5 m-85 -129.58 143.08 50.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.051 0.453 . . . . 10.0 111.949 -178.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.746 ' HG ' HD22 ' B' ' 159' ' ' LEU . 58.7 mt -99.85 122.21 42.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.144 179.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . 0.428 ' HB2' ' HA ' ' B' ' 113' ' ' LEU . 6.7 m -88.87 78.88 7.49 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.533 ' HA ' ' HB ' ' B' ' 114' ' ' VAL . 21.5 t -82.91 118.66 30.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.547 -178.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.824 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 18.8 p90 -134.75 158.93 42.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.855 -0.612 . . . . 10.0 109.712 178.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -97.29 130.69 44.45 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . 0.668 HD11 ' HA ' ' B' ' 118' ' ' CYS . 27.7 pt -73.31 -5.25 6.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.015 0.436 . . . . 10.0 111.372 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.08 3.5 28.19 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.027 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -126.62 116.81 21.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.915 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.41 -32.36 71.29 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.283 0.475 . . . . 10.0 112.283 -178.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -60.97 -46.19 91.73 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 111.654 0.242 . . . . 10.0 111.654 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . 0.824 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.8 OUTLIER -59.73 -26.32 65.55 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.43 0.53 . . . . 10.0 112.43 -179.643 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -70.54 -34.01 71.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.041 0.448 . . . . 10.0 110.138 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -85.71 -26.99 25.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.738 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . 0.467 ' HB2' ' HA ' ' B' ' 89' ' ' SER . 0.3 OUTLIER -66.71 -17.07 64.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.439 179.752 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . 0.632 HD11 ' HB3' ' B' ' 82' ' ' PHE . 43.6 mm -60.69 -45.82 96.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -67.71 -37.13 81.83 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 8.7 t-160 -61.42 -39.32 90.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.396 -0.82 . . . . 10.0 110.195 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -74.83 -46.72 34.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.526 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.97 -40.76 85.75 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.673 0.273 . . . . 10.0 111.27 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -65.32 -34.41 78.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.758 0.313 . . . . 10.0 111.144 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -69.25 -46.23 67.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.224 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . 0.502 ' HA ' HG22 ' B' ' 103' ' ' VAL . 41.8 mt -68.29 -33.96 63.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.115 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . 0.419 ' HD2' ' HG3' ' B' ' 107' ' ' GLU . 29.2 ttpt -60.43 -31.41 70.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.984 0.421 . . . . 10.0 110.642 179.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 44.9 ttp85 -78.21 -34.05 49.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.009 -0.542 . . . . 10.0 111.852 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.789 ' HB ' ' HD3' ' B' ' 73' ' ' ARG . 19.9 m -77.39 -32.11 18.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 112.405 0.52 . . . . 10.0 112.405 -179.157 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -95.92 -14.66 22.93 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.682 -0.407 . . . . 10.0 111.379 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 26.2 t0 58.85 48.15 11.6 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.496 0.665 . . . . 10.0 110.995 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 32.5 t -178.23 153.59 0.78 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.445 -0.798 . . . . 10.0 110.336 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . 0.419 ' HG3' ' HD2' ' B' ' 101' ' ' LYS . 17.1 mp0 -91.82 -8.17 47.39 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 108.715 -0.846 . . . . 10.0 108.715 178.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -83.82 64.02 7.82 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 114.969 -1.014 . . . . 10.0 110.568 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 50.5 t -121.15 116.95 30.88 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.226 -0.897 . . . . 10.0 109.797 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . 0.491 ' HD2' ' O ' ' B' ' 76' ' ' GLU . 51.4 Cg_exo -55.77 113.14 1.29 Allowed 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.927 2.418 . . . . 10.0 111.555 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . 0.403 ' HA ' ' O ' ' B' ' 78' ' ' PHE . 65.3 mtt -133.28 150.95 51.89 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.293 -179.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . 0.481 ' HB ' HD23 ' B' ' 79' ' ' LEU . 95.1 t -132.0 124.96 54.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 179.2 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . 0.428 ' HA ' ' HB2' ' B' ' 80' ' ' CYS . 15.0 tp -75.6 121.09 21.91 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.8 -0.815 . . . . 10.0 108.8 179.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . 0.533 ' HB ' ' HA ' ' B' ' 81' ' ' VAL . 60.8 t -114.8 111.5 36.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 112.026 0.38 . . . . 10.0 112.026 -178.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -89.38 100.12 2.63 Favored Glycine 0 N--CA 1.449 -0.486 0 N-CA-C 109.746 -1.341 . . . . 10.0 109.746 178.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -86.67 153.13 21.99 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 112.544 0.572 . . . . 10.0 112.544 -177.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 77.4 mttt 70.38 46.39 0.58 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 114.919 -1.037 . . . . 10.0 113.442 178.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . 0.668 ' HA ' HD11 ' B' ' 84' ' ' ILE . 15.5 p -78.78 -2.53 39.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.986 0.422 . . . . 10.0 111.404 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -92.67 0.56 57.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.967 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 17.7 mt -97.13 127.08 39.82 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.838 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.68 -26.59 68.7 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.999 2.466 . . . . 10.0 111.286 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.35 70.4 4.7 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.589 -0.732 . . . . 10.0 110.001 179.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 24.6 ttt180 -101.41 122.46 43.79 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.579 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.21 -49.43 4.48 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.361 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 62.1 t -78.67 116.51 22.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.665 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -73.3 153.48 40.54 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.028 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . 0.404 HG22 HE21 ' B' ' 131' ' ' GLN . 2.3 m -60.15 -37.41 80.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.229 179.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 16.4 tttm -68.25 -36.93 80.21 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 121.174 -0.211 . . . . 10.0 111.092 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -60.26 -39.65 87.55 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.058 0.456 . . . . 10.0 110.188 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -71.93 -41.22 68.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.114 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.404 HE21 HG22 ' B' ' 127' ' ' THR . 76.9 mt-30 -61.64 -37.09 82.71 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.895 179.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.89 -46.76 80.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.149 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 32.8 tp -64.36 -42.13 96.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.451 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.76 -44.56 95.89 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.967 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.59 -27.53 69.01 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.071 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.9 m -71.21 -25.73 62.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.074 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . 0.431 ' HB2' HG12 ' B' ' 139' ' ' ILE . 21.8 m-85 -99.8 -20.0 16.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.975 0.416 . . . . 10.0 110.376 179.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.89 21.49 52.82 Favored Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 111.018 -0.833 . . . . 10.0 111.018 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . 0.431 HG12 ' HB2' ' B' ' 137' ' ' TYR . 49.1 pt -109.58 155.78 40.76 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.732 -0.234 . . . . 10.0 110.654 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -79.9 158.01 24.16 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.341 2.027 . . . . 10.0 111.97 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -120.76 122.95 41.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.553 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 24.0 mm -122.0 116.52 49.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.715 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . 0.6 ' HG2' ' HB3' ' B' ' 118' ' ' CYS . 6.8 tt0 -83.19 128.13 34.22 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.74 -0.837 . . . . 10.0 108.74 178.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 81.4 p -135.66 167.82 20.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.884 0.85 . . . . 10.0 112.987 -177.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . 0.409 ' HB3' ' OG1' ' B' ' 148' ' ' THR . 5.6 t -157.55 131.81 8.32 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.471 -1.24 . . . . 10.0 108.173 178.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -76.71 -14.56 59.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.842 0.353 . . . . 10.0 110.639 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -85.48 -44.43 12.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.954 -0.566 . . . . 10.0 111.111 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . 0.409 ' OG1' ' HB3' ' B' ' 145' ' ' SER . 48.9 p -86.05 -25.83 25.68 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.992 0.425 . . . . 10.0 110.368 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 14.2 ttt-85 66.07 27.55 10.55 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.435 -0.802 . . . . 10.0 110.682 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -91.9 127.53 37.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.262 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.35 7.22 67.49 Favored Glycine 0 C--O 1.228 -0.268 0 CA-C-N 115.977 -0.556 . . . . 10.0 113.939 178.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 95.3 t -66.57 -55.36 18.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.72 0.295 . . . . 10.0 111.63 -179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.46 -42.46 98.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.672 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -65.05 -31.77 73.16 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.319 0.489 . . . . 10.0 112.319 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.91 -46.67 89.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.107 0.48 . . . . 10.0 109.868 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -70.94 -40.03 72.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.384 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -62.92 -44.36 96.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.228 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.767 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 70.7 m -63.91 -33.68 76.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.859 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.746 HD22 ' HG ' ' B' ' 79' ' ' LEU . 58.1 tp -60.9 -42.82 98.76 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . 0.419 HG21 HD13 ' B' ' 46' ' ' ILE . 47.8 t -69.76 -32.96 54.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.74 178.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . 0.767 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 72.8 mtt180 -63.4 -41.19 98.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.557 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -64.65 -38.17 90.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . 0.547 HG22 ' HE2' ' B' ' 167' ' ' LYS . 97.1 mt -67.02 -40.12 84.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.477 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 30.1 ttm180 -58.17 -46.52 85.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.584 -0.735 . . . . 10.0 109.701 179.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -70.39 -33.32 71.25 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.291 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -59.93 -41.79 92.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.756 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . 0.547 ' HE2' HG22 ' B' ' 163' ' ' ILE . 67.6 mttm -68.22 -43.66 77.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.691 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -67.83 -33.52 74.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.078 0.466 . . . . 10.0 110.201 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -67.78 -28.92 68.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.704 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 54.8 ttp -62.01 -38.01 87.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.95 0.405 . . . . 10.0 111.233 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 49.9 m . . . . . 0 C--N 1.327 -0.398 0 CA-C-O 121.191 0.519 . . . . 10.0 111.077 179.634 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.134 -0.386 . . . . 10.0 112.134 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' D' D ' 809' ' ' THR . . . . . 0.794 HG21 HD11 ' B' ' 36' ' ' ILE . 11.8 p -122.7 145.83 48.04 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.667 0.27 . . . . 10.0 110.562 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 51.0 t -121.88 136.19 59.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.639 -0.255 . . . . 10.0 110.359 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 811' ' ' LYS . . . . . 0.533 ' HG2' HG22 ' D' ' 821' ' ' VAL . 80.2 mttt -86.55 120.79 28.24 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.19 0.519 . . . . 10.0 110.862 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 44.7 t -105.65 123.55 60.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.493 179.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 813' ' ' TYR . . . . . 0.809 ' HB2' HG12 ' D' ' 876' ' ' ILE . 80.1 m-85 -91.15 137.26 32.5 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.038 0.447 . . . . 10.0 110.785 -179.396 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 814' ' ' LEU . . . . . 0.772 HD13 ' HD2' ' D' ' 841' ' ' ARG . 13.3 mt -105.46 153.22 39.91 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.388 -178.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -65.01 -13.71 41.29 Favored 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 123.263 2.642 . . . . 10.0 113.428 -179.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -90.27 37.92 0.92 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.967 -0.383 . . . . 10.0 109.967 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 817' ' ' LYS . . . . . 0.602 ' HD3' HH12 ' B' ' 41' ' ' ARG . 30.0 mtpp 51.94 39.43 26.03 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.207 -0.906 . . . . 10.0 111.646 -179.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 818' ' ' GLN . . . . . 0.496 HE22 ' C ' ' B' ' 40' ' ' TYR . 84.1 mt-30 -136.63 -169.51 2.48 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 114.515 1.302 . . . . 10.0 114.515 -177.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 819' ' ' ARG . . . . . 0.46 ' NH1' ' HA ' ' D' ' 818' ' ' GLN . 0.0 OUTLIER -151.85 167.73 27.36 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.123 -0.944 . . . . 10.0 111.539 -178.363 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 14.7 t -154.03 139.12 17.36 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.949 -1.13 . . . . 10.0 107.949 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 821' ' ' VAL . . . . . 0.553 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 3.2 t -107.87 112.79 41.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 C-N-CA 120.443 -0.503 . . . . 10.0 111.202 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 5.6 t -110.22 148.91 13.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.54 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 2.6 m -88.68 108.33 19.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.115 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 61.5 t -77.7 121.18 29.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.942 0.401 . . . . 10.0 110.636 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 21.6 mtp85 -122.41 156.14 34.63 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.186 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -73.54 139.4 45.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.811 0.338 . . . . 10.0 110.766 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 110.82 -36.91 3.98 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.781 -0.724 . . . . 10.0 112.252 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 12.0 ptm -81.42 149.74 28.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.741 0.305 . . . . 10.0 110.61 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 97.9 p -100.03 176.3 5.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.952 0.406 . . . . 10.0 110.657 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 16.1 t -63.2 -36.82 77.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.193 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -62.47 -44.87 95.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.484 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -65.21 -47.52 76.58 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.048 0.452 . . . . 10.0 111.072 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 3.1 m -64.89 -43.0 94.33 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.769 -0.651 . . . . 10.0 112.416 -178.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.87 -16.63 56.8 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.31 0.856 . . . . 10.0 113.31 -178.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -59.23 -50.78 72.68 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.031 0.443 . . . . 10.0 111.01 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 5.5 mmmm -66.3 -25.92 67.08 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.387 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -80.11 -18.02 51.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.533 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 838' ' ' LEU . . . . . 0.563 HD21 HG11 ' D' ' 877' ' ' VAL . 78.2 mt -100.68 -48.66 4.43 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.236 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -58.26 -33.16 69.08 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.983 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 840' ' ' VAL . . . . . 0.755 HG13 ' HG3' ' D' ' 841' ' ' ARG . 9.6 p -56.03 -22.63 13.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 115.805 -0.634 . . . . 10.0 112.096 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 841' ' ' ARG . . . . . 0.772 ' HD2' HD13 ' D' ' 814' ' ' LEU . 0.9 OUTLIER -119.53 13.23 12.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.586 -179.381 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 75.95 19.33 78.87 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.68 -0.771 . . . . 10.0 112.526 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 58.5 mt -92.65 175.51 6.79 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.935 -0.394 . . . . 10.0 109.935 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -152.22 155.15 37.19 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.382 -0.229 . . . . 10.0 110.382 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 845' ' ' GLN . . . . . 0.47 ' HG3' HD12 ' D' ' 838' ' ' LEU . 22.4 mp0 -75.6 71.01 2.48 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.995 0.426 . . . . 10.0 111.054 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -129.4 -70.45 0.65 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.669 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -104.62 15.31 28.26 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.395 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 16.0 m -111.5 129.74 55.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.198 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 6.1 p -121.69 153.12 25.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.486 -0.324 . . . . 10.0 110.517 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 20.1 t -100.16 136.28 32.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.132 0.492 . . . . 10.0 111.523 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 851' ' ' TYR . . . . . 0.51 ' CE2' HG22 ' D' ' 860' ' ' VAL . 86.9 m-85 -112.83 135.01 54.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.687 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 852' ' ' ARG . . . . . 0.494 ' HG3' ' HB ' ' D' ' 861' ' ' THR . 61.1 mtp180 -78.97 131.4 36.32 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 178.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 853' ' ' LEU . . . . . 0.722 HD21 ' HE3' ' D' ' 858' ' ' LYS . 0.4 OUTLIER -106.73 114.12 28.03 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.121 0.486 . . . . 10.0 111.746 -179.315 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 2.4 pt -150.75 141.21 16.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt 68.47 -53.29 0.55 Allowed 'General case' 0 N--CA 1.472 0.631 0 O-C-N 123.653 0.596 . . . . 10.0 112.567 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 167.09 -30.56 0.19 Allowed Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 111.21 -0.756 . . . . 10.0 111.21 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 11.9 mmt180 -83.68 150.64 25.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.749 0.309 . . . . 10.0 110.629 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 858' ' ' LYS . . . . . 0.722 ' HE3' HD21 ' D' ' 853' ' ' LEU . 7.6 mptt -108.71 114.67 28.67 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.26 -0.427 . . . . 10.0 109.927 179.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.02 138.75 42.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.574 0.226 . . . . 10.0 111.212 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 860' ' ' VAL . . . . . 0.51 HG22 ' CE2' ' D' ' 851' ' ' TYR . 1.6 t -62.99 146.9 12.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.95 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 861' ' ' THR . . . . . 0.494 ' HB ' ' HG3' ' D' ' 852' ' ' ARG . 1.8 t -134.2 160.59 37.39 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.165 179.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -99.35 157.62 16.28 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.502 -0.317 . . . . 10.0 110.417 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -78.79 -29.6 45.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.931 0.395 . . . . 10.0 111.127 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -89.25 50.03 1.86 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.992 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 1.3 m -123.91 153.1 41.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.823 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -67.59 141.49 56.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.83 0.348 . . . . 10.0 110.811 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 9.9 tp -91.86 -14.4 8.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.183 0.516 . . . . 10.0 111.08 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 868' ' ' ALA . . . . . 0.453 ' N ' ' HD2' ' D' ' 869' ' ' PRO . . . -55.28 -49.37 92.79 Favored Pre-proline 0 CA--C 1.541 0.62 0 N-CA-C 113.795 1.035 . . . . 10.0 113.795 -179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 869' ' ' PRO . . . . . 0.453 ' HD2' ' N ' ' D' ' 868' ' ' ALA . 50.9 Cg_endo -68.89 -13.35 36.58 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 122.143 1.895 . . . . 10.0 113.058 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 8.8 mp -85.94 81.93 8.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.257 0.551 . . . . 10.0 110.557 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -139.52 123.4 17.63 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.107 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 87.68 15.6 61.36 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.911 -0.662 . . . . 10.0 112.02 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -127.09 159.44 34.2 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 122.871 -0.194 . . . . 10.0 110.613 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 874' ' ' GLU . . . . . 0.417 ' HB2' ' HB3' ' D' ' 853' ' ' LEU . 2.2 mp0 -102.47 174.07 6.07 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.092 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 93.1 mt -136.56 131.41 33.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.71 -0.223 . . . . 10.0 110.568 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 876' ' ' ILE . . . . . 0.809 HG12 ' HB2' ' D' ' 813' ' ' TYR . 6.5 mt -117.11 129.09 74.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.585 -0.279 . . . . 10.0 110.301 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 877' ' ' VAL . . . . . 0.563 HG11 HD21 ' D' ' 838' ' ' LEU . 24.3 t -102.64 126.92 56.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -140.79 179.22 6.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.95 0.405 . . . . 10.0 111.112 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 20.1 m -81.39 148.11 5.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.55 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 15.3 mt . . . . . 0 C--O 1.254 1.335 0 CA-C-O 118.402 -0.809 . . . . 10.0 111.063 -179.984 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . 0.605 ' HA ' ' HB2' ' A' ' 242' ' ' GLU . 75.2 mt . . . . . 0 C--O 1.227 -0.131 0 CA-C-O 120.446 0.165 . . . . 10.0 111.153 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 54.2 mtm-85 -65.35 -50.03 67.14 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.648 -0.871 . . . . 10.0 108.648 178.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -64.73 -40.62 95.63 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.53 -0.915 . . . . 10.0 108.53 178.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . 0.605 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 41.9 mm-40 -58.94 -51.9 68.05 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.202 -0.908 . . . . 10.0 110.715 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 62.3 mtm -63.84 -28.0 69.56 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.795 0.331 . . . . 10.0 110.818 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 56.6 m -70.78 -13.46 62.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.296 178.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 41.8 mttm -109.43 -53.31 2.67 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 108.64 -0.874 . . . . 10.0 108.64 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . 0.472 ' O ' HG23 ' A' ' 250' ' ' VAL . 7.3 t70 -52.14 -64.5 0.79 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.078 -0.965 . . . . 10.0 111.395 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 95.8 mt -57.98 -39.61 78.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.977 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -65.72 -44.45 86.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.682 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -64.85 -40.53 95.31 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.518 -0.549 . . . . 10.0 109.518 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . 0.692 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 54.2 t -62.08 -51.36 73.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.451 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.016 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . 0.457 ' O ' HG12 ' A' ' 254' ' ' VAL . 84.0 mttt -66.16 -46.6 76.86 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.593 0.59 . . . . 10.0 112.593 -179.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.12 -43.87 97.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.187 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -80.32 -24.78 39.7 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.302 0.482 . . . . 10.0 112.302 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.692 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.4 OUTLIER -62.64 -27.52 43.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.924 -0.31 . . . . 10.0 110.728 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . 0.489 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 23.2 mt-30 -61.31 -62.0 6.8 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-N 116.526 -0.306 . . . . 10.0 110.591 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . 0.49 ' O ' ' HB2' ' A' ' 260' ' ' ASP . 32.4 Cg_endo -67.56 -28.51 38.04 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 121.73 1.62 . . . . 10.0 111.569 178.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -66.1 -50.37 64.29 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 109.524 -0.547 . . . . 10.0 109.524 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . 0.414 ' HG ' HG22 ' A' ' 254' ' ' VAL . 41.7 mt -68.92 -37.75 79.13 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.009 -0.542 . . . . 10.0 110.058 179.043 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -61.48 -44.55 96.88 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.497 -0.557 . . . . 10.0 109.497 178.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . 0.49 ' HB2' ' O ' ' A' ' 256' ' ' PRO . 9.4 t0 -58.57 -49.08 78.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.506 179.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -65.39 -46.39 80.26 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 115.466 -0.788 . . . . 10.0 110.934 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -58.93 -52.47 65.61 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 111.888 0.329 . . . . 10.0 111.888 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -57.05 -46.39 82.47 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 120.782 0.325 . . . . 10.0 111.289 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 0.1 OUTLIER -70.08 -38.28 75.68 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.639 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 15.3 t90 -66.43 -36.58 83.17 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 179.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . 0.444 ' O ' ' HB2' ' A' ' 270' ' ' GLU . 28.0 mt-30 -63.23 -42.21 99.21 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.465 -0.939 . . . . 10.0 108.465 178.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -66.56 -39.78 88.69 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.855 -0.795 . . . . 10.0 108.855 178.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . 0.45 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 22.9 mt-10 -60.21 -49.65 76.77 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.818 178.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 79.4 mmm -65.29 -44.67 87.22 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.703 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . 0.466 ' HG3' HH12 ' A' ' 273' ' ' ARG . 0.4 OUTLIER -60.91 -49.74 76.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.917 179.6 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . 0.467 ' O ' ' HG2' ' A' ' 275' ' ' LYS . 59.4 mt -64.2 -44.03 93.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.298 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . 0.49 ' O ' HG23 ' A' ' 276' ' ' VAL . 26.6 t80 -60.67 -47.35 86.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.222 -0.444 . . . . 10.0 109.979 179.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . 0.466 HH12 ' HG3' ' A' ' 270' ' ' GLU . 32.1 ttm105 -65.14 -37.34 87.11 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.125 0.488 . . . . 10.0 110.083 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . 0.418 ' HB2' ' O ' ' A' ' 270' ' ' GLU . 0.0 OUTLIER -63.08 -35.81 81.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.403 -0.817 . . . . 10.0 109.559 178.885 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.567 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 25.9 mmtp -80.84 -34.57 33.74 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.138 178.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 272' ' ' TYR . 12.0 t -51.78 -44.92 37.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 N-CA-C 112.112 0.412 . . . . 10.0 112.112 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . 0.44 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 54.0 mt-10 -50.6 -64.05 1.52 Allowed Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 112.613 0.597 . . . . 10.0 112.613 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . 0.519 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 50.2 Cg_endo -70.89 -35.93 8.57 Favored 'Trans proline' 0 C--N 1.355 0.91 0 C-N-CA 121.846 1.698 . . . . 10.0 113.031 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.641 HD22 ' HG2' ' C' ' 495' ' ' LYS . 28.5 mt -63.71 -39.78 95.15 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 121.031 -0.268 . . . . 10.0 111.0 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -73.86 -29.72 62.27 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.952 -0.759 . . . . 10.0 108.952 178.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . 0.422 ' O ' ' HG3' ' A' ' 285' ' ' GLU . . . -64.45 -44.52 90.85 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.89 -0.782 . . . . 10.0 108.89 178.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 65.7 mt-10 -58.9 -42.27 89.16 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 108.711 -0.848 . . . . 10.0 108.711 178.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 95.0 mt -63.36 -46.16 87.81 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.244 -0.889 . . . . 10.0 110.431 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . 0.406 HE21 ' HB3' ' A' ' 284' ' ' GLN . 16.6 mt-30 -62.27 -54.1 45.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.897 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 281' ' ' ALA . 21.7 mt-10 -60.82 -44.74 96.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.08 0.467 . . . . 10.0 110.504 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.02 -44.07 97.91 Favored Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.689 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.83 -39.39 93.49 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 109.919 -0.4 . . . . 10.0 109.919 179.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . 0.57 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 96.8 mtt180 -60.07 -42.57 94.83 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.476 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 14.1 tm0? -67.07 -49.69 64.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.176 -0.466 . . . . 10.0 109.999 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 33.6 mttp -59.42 -47.1 86.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.501 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 77.8 mt -66.31 -35.42 80.34 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.455 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . 0.57 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 20.5 t60 -60.41 -50.17 74.64 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 297' ' ' LYS . 0.4 OUTLIER -64.12 -36.47 84.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.854 179.497 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 83.0 mt -71.51 -38.64 71.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.995 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -66.83 -41.93 86.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.473 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -77.72 2.37 17.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.268 0.556 . . . . 10.0 110.24 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . 1.034 ' HE2' ' HG ' ' C' ' 477' ' ' LEU . 29.3 tttp -105.25 -37.45 6.88 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.859 -0.793 . . . . 10.0 108.859 178.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 13.7 mt -68.45 -24.57 64.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.359 -0.837 . . . . 10.0 111.053 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -62.59 1.71 Allowed Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.495 -0.32 . . . . 10.0 111.851 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -68.06 -51.55 0.61 Allowed 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 122.055 1.837 . . . . 10.0 112.445 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.812 HD13 ' HG2' ' C' ' 473' ' ' LYS . 60.2 mt -66.98 -26.65 66.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.704 0.287 . . . . 10.0 111.171 -179.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -75.81 -40.11 31.98 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 109.35 -1.5 . . . . 10.0 109.35 177.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -64.65 -43.86 92.3 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.767 -0.827 . . . . 10.0 108.767 178.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -62.62 -40.15 96.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.441 -0.799 . . . . 10.0 108.909 178.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 14.7 tpt -61.75 -41.82 98.17 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 115.693 -0.685 . . . . 10.0 109.368 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 -64.78 -42.88 94.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.473 . . . . 10.0 109.963 178.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -63.44 -46.84 84.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.251 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . 0.672 ' HG3' HD21 ' C' ' 469' ' ' LEU . 16.5 mmt180 -68.19 -33.67 74.87 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.406 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . 0.401 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -65.5 -39.34 91.77 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 178.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' A' ' 314' ' ' ASP . 44.8 mtt85 -60.22 -47.22 86.91 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.031 -0.729 . . . . 10.0 109.031 178.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -64.68 -43.09 94.68 Favored 'General case' 0 C--O 1.226 -0.184 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 178.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . 0.709 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 0.4 OUTLIER -53.45 -54.42 37.3 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.424 -0.807 . . . . 10.0 110.331 179.052 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 39.9 t -73.84 -38.68 50.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.396 -0.82 . . . . 10.0 112.053 -178.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . 0.531 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 1.3 m-20 -63.51 -40.95 98.41 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.889 0.376 . . . . 10.0 110.632 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -66.76 -28.99 68.85 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 177.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 19.2 mt -74.28 -40.65 62.17 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.191 -0.913 . . . . 10.0 109.131 178.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -62.19 -47.1 85.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.975 0.416 . . . . 10.0 110.345 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 1.4 p -66.9 -15.24 63.52 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.618 -0.719 . . . . 10.0 111.664 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -103.27 -38.19 7.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.087 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . 0.44 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 39.9 mt -64.82 -34.72 79.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.387 -0.369 . . . . 10.0 111.19 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.94 -60.82 8.37 Favored Pre-proline 0 CA--C 1.535 0.395 0 O-C-N 123.213 0.32 . . . . 10.0 110.541 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -65.16 -30.06 55.51 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 121.524 1.482 . . . . 10.0 111.08 177.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . 0.44 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 4.2 m-30 -61.8 -56.42 19.67 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 110.249 -0.278 . . . . 10.0 110.249 178.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . 0.405 ' HA ' ' HB2' ' A' ' 327' ' ' LEU . 17.0 p -66.72 -36.55 82.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.924 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -63.07 -48.61 77.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.3 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -71.57 -22.53 61.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.889 0.376 . . . . 10.0 110.009 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . 0.506 HD23 ' HG3' ' A' ' 330' ' ' ARG . 14.2 mt -69.98 -28.09 65.24 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 177.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -65.0 -39.73 93.9 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 107.323 -1.362 . . . . 10.0 107.323 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -64.93 -39.56 93.69 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.007 -0.997 . . . . 10.0 108.729 177.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . 0.69 ' O ' ' HG2' ' A' ' 334' ' ' ARG . 10.5 mmt180 -62.19 -53.4 55.84 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 108.658 -0.867 . . . . 10.0 108.658 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . 0.421 ' O ' ' HB2' ' A' ' 335' ' ' LEU . 95.6 mt -54.59 -44.01 72.65 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.454 -0.793 . . . . 10.0 110.366 179.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . 0.409 ' O ' ' HG3' ' A' ' 336' ' ' GLU . . . -62.97 -48.55 78.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.412 -0.358 . . . . 10.0 110.522 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.18 -45.64 90.5 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.592 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . 0.69 ' HG2' ' O ' ' A' ' 330' ' ' ARG . 4.0 mmt85 -66.68 -46.2 76.41 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.942 179.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 331' ' ' LEU . 5.2 mt -60.43 -41.37 93.85 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.797 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 332' ' ' ALA . 89.0 mt-10 -58.72 -44.53 90.42 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.901 -0.407 . . . . 10.0 109.901 178.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -68.77 -42.53 77.31 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.662 -0.496 . . . . 10.0 109.662 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . 0.491 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 71.6 mt -65.49 -24.38 67.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.398 179.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -89.5 -38.28 14.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.883 0.373 . . . . 10.0 110.841 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -72.94 -53.78 10.38 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.128 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -71.06 -32.52 69.23 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.509 -0.922 . . . . 10.0 108.509 178.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . 0.491 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -63.46 -46.37 92.71 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.344 -0.844 . . . . 10.0 111.121 179.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.72 -41.2 98.92 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 109.975 -1.25 . . . . 10.0 109.975 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.62 -44.18 91.36 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . 0.496 ' HD3' ' OE2' ' C' ' 433' ' ' GLU . 22.5 mtm180 -58.57 -45.07 89.81 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.397 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 87.4 mt -63.09 -51.25 67.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.816 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.24 -44.64 95.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.155 0.502 . . . . 10.0 110.373 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . 0.626 ' HB3' ' HZ1' ' A' ' 352' ' ' LYS . 27.8 mt-10 -65.5 -43.34 90.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.88 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -62.48 -36.22 81.79 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -64.86 -46.94 79.72 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.548 -0.538 . . . . 10.0 109.548 178.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -65.1 -41.46 94.95 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.246 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . 0.717 ' HZ2' ' HB3' ' C' ' 425' ' ' GLU . 16.1 mtmm -71.82 -16.91 62.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.481 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -86.67 -42.43 13.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.55 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.63 -40.29 96.52 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.948 -0.39 . . . . 10.0 109.948 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . 0.436 ' HA ' ' OG ' ' A' ' 358' ' ' SER . 5.4 mm-40 -71.14 -27.79 63.81 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.419 0.628 . . . . 10.0 109.461 178.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . 0.515 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 0.1 OUTLIER -73.75 -33.75 64.44 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.467 -0.938 . . . . 10.0 108.467 178.309 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 82.4 mt -78.68 -38.23 39.8 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.136 -0.938 . . . . 10.0 111.747 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . 0.436 ' OG ' ' HA ' ' A' ' 355' ' ' GLU . 1.9 p -63.11 -45.89 89.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.923 0.392 . . . . 10.0 109.967 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . 0.592 ' HA ' ' OE1' ' A' ' 362' ' ' GLU . 17.6 p -71.96 -15.98 62.08 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.473 0.654 . . . . 10.0 109.256 178.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 356' ' ' HIS . 18.6 tp -84.32 -28.87 26.78 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.396 -0.82 . . . . 10.0 109.118 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 3.1 m -64.71 -34.27 77.92 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.107 -1.071 . . . . 10.0 108.107 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . 0.592 ' OE1' ' HA ' ' A' ' 359' ' ' THR . 32.5 mt-10 -73.55 -0.08 14.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.703 -1.135 . . . . 10.0 110.538 178.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.658 ' HG2' HG22 ' C' ' 411' ' ' THR . 55.4 mttp -115.38 -37.06 4.13 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.548 -0.908 . . . . 10.0 108.548 177.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -75.29 -14.78 60.53 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.591 -0.731 . . . . 10.0 111.72 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.93 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 94.0 mttt -110.64 -71.19 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 120.73 -0.388 . . . . 10.0 112.028 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.93 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 40.7 Cg_exo -59.4 -52.22 5.11 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.06 1.84 . . . . 10.0 112.322 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . 0.587 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -62.82 -40.24 96.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.561 0.22 . . . . 10.0 111.468 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.75 -43.21 94.06 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.975 -0.38 . . . . 10.0 109.975 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . 0.599 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 16.0 mt-10 -65.34 -34.82 79.22 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 109.744 -0.465 . . . . 10.0 109.744 178.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -44.7 91.96 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 178.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 82.5 mt -62.29 -40.71 97.16 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.333 178.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.574 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 65.0 mtt180 -62.91 -43.68 98.14 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.249 -0.648 . . . . 10.0 109.249 178.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.599 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.3 mt-30 -62.33 -26.61 68.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.257 -0.883 . . . . 20.0 112.564 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -89.23 -38.63 6.67 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 109.684 -1.366 . . . . 10.0 109.684 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 31.9 mt -58.1 -35.88 72.08 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.706 0.262 . . . . 10.0 111.706 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 35.3 mt -55.96 -65.38 1.56 Allowed Pre-proline 0 CA--C 1.538 0.507 0 N-CA-C 111.612 0.227 . . . . 10.0 111.612 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . 0.545 ' HD3' ' HB2' ' A' ' 376' ' ' LEU . 37.9 Cg_endo -66.9 -30.53 39.86 Favored 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 122.069 1.846 . . . . 10.0 111.783 179.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 4.3 t -64.89 -48.91 82.35 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 CA-C-O 120.514 0.197 . . . . 10.0 110.567 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 41.6 mt -64.22 -35.61 81.39 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . 0.442 ' HG3' ' O ' ' A' ' 376' ' ' LEU . 19.4 mt-10 -66.25 -53.7 33.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.799 178.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 5.5 p -60.54 -38.05 83.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.861 0.362 . . . . 10.0 110.464 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -63.12 -49.32 74.89 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.923 -0.58 . . . . 10.0 109.835 178.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -62.89 -42.22 99.69 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 116.483 -0.326 . . . . 10.0 110.863 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 48.0 t -58.43 -47.3 88.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 12.7 m -69.42 -38.96 78.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.148 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . 0.469 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 3.3 m-85 -67.36 -49.46 63.89 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.688 0.255 . . . . 10.0 111.688 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 92.1 mt -59.82 -41.34 91.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.49 -0.323 . . . . 10.0 111.233 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . 0.429 ' HA ' ' OE1' ' A' ' 391' ' ' GLU . 22.6 p -72.23 -31.45 65.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.112 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -73.39 -33.89 65.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.904 0.383 . . . . 10.0 110.087 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 83.4 mt -60.2 -28.35 67.9 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.331 0.586 . . . . 10.0 109.913 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . 0.429 ' OE1' ' HA ' ' A' ' 388' ' ' SER . 39.0 mt-10 -65.78 -40.19 91.73 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.365 -0.834 . . . . 10.0 109.688 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . 0.548 ' HA ' ' HE3' ' A' ' 395' ' ' LYS . 0.7 OUTLIER -62.37 -47.4 84.34 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 120.86 0.362 . . . . 10.0 110.43 179.413 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -58.1 -46.32 85.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.465 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 10.5 m -65.21 -41.85 94.08 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.224 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . 0.548 ' HE3' ' HA ' ' A' ' 392' ' ' GLU . 50.5 mtmt . . . . . 0 C--O 1.234 0.237 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.631 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 82.1 mt . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 120.712 0.291 . . . . 10.0 110.24 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 81.5 mt -66.04 -42.81 89.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.699 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -46.46 85.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.453 0.644 . . . . 10.0 109.857 179.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . 0.447 ' O ' HG23 ' C' ' 408' ' ' VAL . 11.0 t-20 -62.92 -48.19 80.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.969 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 16.4 t90 -58.08 -37.74 75.05 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.104 -0.498 . . . . 10.0 112.173 -179.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -60.47 -41.39 94.09 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.071 0.462 . . . . 10.0 110.378 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 6.1 m -73.69 -19.93 60.68 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.595 -0.729 . . . . 10.0 110.623 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . 0.447 HG23 ' O ' ' C' ' 404' ' ' ASN . 54.6 t -74.19 -34.12 36.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.262 -0.644 . . . . 10.0 109.262 178.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.83 -39.37 83.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.188 178.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -44.46 84.3 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.176 -0.465 . . . . 10.0 109.949 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . 0.658 HG22 ' HG2' ' A' ' 363' ' ' LYS . 2.2 p -66.49 -32.45 73.82 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.168 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.37 -39.32 92.13 Favored 'General case' 0 CA--C 1.521 -0.172 0 N-CA-C 108.494 -0.928 . . . . 10.0 108.494 177.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . 0.437 ' C ' ' H ' ' C' ' 415' ' ' LEU . 73.5 m -64.9 -38.13 89.93 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 177.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -72.97 10.42 0.91 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.801 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . 0.437 ' H ' ' C ' ' C' ' 413' ' ' SER . 69.3 mt -124.78 -48.74 1.77 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.335 -0.987 . . . . 10.0 108.335 178.009 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -65.9 -49.69 67.14 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.231 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -69.14 -22.7 63.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.272 0.558 . . . . 10.0 109.883 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.93 -36.77 30.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.61 -0.723 . . . . 10.0 109.654 179.386 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 22.9 mt -60.69 -29.61 69.42 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.96 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -51.48 -73.85 0.34 Allowed Glycine 0 CA--C 1.519 0.332 0 C-N-CA 121.272 -0.49 . . . . 10.0 112.145 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.91 -36.06 98.85 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.629 2.219 . . . . 10.0 111.738 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 38.8 t -60.61 -49.8 82.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.795 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 23.9 p -70.89 -36.28 72.68 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.405 0.145 . . . . 10.0 110.728 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -55.94 -50.14 71.56 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.785 -0.821 . . . . 10.0 108.785 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . 0.717 ' HB3' ' HZ2' ' A' ' 352' ' ' LYS . 63.0 mt-10 -69.0 -40.76 78.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.18 -0.918 . . . . 10.0 109.93 178.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -58.54 -44.09 89.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.096 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . 0.483 ' O ' ' HG3' ' C' ' 431' ' ' GLU . 62.9 m95 -64.81 -38.93 92.63 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 178.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -63.53 -41.49 98.47 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.756 -0.831 . . . . 10.0 108.756 178.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . 0.675 ' HA ' ' HD2' ' C' ' 432' ' ' LYS . 23.6 t-20 -64.82 -43.66 92.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.337 -0.847 . . . . 10.0 109.463 178.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 33.4 mt -60.22 -35.06 74.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.052 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' C' ' 427' ' ' TRP . 51.2 mt-10 -65.94 -45.3 82.34 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 178.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . 0.675 ' HD2' ' HA ' ' C' ' 429' ' ' ASN . 32.0 mttt -57.35 -46.33 83.44 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 108.57 -0.9 . . . . 10.0 108.57 178.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . 0.496 ' OE2' ' HD3' ' A' ' 345' ' ' ARG . 5.9 mm-40 -60.11 -49.06 79.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.025 -0.988 . . . . 10.0 110.652 179.046 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 27.0 m -61.36 -44.75 96.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.438 -0.346 . . . . 10.0 111.002 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -64.79 -40.8 95.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.909 0.385 . . . . 10.0 110.215 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.94 -47.36 83.56 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.045 -1.222 . . . . 10.0 110.045 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 71.0 mt -60.71 -33.0 72.23 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -64.65 -48.79 73.53 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -62.99 -37.68 88.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.183 0.516 . . . . 10.0 110.08 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . 0.648 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 48.3 mt-10 -67.66 -55.75 12.04 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.685 -0.688 . . . . 10.0 110.38 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 71.6 mtm -68.13 -28.37 67.26 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 114.555 1.317 . . . . 10.0 114.555 -177.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.8 p -62.48 -43.6 98.41 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.013 -0.675 . . . . 10.0 109.642 179.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -78.22 -42.28 31.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.165 178.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . 0.466 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 2.9 t70 -57.62 -58.1 9.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.206 -0.906 . . . . 10.0 111.448 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . 0.433 ' O ' ' HG3' ' C' ' 449' ' ' LYS . 93.0 mt -64.39 -41.58 96.59 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.077 0.399 . . . . 10.0 112.077 -178.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -62.57 -48.17 80.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.027 0.441 . . . . 10.0 110.021 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -68.61 -25.17 64.73 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 179.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . 0.432 ' HB ' ' HA ' ' C' ' 445' ' ' LEU . 1.1 t -64.75 -42.84 96.08 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 N-CA-C 108.842 -0.799 . . . . 10.0 108.842 177.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' C' ' 445' ' ' LEU . 88.4 mttt -65.91 -34.53 78.33 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.225 -0.657 . . . . 10.0 109.225 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -81.0 0.21 36.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.4 -0.818 . . . . 10.0 111.265 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . 0.487 ' C ' ' HD2' ' C' ' 454' ' ' PRO . 56.7 mttm -117.47 -37.66 3.46 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.625 179.019 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 25.2 t -62.76 -41.41 92.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.28 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . 0.6 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 41.0 mt-30 -57.93 -58.52 18.01 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 116.665 -0.243 . . . . 10.0 110.701 178.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . 0.6 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 52.9 Cg_exo -60.32 -36.44 87.5 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 122.199 1.932 . . . . 10.0 110.931 178.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -60.9 -49.38 77.71 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.876 179.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 53.8 mt -70.54 -37.78 74.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.985 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -63.66 -47.61 80.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.096 0.474 . . . . 10.0 109.97 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . 0.75 ' HA ' ' HE3' ' C' ' 461' ' ' LYS . 28.5 t0 -68.73 -32.91 73.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.688 179.102 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -66.13 -42.75 88.69 Favored 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 108.446 -0.946 . . . . 10.0 108.446 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -62.74 -46.17 89.3 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.039 -0.726 . . . . 10.0 109.039 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . 0.75 ' HE3' ' HA ' ' C' ' 458' ' ' ASP . 12.9 mtmt -57.13 -42.42 80.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.604 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 13.7 mtmm -72.57 -40.55 66.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.358 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -22.3 65.01 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.882 179.401 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . 0.507 ' OE1' ' HA ' ' C' ' 461' ' ' LYS . 64.3 mt-30 -69.92 -44.2 70.12 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 107.949 -1.13 . . . . 10.0 107.949 177.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 1.262 ' O ' ' CG ' ' C' ' 469' ' ' LEU . 26.0 mt-10 -68.72 -32.07 71.59 Favored 'General case' 0 C--O 1.226 -0.165 0 N-CA-C 108.895 -0.78 . . . . 10.0 108.895 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -69.78 -55.27 10.31 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.564 -0.743 . . . . 10.0 109.989 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 45.1 tpp -61.26 -56.95 14.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.628 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -63.63 -40.69 97.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.642 0.258 . . . . 10.0 110.478 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 1.262 ' CG ' ' O ' ' C' ' 465' ' ' GLU . 96.4 mt -59.04 -47.4 85.35 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 115.836 -0.62 . . . . 20.0 110.438 179.087 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -68.02 -34.58 76.76 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.493 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -65.89 -43.61 87.78 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.21 -0.663 . . . . 10.0 109.21 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -69.24 -8.77 48.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.076 179.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . 0.812 ' HG2' HD13 ' A' ' 301' ' ' LEU . 92.5 mttt -101.99 -51.76 3.33 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.048 178.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 69.3 t -67.16 -39.87 84.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.599 -0.728 . . . . 10.0 112.876 -178.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -54.4 -58.88 11.92 Favored Pre-proline 0 N--CA 1.464 0.264 0 C-N-CA 120.916 -0.314 . . . . 10.0 111.693 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -68.64 -28.01 31.67 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 121.378 1.385 . . . . 10.0 110.555 178.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . 1.034 ' HG ' ' HE2' ' A' ' 297' ' ' LYS . 0.6 OUTLIER -65.76 -40.83 92.46 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.631 -0.507 . . . . 10.0 109.631 179.372 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . 0.644 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 17.7 ttm180 -62.95 -34.67 77.99 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.02 -0.733 . . . . 10.0 109.02 179.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -70.12 -49.55 49.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.004 -0.543 . . . . 10.0 109.948 178.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . 0.536 ' CD ' ' HZ3' ' A' ' 297' ' ' LYS . 23.8 mt-10 -62.83 -46.49 87.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.235 179.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 31.9 mt -66.08 -32.68 74.28 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.951 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . 0.644 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 4.2 tt0 -68.59 -41.46 79.59 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -70.43 -38.36 74.55 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 178.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -67.12 -32.89 81.63 Favored Glycine 0 N--CA 1.442 -0.909 0 N-CA-C 109.757 -1.337 . . . . 10.0 109.757 177.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . 0.59 ' HA ' ' HG2' ' C' ' 488' ' ' LYS . . . -73.09 -43.47 61.74 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 178.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 64.5 mtt180 -63.28 -38.65 91.99 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.847 -0.797 . . . . 10.0 108.847 178.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -50.41 64.24 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.49 177.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . 0.59 ' HG2' ' HA ' ' C' ' 485' ' ' ALA . 52.8 pttt -62.83 -32.7 73.96 Favored 'General case' 0 C--O 1.225 -0.193 0 O-C-N 123.292 0.37 . . . . 10.0 110.252 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 30.9 mt -69.56 -38.39 77.42 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -68.12 -41.97 80.91 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.204 -1.036 . . . . 10.0 108.204 177.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . 0.448 ' O ' ' HG3' ' C' ' 495' ' ' LYS . 36.6 mt-10 -61.27 -47.17 87.24 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.134 -0.939 . . . . 10.0 108.63 178.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 43.1 mt -65.79 -40.56 92.07 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.918 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -60.4 -45.5 93.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.013 0.435 . . . . 10.0 110.467 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -80.25 10.9 3.94 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.882 -179.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.641 ' HG2' HD22 ' A' ' 279' ' ' LEU . 12.5 mttm -120.13 -46.06 2.43 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.525 -0.761 . . . . 10.0 108.979 177.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 94.1 mt -69.67 -34.82 74.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.701 -0.681 . . . . 10.0 111.719 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 13.3 m -65.3 -58.25 12.75 Favored Pre-proline 0 CA--C 1.537 0.467 0 C-N-CA 120.682 -0.407 . . . . 10.0 111.297 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.56 -47.44 11.49 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 121.727 1.618 . . . . 10.0 111.588 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . 0.404 ' HA ' ' HB2' ' C' ' 502' ' ' GLU . 73.3 mt -66.63 -31.51 72.23 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-O 120.679 0.276 . . . . 10.0 111.213 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.29 -48.77 61.68 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 110.038 -1.225 . . . . 10.0 110.038 178.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -65.92 -39.88 90.94 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.244 -0.65 . . . . 10.0 109.244 178.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . 0.416 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 10.8 mt-10 -60.31 -52.79 63.77 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.602 178.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . 0.658 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 42.8 mmm -57.95 -36.45 72.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.679 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 74.4 mtt180 -66.46 -43.48 85.39 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.898 -0.408 . . . . 10.0 109.898 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . 0.589 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 0.9 OUTLIER -66.73 -41.16 88.31 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 178.687 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.658 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 41.1 mtt180 -62.01 -42.98 99.74 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 178.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -63.79 -36.45 83.92 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.409 -0.814 . . . . 10.0 110.114 178.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . 0.589 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 67.5 mtt180 -62.58 -42.59 99.65 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.878 -0.786 . . . . 10.0 108.878 178.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -86.5 19.52 2.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.962 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -131.15 -53.43 1.04 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.996 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 86.5 t -68.12 -47.61 77.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.164 -0.471 . . . . 10.0 109.999 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.44 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 0.5 OUTLIER -66.23 -33.44 75.76 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 108.874 -0.788 . . . . 10.0 108.874 178.895 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -64.86 -50.07 68.06 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 107.671 -1.233 . . . . 10.0 107.671 177.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 21.2 mt -59.26 -35.52 73.85 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.736 178.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . 0.44 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 89.3 mtt180 -59.34 -53.75 54.6 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.779 -0.823 . . . . 10.0 108.779 177.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.59 14.56 0.99 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.608 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . 0.478 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 4.6 m-70 -126.43 -38.03 2.14 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 122.136 -0.353 . . . . 10.0 110.363 179.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 84.6 mt -87.69 -33.97 18.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.56 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -58.28 -57.88 22.99 Favored Pre-proline 0 C--N 1.33 -0.272 0 C-N-CA 121.174 -0.211 . . . . 10.0 111.499 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.61 -36.52 63.75 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 121.444 1.429 . . . . 10.0 110.613 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . 0.478 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 22.1 t80 -61.46 -46.46 89.95 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.895 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . 0.424 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 6.3 p -67.6 -31.1 70.9 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.969 -0.382 . . . . 10.0 109.969 179.225 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -67.76 -41.92 82.58 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.884 -0.784 . . . . 10.0 108.884 178.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . 0.431 ' O ' ' HG3' ' C' ' 528' ' ' ARG . 4.3 mt-10 -67.12 -37.8 84.49 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 177.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . 0.472 HD23 ' HD2' ' C' ' 528' ' ' ARG . 21.3 mt -62.58 -32.26 73.22 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.401 -0.818 . . . . 10.0 109.809 178.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . 0.424 ' HG3' ' O ' ' C' ' 522' ' ' SER . 71.4 mtt180 -65.74 -37.99 87.89 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.386 -0.598 . . . . 10.0 109.386 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -68.64 -43.59 75.98 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.593 -0.891 . . . . 10.0 108.593 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . 0.472 ' HD2' HD23 ' C' ' 525' ' ' LEU . 80.8 mtt180 -61.54 -43.95 97.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.808 -1.087 . . . . 10.0 109.466 178.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 30.2 mt -65.16 -35.99 82.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.719 -0.673 . . . . 10.0 109.793 178.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.86 -46.65 86.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.095 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.66 -44.65 77.35 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.53 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 10.2 mtt180 -62.14 -46.0 90.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.672 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 47.9 mt -67.52 -32.69 73.66 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.505 -0.316 . . . . 10.0 110.537 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -64.68 -44.62 89.77 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.224 -0.658 . . . . 10.0 109.224 178.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.59 -41.53 96.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.428 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 83.9 mt -65.49 -28.97 69.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.67 178.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -77.57 -43.89 30.29 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.86 -0.422 . . . . 10.0 109.86 178.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -62.33 -48.58 79.19 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.714 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -71.21 -35.3 71.48 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 115.479 -0.782 . . . . 10.0 109.458 178.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . 0.41 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -60.27 -45.98 95.11 Favored Glycine 0 N--CA 1.445 -0.737 0 N-CA-C 111.279 -0.728 . . . . 10.0 111.279 178.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.85 99.69 Favored Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 111.048 -0.821 . . . . 10.0 111.048 179.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.81 -45.26 82.98 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' C' ' 543' ' ' ARG . 53.4 mtt180 -61.5 -39.7 91.9 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.715 179.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 75.4 mt -60.1 -42.26 94.29 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 178.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -68.51 -45.36 72.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.754 -0.657 . . . . 10.0 109.323 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.03 -51.88 67.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.522 -0.763 . . . . 10.0 110.208 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -60.45 -38.8 85.31 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.162 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -67.66 -41.72 83.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.054 0.454 . . . . 10.0 110.703 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.62 -50.54 64.66 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' C' ' 554' ' ' HIS . 0.0 OUTLIER -63.01 -32.96 74.44 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.885 179.567 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.21 -43.15 92.45 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.647 -0.501 . . . . 10.0 109.647 178.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 25.3 m -63.52 -45.0 92.62 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.489 -0.56 . . . . 10.0 109.489 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -64.41 -39.62 94.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.46 178.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . 0.456 ' HB2' ' O ' ' C' ' 550' ' ' LYS . 16.5 t-80 -64.3 -41.55 96.79 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.616 -0.72 . . . . 10.0 110.124 178.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 79.7 mt -68.6 -38.23 80.44 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.483 -0.326 . . . . 10.0 110.429 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 19.3 m -66.91 -39.05 87.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.396 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 3.2 p -73.95 -25.37 59.91 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.36 179.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' C' ' 554' ' ' HIS . 32.8 mt -75.84 -41.27 52.99 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 108.738 -0.838 . . . . 10.0 108.738 177.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . 0.58 ' HA ' ' HB3' ' C' ' 562' ' ' ALA . 47.0 m -61.53 -25.95 67.62 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.526 -0.761 . . . . 10.0 110.819 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -61.29 -21.94 64.4 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.839 -0.619 . . . . 10.0 110.51 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -117.43 -21.72 8.52 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.886 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . 0.58 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -66.42 -21.72 66.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.87 179.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . 0.936 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 86.7 mttt -109.89 -67.59 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.596 178.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . 0.936 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 31.2 Cg_exo -61.25 -54.56 1.7 Allowed 'Trans proline' 0 C--N 1.357 0.982 0 C-N-CA 122.164 1.91 . . . . 10.0 113.098 -179.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . 0.422 ' O ' ' HG ' ' C' ' 569' ' ' LEU . . . -63.04 -44.64 95.32 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.925 -0.31 . . . . 10.0 111.685 -179.274 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . 0.451 HD23 ' HA ' ' C' ' 566' ' ' LEU . 4.1 mt -60.63 -40.94 93.81 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-O 120.756 0.312 . . . . 10.0 110.356 178.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . 0.712 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 20.0 mm-40 -64.79 -37.62 88.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.306 178.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.29 -39.96 78.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.942 178.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' C' ' 565' ' ' ALA . 78.2 mt -61.6 -44.7 96.52 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.25 -0.648 . . . . 10.0 109.25 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -65.0 -38.6 91.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.514 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . 0.712 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.3 mt-30 -70.05 -18.24 63.28 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.745 -0.661 . . . . 20.0 112.584 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -94.2 -35.55 5.99 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 108.961 -1.656 . . . . 10.0 108.961 178.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . 0.632 ' HA ' HG12 ' C' ' 576' ' ' VAL . 63.5 mt -67.51 -40.92 85.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.366 -0.417 . . . . 10.0 111.82 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 94.5 mt -53.79 -60.75 6.48 Favored Pre-proline 0 CA--C 1.534 0.364 0 N-CA-C 112.418 0.525 . . . . 10.0 112.418 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -66.34 -36.41 27.64 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 121.744 1.629 . . . . 10.0 112.401 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . 0.632 HG12 ' HA ' ' C' ' 573' ' ' LEU . 1.9 p -67.3 -37.43 79.05 Favored 'Isoleucine or valine' 0 C--N 1.34 0.165 0 C-N-CA 120.434 -0.506 . . . . 10.0 111.411 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . 0.489 ' O ' ' HG3' ' C' ' 581' ' ' LYS . 6.2 mt -63.31 -41.14 98.92 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.178 -0.675 . . . . 10.0 109.178 178.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . 0.473 ' O ' HG23 ' C' ' 582' ' ' VAL . 43.0 mt-10 -64.5 -45.45 87.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.515 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 3.9 p -67.28 -31.15 71.28 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 121.165 0.507 . . . . 10.0 110.14 178.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.06 -35.98 74.65 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.764 -0.828 . . . . 10.0 108.764 178.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' C' ' 577' ' ' LEU . 87.8 mttt -63.97 -37.92 89.19 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.383 178.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . 0.473 HG23 ' O ' ' C' ' 578' ' ' GLU . 58.4 t -62.59 -43.26 98.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 N-CA-C 108.895 -0.78 . . . . 10.0 108.895 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 8.6 m -66.07 -40.01 90.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.407 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -69.36 -48.61 60.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.109 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . 0.484 ' O ' ' HG3' ' C' ' 589' ' ' GLU . 76.9 mt -57.63 -47.79 81.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.626 -0.261 . . . . 10.0 110.706 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 25.9 p -61.45 -42.39 98.68 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -62.31 -44.0 97.53 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.235 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 91.5 mt -57.63 -44.98 85.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.471 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . 0.525 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 45.5 mt-10 -67.08 -53.14 33.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.977 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -58.09 -47.03 84.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.208 -0.451 . . . . 10.0 112.075 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -63.03 -43.68 98.05 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.355 0.502 . . . . 10.0 112.355 -179.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 10.2 p -65.11 -29.28 70.13 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.807 -0.357 . . . . 10.0 111.427 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . 0.525 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 89.6 mttt -68.67 -22.45 64.38 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.082 0.467 . . . . 10.0 110.371 178.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.06 -4.65 31.93 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.491 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 86.2 mt -95.68 -40.98 9.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.395 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 . . . . . 0 C--O 1.252 1.224 0 CA-C-O 118.411 -0.804 . . . . 10.0 110.468 -179.865 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 5.5 t . . . . . 0 N--CA 1.453 -0.319 0 CA-C-O 120.904 0.383 . . . . 10.0 110.602 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -86.97 118.96 26.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.236 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -108.58 120.02 41.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.021 0.438 . . . . 10.0 111.811 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 2.8 mtmt -109.59 116.2 31.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.53 179.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.539 HD22 HD23 ' B' ' 159' ' ' LEU . 45.3 mt -110.73 117.98 34.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.44 -0.345 . . . . 10.0 111.197 -178.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 47.6 t -104.69 118.19 51.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.026 0.441 . . . . 10.0 110.686 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 23.4 t -92.21 116.64 33.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 17.2 m -108.47 170.09 2.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.909 0.385 . . . . 10.0 111.256 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 150.39 170.95 18.2 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.901 -0.666 . . . . 10.0 111.581 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.454 ' O ' HG22 ' B' ' 14' ' ' VAL . . . -87.9 -174.24 4.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.878 0.371 . . . . 10.0 111.371 -179.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.38 141.58 21.43 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.004 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 108.6 -21.52 28.01 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.647 -0.787 . . . . 10.0 112.18 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . 0.51 HG23 ' HG3' ' B' ' 16' ' ' LYS . 21.9 m -80.04 162.4 3.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 120.938 0.399 . . . . 10.0 110.854 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -90.2 52.14 3.47 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.809 -0.71 . . . . 10.0 113.451 -179.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . 0.51 ' HG3' HG23 ' B' ' 14' ' ' VAL . 42.1 mtmt -60.73 -58.71 7.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.12 0.486 . . . . 10.0 110.34 179.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -65.93 -32.04 73.32 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.266 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.02 -50.21 69.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.908 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 86.0 mt -59.54 -42.27 91.94 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 121.03 0.443 . . . . 10.0 110.076 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . 0.478 ' O ' HG12 ' B' ' 24' ' ' ILE . 14.4 m -61.37 -53.68 53.54 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.569 -0.741 . . . . 10.0 111.423 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 96.3 mt -61.43 -32.69 54.04 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-O 120.759 0.314 . . . . 10.0 111.115 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.67 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 7.4 tp-100 -67.09 -27.84 67.69 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.142 0.496 . . . . 10.0 110.62 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 23.6 tp -88.58 -33.32 17.73 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.827 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . 0.478 HG12 ' O ' ' B' ' 20' ' ' THR . 42.5 mm -81.1 -69.48 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.935 -179.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -84.17 -14.19 50.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.77 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.67 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 53.6 m-80 68.18 29.09 6.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.588 0.709 . . . . 10.0 109.129 -178.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 74.9 t60 -124.97 144.64 50.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.987 -1.006 . . . . 10.0 110.165 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -103.09 131.71 49.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.657 0.265 . . . . 10.0 110.899 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 4.3 m -91.84 125.76 44.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.144 178.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.35 -11.25 26.07 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.281 0.562 . . . . 10.0 110.689 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -87.5 146.13 25.95 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.877 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -88.5 64.83 7.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.963 0.411 . . . . 10.0 110.224 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.14 140.0 76.39 Favored Pre-proline 0 C--O 1.237 0.432 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.065 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -71.57 -179.51 3.77 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 122.777 2.318 . . . . 10.0 113.007 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . 0.424 HG22 ' HA ' ' B' ' 59' ' ' ALA . 1.0 OUTLIER -166.9 136.0 2.85 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.846 179.745 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.784 HD11 HG21 ' D' ' 809' ' ' THR . 3.5 mt -117.21 -66.3 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.523 ' O ' HG23 ' D' ' 821' ' ' VAL . 2.8 tm-20 -147.79 94.92 2.42 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 179.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . 0.457 ' O ' HD12 ' B' ' 56' ' ' LEU . 25.1 m-20 -118.89 150.21 40.25 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.094 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.19 141.02 46.9 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.883 -0.327 . . . . 10.0 111.397 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . 0.673 ' CE2' HG22 ' D' ' 840' ' ' VAL . 30.1 m-85 -124.29 147.26 48.25 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.53 -0.304 . . . . 10.0 111.811 -178.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . 0.661 ' NH1' ' HB2' ' D' ' 817' ' ' LYS . 0.0 OUTLIER -125.11 136.44 53.64 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 112.891 0.7 . . . . 10.0 112.891 -178.856 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . 0.47 ' HD2' HD13 ' B' ' 24' ' ' ILE . 28.8 tttm -158.72 157.89 32.62 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.226 -0.897 . . . . 10.0 109.626 178.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -133.86 123.31 24.53 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.142 -0.318 . . . . 10.0 110.142 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 10.0 m -138.36 165.65 24.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.847 0.356 . . . . 10.0 111.101 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.729 HG22 ' HB ' ' B' ' 50' ' ' THR . 16.0 t -90.32 97.06 6.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.667 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . 0.575 HD11 HD11 ' B' ' 53' ' ' LEU . 46.1 mt -86.45 120.13 35.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.674 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 51.7 m-20 68.53 -67.26 0.21 Allowed 'General case' 0 N--CA 1.465 0.293 0 O-C-N 123.766 0.667 . . . . 10.0 111.291 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . -155.12 -12.25 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 121.039 -0.6 . . . . 10.0 112.871 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -121.81 132.99 54.9 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 117.145 0.472 . . . . 10.0 111.769 -179.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.729 ' HB ' HG22 ' B' ' 45' ' ' VAL . 9.9 t -79.83 130.76 35.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.993 -0.548 . . . . 10.0 110.605 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -142.45 150.79 41.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.888 0.375 . . . . 10.0 111.602 -179.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 26.6 tp -79.86 129.29 34.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.158 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.575 HD11 HD11 ' B' ' 46' ' ' ILE . 82.6 mt -111.99 123.03 49.38 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.939 -179.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -103.04 103.16 13.23 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.027 -1.101 . . . . 10.0 108.027 177.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.475 HD12 HD11 ' B' ' 24' ' ' ILE . 26.9 mt -92.94 138.86 19.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.959 -0.564 . . . . 10.0 111.502 -177.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.457 HD12 ' O ' ' B' ' 38' ' ' ASP . 37.2 tp -114.01 121.14 42.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.882 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.436 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 6.5 t70 -98.72 96.22 7.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.433 -0.803 . . . . 10.0 108.888 179.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 47.5 p -80.64 163.52 23.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.721 -0.672 . . . . 10.0 112.689 -178.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . 0.424 ' HA ' HG22 ' B' ' 35' ' ' THR . . . -66.73 158.37 30.39 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.734 -0.666 . . . . 10.0 111.102 179.402 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -83.62 -53.58 3.35 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.8 -0.714 . . . . 10.0 111.776 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -113.31 135.51 53.77 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.054 -0.35 . . . . 20.0 110.054 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -158.66 -178.26 7.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.687 0.279 . . . . 10.0 110.843 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -113.94 -91.77 0.5 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.153 0.501 . . . . 10.0 109.968 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -159.85 78.99 0.7 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.652 -0.704 . . . . 10.0 109.915 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 48.6 m -91.46 130.86 37.24 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.586 -0.734 . . . . 10.0 111.056 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.36 -34.5 73.96 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 121.245 0.545 . . . . 10.0 109.834 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 83.9 mmm -62.7 -40.29 96.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.412 -0.813 . . . . 10.0 109.81 178.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.65 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 0.4 OUTLIER -66.18 -44.97 82.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.437 179.793 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -58.4 -32.24 68.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.811 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -61.67 -58.36 8.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.998 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . 0.65 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 21.0 p90 -70.61 -11.95 61.26 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 113.146 0.795 . . . . 10.0 113.146 -178.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 66.3 mmm -75.6 -16.52 60.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.27 -0.423 . . . . 10.0 109.992 178.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . 0.718 ' HG2' ' HB ' ' B' ' 103' ' ' VAL . 20.0 mtt180 -95.18 -17.5 21.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.44 . . . . 10.0 111.245 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -87.18 13.33 9.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.319 -0.4 . . . . 10.0 111.68 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -104.73 138.25 14.06 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.61 -0.805 . . . . 10.0 111.656 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -91.38 -37.4 13.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.268 0.556 . . . . 10.0 110.74 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -132.09 143.55 15.14 Favored Glycine 0 N--CA 1.444 -0.782 0 N-CA-C 110.82 -0.912 . . . . 10.0 110.82 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -124.62 123.35 39.86 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.242 0.544 . . . . 10.0 112.111 -178.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.627 ' HG ' HD22 ' B' ' 159' ' ' LEU . 97.5 mt -92.18 115.77 28.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.602 -0.726 . . . . 10.0 109.666 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . 0.426 ' HB3' HD12 ' B' ' 93' ' ' ILE . 9.8 m -86.37 85.59 7.33 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.783 -0.451 . . . . 10.0 109.783 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 39.6 t -82.93 119.36 32.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.005 -0.543 . . . . 10.0 112.099 -178.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.795 ' HB3' HD11 ' B' ' 93' ' ' ILE . 19.3 p90 -133.81 135.34 43.75 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.047 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -79.07 128.46 33.3 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.652 -0.249 . . . . 10.0 110.437 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . 0.678 HD11 ' HA ' ' B' ' 118' ' ' CYS . 34.0 pt -70.89 -13.26 16.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.815 0.34 . . . . 10.0 111.899 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . 0.51 ' OD1' ' HD2' ' B' ' 117' ' ' LYS . 3.7 p-10 -94.17 -2.76 52.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.05 0.453 . . . . 10.0 110.023 179.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -126.25 102.51 7.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.034 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.29 -37.39 69.81 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.094 -0.503 . . . . 10.0 112.331 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 23.5 tptp -57.87 -34.94 70.3 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 111.928 0.344 . . . . 10.0 111.928 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 62.1 m -66.56 -35.63 80.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.652 -0.249 . . . . 10.0 111.015 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -68.22 -39.18 82.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.246 0.546 . . . . 10.0 109.971 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -73.55 -34.42 65.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.922 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.84 -14.02 62.62 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.959 -0.564 . . . . 10.0 111.965 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . 0.795 HD11 ' HB3' ' B' ' 82' ' ' PHE . 32.9 mm -58.6 -42.48 84.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.903 0.382 . . . . 10.0 110.322 179.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -66.7 -32.49 73.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.252 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -66.98 -38.14 85.51 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.193 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -80.41 -32.27 37.51 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.123 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -56.96 -48.03 79.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.766 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -65.78 -35.74 81.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.224 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -62.05 -44.55 96.45 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.476 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 53.0 mt -66.86 -39.21 83.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.277 0.561 . . . . 10.0 110.337 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . 0.672 ' HE3' ' HG2' ' B' ' 107' ' ' GLU . 45.2 mtpt -68.54 -20.95 64.58 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.465 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 1.6 ttp-105 -84.48 -38.94 19.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.607 -0.27 . . . . 10.0 111.589 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.718 ' HB ' ' HG2' ' B' ' 73' ' ' ARG . 34.7 m -71.79 -26.02 25.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 112.391 0.515 . . . . 10.0 112.391 -179.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.444 ' HG2' HG23 ' B' ' 103' ' ' VAL . 66.5 mmtt -107.27 -9.6 16.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.447 179.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 5.8 t70 54.06 38.15 28.4 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.514 -0.766 . . . . 10.0 112.351 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 22.7 t -156.49 156.66 34.1 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.421 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . 0.672 ' HG2' ' HE3' ' B' ' 101' ' ' LYS . 24.9 mt-10 -95.42 -17.17 21.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.051 -0.522 . . . . 10.0 109.647 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . 0.43 ' OD1' ' HE2' ' B' ' 169' ' ' LYS . 12.8 t70 -85.71 74.78 10.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.352 -0.84 . . . . 10.0 110.298 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 44.4 t -129.37 132.82 24.52 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.795 -0.639 . . . . 10.0 109.903 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -64.04 103.3 0.41 Allowed 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.935 2.424 . . . . 10.0 112.241 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . 0.402 ' HB2' HG21 ' B' ' 139' ' ' ILE . 38.3 mtt -126.29 153.27 45.03 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.305 -0.628 . . . . 10.0 109.305 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . 0.458 ' HB ' HD23 ' B' ' 79' ' ' LEU . 96.9 t -135.5 130.56 50.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 18.2 tp -80.75 114.42 19.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.496 -0.927 . . . . 10.0 108.496 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 19.4 t -111.66 110.83 33.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.073 0.463 . . . . 10.0 112.185 -177.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -82.75 136.19 15.0 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 109.011 -1.635 . . . . 10.0 109.011 177.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -121.55 153.52 37.89 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 117.557 0.679 . . . . 10.0 112.366 -178.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . 0.51 ' HD2' ' OD1' ' B' ' 85' ' ' ASN . 90.4 mttt 69.65 44.19 0.91 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.256 -0.884 . . . . 10.0 112.615 178.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . 0.678 ' HA ' HD11 ' B' ' 84' ' ' ILE . 18.7 p -79.58 -4.12 50.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.376 0.608 . . . . 10.0 110.172 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -93.39 1.31 56.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.342 -0.845 . . . . 10.0 110.19 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . 0.412 HD12 ' HB3' ' B' ' 117' ' ' LYS . 40.5 mt -99.92 141.5 22.88 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.172 -0.467 . . . . 10.0 109.741 178.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -81.19 7.99 4.63 Favored 'Trans proline' 0 CA--C 1.529 0.25 0 C-N-CA 122.701 2.267 . . . . 10.0 112.284 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.49 35.43 1.64 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.943 0.402 . . . . 10.0 111.042 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 4.7 ttt180 -60.92 105.28 0.45 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.136 0.493 . . . . 10.0 112.296 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.1 m -94.56 -41.62 9.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.902 -0.59 . . . . 10.0 109.617 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 38.3 t -93.93 111.24 24.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.695 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.16 158.08 36.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.055 0.455 . . . . 10.0 111.272 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . 0.503 ' O ' ' HG3' ' B' ' 131' ' ' GLN . 0.2 OUTLIER -56.93 -40.11 75.74 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.768 -0.651 . . . . 10.0 112.381 -179.373 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 19.8 tptt -59.85 -46.41 89.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.497 0.189 . . . . 10.0 111.239 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . 0.433 HE21 ' HB3' ' B' ' 129' ' ' GLN . 15.9 mt-30 -55.67 -43.12 76.05 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.205 0.526 . . . . 10.0 110.438 178.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.48 -44.32 83.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.545 -0.752 . . . . 10.0 111.539 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.503 ' HG3' ' O ' ' B' ' 127' ' ' THR . 22.4 mt-30 -64.61 -35.13 79.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.802 0.334 . . . . 10.0 110.992 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -61.05 -49.72 76.23 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.74 -0.663 . . . . 10.0 110.656 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 13.7 tp -67.24 -42.2 84.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.766 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.23 74.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.673 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 21.5 tpt180 -60.3 -38.24 83.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.354 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 38.2 m -70.79 -24.57 62.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.655 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -93.72 -7.97 42.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.019 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 72.25 26.78 71.32 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.825 -0.625 . . . . 10.0 111.697 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . 0.402 HG21 ' HB2' ' B' ' 111' ' ' MET . 47.7 pt -122.83 149.76 57.11 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.668 0.27 . . . . 10.0 110.672 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -77.34 151.81 29.94 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.629 2.219 . . . . 10.0 111.602 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -111.78 126.83 55.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.367 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 41.3 mm -126.22 126.18 68.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.061 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . 0.537 ' HG2' ' HB3' ' B' ' 118' ' ' CYS . 4.0 tt0 -90.46 125.3 35.53 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . 0.638 ' HA ' ' O ' ' B' ' 150' ' ' GLN . 74.0 p -132.29 160.26 36.73 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.662 0.986 . . . . 10.0 113.662 -177.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -155.36 123.68 5.9 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.224 -1.353 . . . . 10.0 107.98 178.096 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -74.28 -30.39 62.08 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.344 0.498 . . . . 10.0 112.344 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 33.1 tttp -64.93 -45.92 83.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.485 -0.325 . . . . 10.0 111.458 -179.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.75 -0.93 36.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.956 -179.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' B' ' 149' ' ' ARG . 16.9 ttt85 57.28 47.49 16.71 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.426 0.631 . . . . 10.0 110.924 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . 0.638 ' O ' ' HA ' ' B' ' 144' ' ' THR . 33.8 tp60 -83.53 106.52 15.33 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.054 -179.297 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 59.05 22.13 54.6 Favored Glycine 0 CA--C 1.52 0.377 0 N-CA-C 114.742 0.657 . . . . 10.0 114.742 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 60.9 t -64.69 -48.28 85.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 117.273 0.536 . . . . 10.0 110.23 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -64.49 -46.36 83.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.186 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -63.61 -31.23 72.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.57 -0.741 . . . . 10.0 112.525 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.68 -44.12 85.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.069 0.462 . . . . 10.0 110.444 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -72.02 -37.31 69.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.55 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -64.47 -40.44 95.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.969 0.414 . . . . 10.0 110.782 179.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 46.9 m -61.54 -40.56 95.14 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.004 179.055 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.627 HD22 ' HG ' ' B' ' 79' ' ' LEU . 30.9 tp -62.17 -45.57 92.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.396 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . 0.485 HG21 HD13 ' B' ' 46' ' ' ILE . 89.7 t -60.21 -41.97 88.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.308 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 67.6 mtm-85 -62.66 -37.92 88.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.108 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -67.71 -39.09 84.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.914 0.388 . . . . 10.0 110.284 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . 0.534 HG22 ' HE2' ' B' ' 167' ' ' LYS . 71.7 mt -66.75 -39.57 83.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 178.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -61.99 -42.74 99.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.183 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 21.9 mtmm -67.68 -32.68 73.51 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.123 179.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 -61.99 -45.61 92.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.355 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . 0.534 ' HE2' HG22 ' B' ' 163' ' ' ILE . 59.1 mttm -63.8 -36.14 82.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.479 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -63.24 -41.83 99.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.781 -0.645 . . . . 10.0 109.397 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . 0.43 ' HE2' ' OD1' ' B' ' 108' ' ' ASP . 56.7 tttp -68.34 -39.71 81.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.965 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 97.2 mtp -65.15 -20.81 66.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.969 0.414 . . . . 10.0 111.524 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 13.5 m . . . . . 0 C--N 1.325 -0.488 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.735 179.795 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.248 0 N-CA-C 112.031 -0.427 . . . . 10.0 112.031 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' D' D ' 809' ' ' THR . . . . . 0.784 HG21 HD11 ' B' ' 36' ' ' ILE . 9.6 p -136.97 146.73 45.74 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.707 0.289 . . . . 10.0 110.958 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 810' ' ' VAL . . . . . 0.424 HG23 HG22 ' D' ' 824' ' ' VAL . 92.5 t -106.74 133.15 52.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.283 -0.417 . . . . 10.0 109.888 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 811' ' ' LYS . . . . . 0.417 ' HB2' ' HG3' ' D' ' 874' ' ' GLU . 7.2 mtmp? -85.98 106.87 17.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.285 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 46.9 t -95.84 124.21 48.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.334 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -101.56 130.93 47.96 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.969 -0.382 . . . . 10.0 109.969 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 45.2 mt -103.42 155.98 36.08 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.555 -178.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 815' ' ' PRO . . . . . 0.499 ' HB3' ' HA ' ' D' ' 878' ' ' GLU . 74.4 Cg_endo -74.58 53.38 3.13 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 123.424 2.75 . . . . 10.0 112.036 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -152.63 31.86 0.51 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 817' ' ' LYS . . . . . 0.661 ' HB2' ' NH1' ' B' ' 41' ' ' ARG . 88.4 mttt 53.96 32.54 15.56 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 114.675 -1.148 . . . . 10.0 111.439 -179.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 818' ' ' GLN . . . . . 0.409 HE22 ' C ' ' B' ' 40' ' ' TYR . 73.5 mt-30 -136.99 -179.2 5.56 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 114.13 1.159 . . . . 10.0 114.13 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.02 171.44 15.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.16 -0.927 . . . . 10.0 112.178 -178.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 45.2 m -155.01 131.52 10.51 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.623 -1.251 . . . . 10.0 107.623 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 821' ' ' VAL . . . . . 0.684 HG12 ' HB ' ' D' ' 809' ' ' THR . 4.0 t -97.28 113.26 31.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 120.562 -0.455 . . . . 10.0 111.081 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 26.1 t -105.61 137.82 33.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.883 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 823' ' ' THR . . . . . 0.743 ' HA ' HG22 ' D' ' 809' ' ' THR . 1.2 m -72.95 144.62 47.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.766 179.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 824' ' ' VAL . . . . . 0.424 HG22 HG23 ' D' ' 810' ' ' VAL . 45.2 t -76.19 119.47 24.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.552 -0.295 . . . . 10.0 110.403 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -114.08 130.42 56.57 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.917 0.389 . . . . 10.0 111.063 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -75.28 129.86 38.13 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.979 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 82.88 2.2 90.65 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.971 -0.558 . . . . 10.0 112.582 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 7.1 ttt -89.44 126.97 35.78 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 122.726 -0.279 . . . . 10.0 110.39 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 829' ' ' SER . . . . . 0.644 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 1.0 OUTLIER -82.11 150.68 27.36 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.391 -0.226 . . . . 10.0 110.391 179.592 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 92.9 t -54.05 -38.85 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 O-C-N 123.228 0.33 . . . . 10.0 110.885 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 831' ' ' TYR . . . . . 0.614 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 80.8 t80 -57.13 -31.05 64.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.319 -0.4 . . . . 10.0 111.396 179.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -82.98 -45.67 13.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.509 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.33 -42.68 78.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.031 0.443 . . . . 10.0 111.352 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 834' ' ' LEU . . . . . 0.482 HD13 ' HB3' ' D' ' 837' ' ' ALA . 1.3 mm? -80.28 -8.57 59.53 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.855 -179.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 835' ' ' ASP . . . . . 0.608 ' O ' ' HG2' ' D' ' 839' ' ' LYS . 29.7 t70 -61.45 -61.19 2.71 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 110.051 -0.352 . . . . 10.0 110.051 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 39.3 mttt -62.77 -29.81 70.98 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.885 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 837' ' ' ALA . . . . . 0.482 ' HB3' HD13 ' D' ' 834' ' ' LEU . . . -69.05 -25.77 64.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.942 0.401 . . . . 10.0 110.762 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 838' ' ' LEU . . . . . 0.579 HD12 ' HG3' ' D' ' 845' ' ' GLN . 40.0 mt -93.07 -44.3 8.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.149 179.307 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 839' ' ' LYS . . . . . 0.608 ' HG2' ' O ' ' D' ' 835' ' ' ASP . 10.5 mmtt -61.27 -23.63 65.81 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.668 179.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 840' ' ' VAL . . . . . 0.673 HG22 ' CE2' ' B' ' 40' ' ' TYR . 1.4 p -49.66 -20.88 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 N-CA-C 112.916 0.71 . . . . 10.0 112.916 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 841' ' ' ARG . . . . . 0.43 ' HG3' ' HG ' ' D' ' 843' ' ' LEU . 13.9 ptp180 -140.59 23.17 2.31 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.368 0.604 . . . . 10.0 111.721 177.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 75.59 28.41 61.4 Favored Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 115.601 -0.727 . . . . 10.0 114.654 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 843' ' ' LEU . . . . . 0.43 ' HG ' ' HG3' ' D' ' 841' ' ' ARG . 96.6 mt -92.4 154.26 18.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 117.598 0.699 . . . . 10.0 110.215 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -121.68 143.28 49.44 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.815 0.341 . . . . 10.0 111.602 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 845' ' ' GLN . . . . . 0.579 ' HG3' HD12 ' D' ' 838' ' ' LEU . 21.5 mp0 -60.64 -28.69 68.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.813 -0.63 . . . . 10.0 111.822 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -76.81 -4.34 43.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.468 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 2.2 t -131.95 18.16 4.61 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 120.966 0.412 . . . . 10.0 110.972 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 79.6 m -142.65 153.29 43.3 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.485 -0.325 . . . . 10.0 110.472 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 14.6 p -130.6 141.81 45.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.42 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 850' ' ' VAL . . . . . 0.449 HG21 ' HG ' ' D' ' 834' ' ' LEU . 26.0 t -109.75 122.96 65.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.351 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 851' ' ' TYR . . . . . 0.602 ' HE1' HG22 ' D' ' 860' ' ' VAL . 48.9 m-85 -103.8 142.85 33.66 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.953 179.662 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 42.3 mmm-85 -82.89 164.78 20.27 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.333 -0.849 . . . . 10.0 109.819 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 853' ' ' LEU . . . . . 0.566 HD13 HD11 ' D' ' 876' ' ' ILE . 16.2 tp -124.52 62.07 1.13 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.469 0.652 . . . . 10.0 110.551 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 44.3 mt -84.4 102.25 10.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.28 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp 61.44 17.07 8.07 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.431 -0.804 . . . . 10.0 112.194 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 105.05 -18.32 42.99 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.94 -0.648 . . . . 10.0 112.412 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -81.35 138.45 35.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.968 0.413 . . . . 10.0 110.897 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 858' ' ' LYS . . . . . 0.447 ' HE3' ' CD1' ' D' ' 876' ' ' ILE . 12.5 mptt -88.34 122.36 31.77 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.466 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 3.7 m -122.53 136.1 54.8 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.037 -0.529 . . . . 10.0 109.787 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 860' ' ' VAL . . . . . 0.602 HG22 ' HE1' ' D' ' 851' ' ' TYR . 6.4 t -75.74 123.91 32.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 110.391 -0.225 . . . . 10.0 110.391 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 3.2 t -104.6 160.7 14.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.544 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -99.1 149.63 22.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.569 -0.287 . . . . 10.0 110.914 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 863' ' ' TRP . . . . . 0.614 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 99.4 m95 -70.55 -27.42 64.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.924 -179.142 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.16 1.61 39.63 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.532 0.567 . . . . 10.0 112.532 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 23.5 m -84.98 148.2 26.32 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 179.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 866' ' ' ALA . . . . . 0.644 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -82.48 150.33 27.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.026 0.441 . . . . 10.0 111.622 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 867' ' ' ILE . . . . . 0.475 HD12 HD13 ' D' ' 870' ' ' LEU . 8.8 tp -84.7 -10.32 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.845 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 868' ' ' ALA . . . . . 0.618 ' HB3' ' HD3' ' D' ' 869' ' ' PRO . . . -58.11 -55.6 43.64 Favored Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 113.024 0.75 . . . . 10.0 113.024 -179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 869' ' ' PRO . . . . . 0.618 ' HD3' ' HB3' ' D' ' 868' ' ' ALA . 3.4 Cg_exo -77.81 13.21 1.74 Allowed 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 122.345 2.03 . . . . 10.0 112.161 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 870' ' ' LEU . . . . . 0.475 HD13 HD12 ' D' ' 867' ' ' ILE . 0.2 OUTLIER -103.83 -8.0 20.1 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.094 -0.503 . . . . 10.0 109.983 179.785 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -58.01 127.28 31.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.78 -0.646 . . . . 10.0 111.285 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 121.85 -16.43 8.87 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.479 -0.867 . . . . 10.0 113.402 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -126.95 -170.58 2.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.11 0.455 . . . . 10.0 112.115 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 874' ' ' GLU . . . . . 0.417 ' HG3' ' HB2' ' D' ' 811' ' ' LYS . 4.4 mp0 -113.26 170.24 8.37 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.991 -0.549 . . . . 10.0 110.784 -178.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 36.8 mt -130.83 129.74 42.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.671 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 876' ' ' ILE . . . . . 0.566 HD11 HD13 ' D' ' 853' ' ' LEU . 17.5 mt -114.38 112.73 41.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.312 -179.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 877' ' ' VAL . . . . . 0.516 HG11 HD21 ' D' ' 838' ' ' LEU . 24.4 t -97.74 137.08 26.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 120.728 0.299 . . . . 10.0 110.615 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 878' ' ' GLU . . . . . 0.499 ' HA ' ' HB3' ' D' ' 815' ' ' PRO . 0.0 OUTLIER -140.55 171.05 14.66 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.091 -0.504 . . . . 10.0 109.909 179.233 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 5.8 m -105.11 149.15 8.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.076 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 92.3 mt . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.739 -0.648 . . . . 10.0 111.495 -179.197 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . 0.5 ' HA ' ' HB2' ' A' ' 242' ' ' GLU . 94.3 mt . . . . . 0 C--O 1.223 -0.319 0 CA-C-O 120.527 0.204 . . . . 10.0 111.167 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 49.2 mtt180 -66.18 -41.13 90.7 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.484 -0.562 . . . . 10.0 109.484 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -78.52 -25.01 45.46 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.259 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . 0.5 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 8.1 mt-10 -76.68 -62.62 1.57 Allowed 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.473 -0.785 . . . . 10.0 110.199 178.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . 0.593 ' HA ' ' HB3' ' A' ' 246' ' ' ASP . 93.1 mmm -56.79 -30.56 63.8 Favored 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 113.25 0.833 . . . . 10.0 113.25 -178.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 3.1 p -63.38 -50.97 67.82 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.404 -0.518 . . . . 10.0 109.761 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -74.98 -33.1 61.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.044 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . 0.593 ' HB3' ' HA ' ' A' ' 243' ' ' MET . 11.6 t70 -59.74 -59.38 5.53 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.125 178.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.25 -35.42 78.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.878 -0.601 . . . . 10.0 111.114 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -61.89 -45.82 92.09 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 120.67 0.271 . . . . 10.0 110.585 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -72.19 -38.36 69.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.05 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . 0.645 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 41.3 t -61.81 -39.33 83.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.92 -0.4 . . . . 10.0 109.92 178.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -75.29 -46.61 32.4 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.869 0.366 . . . . 10.0 110.769 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.33 74.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.526 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -90.2 -20.08 23.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.327 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.645 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -62.23 -29.9 47.67 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.206 0 N-CA-C 109.997 -0.371 . . . . 10.0 109.997 179.317 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -64.2 3.36 Favored Pre-proline 0 C--O 1.219 -0.513 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.147 178.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -59.87 -31.76 94.29 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 121.73 1.62 . . . . 10.0 111.548 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -61.21 -57.7 11.35 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.008 0.432 . . . . 10.0 109.895 178.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 96.3 mt -73.1 -38.56 66.3 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.822 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -58.42 -49.18 78.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.761 0.315 . . . . 10.0 110.448 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.48 -45.53 92.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.839 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . 0.403 ' HD1' ' HA ' ' A' ' 261' ' ' PHE . 6.1 m-85 -63.72 -37.56 87.83 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 116.059 -0.518 . . . . 10.0 111.106 179.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -69.6 -39.94 76.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.682 0.277 . . . . 10.0 110.266 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 48.7 mttp -64.27 -42.88 96.24 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 177.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.479 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 14.1 mptt -65.05 -44.5 88.8 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 178.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 6.7 t90 -60.6 -36.62 79.01 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.685 -0.689 . . . . 10.0 110.24 179.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -61.99 -49.89 74.27 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.733 -0.84 . . . . 10.0 108.733 178.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -59.85 -43.79 94.45 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.753 -0.658 . . . . 10.0 109.344 178.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . 0.479 ' HG3' ' O ' ' A' ' 264' ' ' LYS . 27.4 mt-10 -61.09 -47.24 87.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.596 -0.729 . . . . 10.0 111.258 179.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 95.6 mmm -71.43 -43.66 66.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.811 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -61.61 -48.16 82.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.903 0.382 . . . . 10.0 110.248 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 69.4 mt -67.23 -23.59 65.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.5 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . 0.455 ' O ' HG23 ' A' ' 276' ' ' VAL . 0.1 OUTLIER -74.75 -51.51 13.98 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 177.971 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 45.0 mtt85 -60.4 -41.28 93.54 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.668 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.05 -20.54 58.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.611 -0.722 . . . . 10.0 111.063 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.666 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 47.5 mttp -103.19 -41.09 6.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.643 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . 0.568 ' O ' ' HB2' ' A' ' 280' ' ' ARG . 38.5 t -47.11 -43.18 7.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 112.432 0.531 . . . . 10.0 112.432 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 63.9 mt-10 -64.3 -63.78 3.45 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 112.755 0.65 . . . . 10.0 112.755 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.37 -36.15 88.27 Favored 'Trans proline' 0 C--N 1.357 0.982 0 C-N-CA 121.807 1.671 . . . . 10.0 111.998 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.681 HD22 ' HE2' ' C' ' 495' ' ' LYS . 23.1 mt -67.63 -31.57 71.68 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 110.005 -0.368 . . . . 10.0 110.005 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . 0.568 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 5.9 mtt180 -72.89 -35.85 67.19 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -58.96 -46.66 87.5 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.5 -0.555 . . . . 10.0 109.5 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -65.0 -40.63 95.23 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 178.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -43.41 97.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.42 -0.809 . . . . 10.0 109.696 179.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 280' ' ' ARG . 28.8 mt-30 -69.6 -44.93 69.74 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.536 179.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -60.79 -49.73 76.3 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 110.177 -0.305 . . . . 10.0 110.177 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -59.47 -42.43 97.58 Favored Glycine 0 N--CA 1.443 -0.843 0 N-CA-C 110.863 -0.895 . . . . 10.0 110.863 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -66.1 -44.58 83.94 Favored 'General case' 0 C--O 1.223 -0.334 0 O-C-N 123.539 0.199 . . . . 10.0 110.814 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 37.1 mtt180 -58.89 -46.74 87.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.906 0.384 . . . . 10.0 110.194 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -61.72 -47.55 84.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.525 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . 0.518 ' HE3' ' HA2' ' C' ' 484' ' ' GLY . 0.1 OUTLIER -59.97 -44.06 94.71 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.266 179.306 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . 0.478 ' O ' ' HG3' ' A' ' 295' ' ' GLN . 77.0 mt -60.25 -40.23 89.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.275 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -64.62 -47.68 77.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.015 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -64.52 -31.0 72.03 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.072 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 39.6 mt -72.2 -40.97 67.48 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.881 -0.6 . . . . 10.0 109.575 178.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . 0.478 ' HG3' ' O ' ' A' ' 291' ' ' LEU . 21.6 mt-30 -60.55 -36.18 77.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.234 0.54 . . . . 10.0 109.666 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -72.4 3.77 4.44 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.667 179.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . 0.6 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 45.2 mttp -126.24 -24.69 3.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.567 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 82.6 mt -76.54 -33.08 58.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.631 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . 0.778 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 4.5 m -89.66 -61.6 0.22 Allowed Pre-proline 0 CA--C 1.538 0.513 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.815 179.128 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . 0.778 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 52.7 Cg_exo -59.05 -63.86 0.12 Allowed 'Trans proline' 0 C--N 1.357 0.986 0 C-N-CA 122.4 2.067 . . . . 10.0 112.244 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.6 ' HB2' ' O ' ' A' ' 297' ' ' LYS . 88.4 mt -63.17 -25.86 68.54 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.414 179.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -68.17 -49.03 49.43 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 110.1 -1.2 . . . . 10.0 110.1 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -63.44 -35.75 81.47 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.912 -0.403 . . . . 10.0 109.912 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -64.3 -45.12 89.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.095 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.7 ttt -67.47 -33.77 75.79 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.094 -0.706 . . . . 10.0 109.094 178.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . 0.471 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 95.3 mtt180 -64.19 -44.2 92.72 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.165 -0.68 . . . . 10.0 109.165 178.038 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . 0.428 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 18.4 t70 -65.58 -42.42 91.78 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.269 179.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . 1.103 ' HG3' HD21 ' C' ' 469' ' ' LEU . 11.4 mmt180 -62.6 -37.57 86.76 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 178.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . 0.533 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -67.22 -35.99 80.76 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 115.844 -0.616 . . . . 10.0 109.713 178.101 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . 0.471 ' HG3' ' O ' ' A' ' 306' ' ' ARG . 54.5 mtt180 -60.92 -50.86 71.71 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.72 -0.844 . . . . 10.0 108.72 178.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.33 -37.51 87.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.741 178.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . 0.681 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 0.3 OUTLIER -57.85 -55.29 36.81 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.202 178.758 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 87.5 t -71.28 -40.04 73.34 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.264 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.608 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . 0.639 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 36.7 t70 -60.57 -47.82 84.5 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.978 -0.289 . . . . 10.0 110.366 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -64.95 -28.32 69.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.358 0.599 . . . . 10.0 109.398 178.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . 0.537 ' HG ' ' HE3' ' C' ' 462' ' ' LYS . 8.9 mt -71.2 -39.88 71.52 Favored 'General case' 0 C--O 1.216 -0.698 0 N-CA-C 108.744 -0.836 . . . . 10.0 108.744 177.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . 0.639 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 81.5 mtt180 -61.45 -43.92 98.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.356 -0.383 . . . . 10.0 110.398 179.524 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -15.66 63.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.847 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -106.17 -39.08 6.07 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.504 -0.317 . . . . 10.0 111.756 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 50.2 mt -60.15 -36.25 77.11 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 122.251 0.22 . . . . 10.0 111.132 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . 0.401 ' HB3' ' CD ' ' A' ' 322' ' ' PRO . . . -60.75 -62.06 6.72 Favored Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.657 179.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . 0.401 ' CD ' ' HB3' ' A' ' 321' ' ' ALA . 15.7 Cg_endo -60.78 -33.83 92.41 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.709 1.606 . . . . 10.0 110.899 178.028 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . 0.473 ' O ' ' HG ' ' A' ' 327' ' ' LEU . 6.7 m-30 -60.33 -49.77 76.26 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 178.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 32.6 m -66.59 -37.77 85.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.172 179.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . 0.525 ' O ' ' HG3' ' A' ' 329' ' ' GLN . 0.8 OUTLIER -65.41 -41.26 93.78 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.919 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . 0.483 ' HB3' ' OE1' ' C' ' 447' ' ' GLU . 56.5 mt-10 -66.0 -37.38 85.79 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.778 -0.823 . . . . 10.0 108.778 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 323' ' ' TYR . 51.4 mt -61.77 -37.08 82.98 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.03 178.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -64.32 -40.79 96.61 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . 0.525 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 14.1 mt-30 -62.16 -42.67 99.48 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 178.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . 0.645 ' O ' ' HG2' ' A' ' 334' ' ' ARG . 59.8 mtt180 -65.48 -50.6 64.74 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 115.512 -0.767 . . . . 10.0 109.671 178.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 331' ' ' LEU . 1.9 mm? -55.87 -40.5 73.02 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.923 -0.581 . . . . 10.0 110.587 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.24 -45.46 94.42 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -64.42 -45.83 85.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.267 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . 0.694 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 7.6 mmt85 -61.35 -46.19 91.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.54 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . 0.435 ' O ' ' HG3' ' A' ' 339' ' ' LYS . 64.5 mt -62.18 -41.99 98.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.962 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -61.08 -42.38 98.4 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 178.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.26 -40.39 86.2 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . 0.584 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 78.2 mt -67.75 -20.72 65.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.125 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 335' ' ' LEU . 71.4 mttt -87.35 -47.68 8.6 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 178.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -67.97 -62.33 1.45 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.958 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -68.76 -39.09 80.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.285 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . 0.584 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -60.5 -43.63 98.61 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.934 -0.65 . . . . 10.0 111.74 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -64.79 -43.36 96.31 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 110.415 -1.074 . . . . 10.0 110.415 178.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -62.93 -40.43 97.6 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.413 -0.588 . . . . 10.0 109.413 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . 0.732 ' HA ' HD21 ' C' ' 429' ' ' ASN . 29.7 ttm180 -60.21 -44.48 95.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.073 -0.967 . . . . 10.0 109.863 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 73.7 mt -64.68 -40.48 95.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.121 179.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -63.31 -45.81 89.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.73 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.02 -42.74 97.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.934 -0.576 . . . . 10.0 109.837 178.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -62.43 -41.67 98.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.114 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -65.37 -41.66 93.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.382 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.89 -48.46 80.37 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.642 -0.503 . . . . 10.0 109.642 178.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . 0.683 ' NZ ' ' HB2' ' C' ' 425' ' ' GLU . 47.6 mttm -62.43 -41.51 98.76 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.494 -0.775 . . . . 10.0 110.295 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . 0.406 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -62.78 -45.76 91.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.196 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 28.8 m -61.38 -45.51 94.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.892 -0.594 . . . . 10.0 110.67 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . 0.519 ' HA ' ' OE1' ' A' ' 355' ' ' GLU . 7.2 mm-40 -71.53 -31.19 66.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.003 0.43 . . . . 10.0 111.366 179.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . 0.427 ' HA ' ' OG1' ' A' ' 359' ' ' THR . 38.5 t-80 -72.39 -25.39 61.48 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 40.9 mt -71.88 -39.84 69.35 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.252 -0.648 . . . . 10.0 109.252 178.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -44.12 88.03 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 178.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . 0.427 ' OG1' ' HA ' ' A' ' 356' ' ' HIS . 1.1 p -70.71 -20.57 62.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.723 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 360' ' ' LEU . 9.3 mt -80.38 -39.24 28.79 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.642 -0.873 . . . . 10.0 108.642 177.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 16.2 m -66.54 -31.78 72.71 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.534 -0.913 . . . . 10.0 108.534 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . 0.51 ' HB3' ' HD3' ' C' ' 414' ' ' LYS . 46.0 mm-40 -75.06 9.01 2.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.086 -0.961 . . . . 10.0 110.782 178.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.58 ' HG2' HG22 ' C' ' 411' ' ' THR . 63.1 mttp -128.33 -46.69 1.33 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.268 -1.012 . . . . 10.0 108.268 178.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -67.61 -7.3 25.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.458 -0.792 . . . . 10.0 112.518 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.488 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 96.4 mttt -106.42 -66.96 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.526 0 C-N-CA 120.95 -0.3 . . . . 10.0 111.806 178.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.488 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 40.1 Cg_endo -66.28 -47.59 3.16 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 121.58 1.52 . . . . 10.0 112.557 -178.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -65.08 -38.98 92.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.506 0.193 . . . . 10.0 111.122 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 1.5 mt -68.47 -39.85 81.24 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.701 -0.4 . . . . 10.0 110.065 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 27.5 mt-10 -68.96 -35.38 76.68 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.557 -0.535 . . . . 10.0 109.557 178.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -47.21 81.82 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.855 -1.165 . . . . 10.0 107.855 177.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 367' ' ' ALA . 65.3 mt -62.28 -41.19 98.27 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.311 -0.859 . . . . 10.0 110.775 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 372' ' ' ARG . 52.4 mtt180 -63.39 -43.34 97.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.114 0.483 . . . . 10.0 110.035 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.5 mt-30 -68.13 -21.06 64.95 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.439 -0.8 . . . . 20.0 111.869 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -93.24 -37.35 5.66 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.821 -0.912 . . . . 10.0 110.821 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 18.5 mt -59.52 -37.52 78.55 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.306 0.484 . . . . 10.0 112.306 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . 0.447 ' HB2' ' CD ' ' A' ' 377' ' ' PRO . 81.8 mt -58.85 -62.33 5.97 Favored Pre-proline 0 CA--C 1.535 0.378 0 N-CA-C 111.734 0.272 . . . . 10.0 111.734 179.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . 0.447 ' CD ' ' HB2' ' A' ' 376' ' ' LEU . 29.6 Cg_endo -63.68 -35.17 59.75 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.012 1.808 . . . . 10.0 112.044 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 15.6 t -64.46 -47.25 90.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-O 120.645 0.26 . . . . 10.0 110.581 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 18.3 mt -63.92 -32.3 73.78 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.655 -0.498 . . . . 10.0 109.655 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -69.87 -46.96 64.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.429 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.1 p -62.49 -36.85 83.82 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.187 -0.672 . . . . 10.0 109.187 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -68.47 -45.85 71.33 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.339 -0.846 . . . . 10.0 109.845 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 25.3 mtmt -60.17 -45.44 93.09 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.991 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 70.8 t -59.7 -44.63 94.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 109.752 -0.462 . . . . 10.0 109.752 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 27.9 m -65.93 -40.55 91.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.493 178.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . 0.443 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 7.4 m-30 -65.23 -48.0 74.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.764 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 75.1 mt -58.77 -48.67 80.43 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.256 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . 0.406 ' HB2' ' NZ ' ' C' ' 594' ' ' LYS . 18.3 p -66.44 -25.52 66.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.519 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -82.0 -42.07 19.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.41 179.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 84.5 mt -58.48 -41.37 85.14 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.41 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -64.45 -36.36 83.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.245 178.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.79 -43.28 84.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.039 0.447 . . . . 10.0 110.954 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -56.84 -52.43 65.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.761 -0.654 . . . . 10.0 111.009 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -69.32 -22.47 63.77 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.838 0.352 . . . . 10.0 111.234 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt . . . . . 0 C--N 1.325 -0.47 0 CA-C-N 116.324 -0.398 . . . . 10.0 111.069 -179.943 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 6.8 mp . . . . . 0 N--CA 1.453 -0.286 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . 0.44 HD23 ' H ' ' C' ' 402' ' ' LEU . 0.3 OUTLIER -65.43 -37.34 86.63 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.392 -0.822 . . . . 10.0 110.386 179.617 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.4 -38.6 74.69 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -68.22 -36.34 79.35 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.118 -0.697 . . . . 10.0 109.118 178.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 68.9 t90 -66.49 -36.7 83.38 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.419 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -60.68 -46.39 90.53 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.939 -0.573 . . . . 10.0 109.96 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -32.81 74.69 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.129 0.49 . . . . 10.0 109.979 179.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 36.0 t -67.9 -37.61 78.7 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.089 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 177.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 21.8 m -68.52 -42.13 78.93 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.684 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.98 -43.36 88.03 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.897 -0.321 . . . . 10.0 110.538 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . 0.58 HG22 ' HG2' ' A' ' 363' ' ' LYS . 7.4 p -65.7 -38.14 88.4 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.409 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.58 -40.1 88.77 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.156 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 30.8 m -62.52 -44.67 95.79 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 178.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . 0.51 ' HD3' ' HB3' ' A' ' 362' ' ' GLU . 89.8 mttt -69.43 -25.29 64.04 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.137 178.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.0 -36.38 67.01 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.998 -1.112 . . . . 10.0 107.998 177.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -72.68 -23.6 60.9 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.235 -0.893 . . . . 10.0 110.191 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . 0.512 ' O ' ' HD2' ' C' ' 421' ' ' PRO . 78.4 mt-10 -64.33 -38.83 92.41 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 107.923 -1.14 . . . . 10.0 107.923 176.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . 0.73 ' O ' ' HB ' ' C' ' 422' ' ' VAL . 1.4 mt-30 -69.36 -30.19 68.14 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 115.103 -0.953 . . . . 10.0 109.057 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 88.5 mt -72.3 -1.74 16.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.633 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -92.82 -93.29 1.47 Allowed Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.748 -0.739 . . . . 10.0 111.483 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . 0.512 ' HD2' ' O ' ' C' ' 417' ' ' GLU . 9.6 Cg_endo -52.94 -46.03 36.73 Favored 'Trans proline' 0 N--CA 1.473 0.3 0 C-N-CA 123.321 2.681 . . . . 10.0 113.172 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . 0.73 ' HB ' ' O ' ' C' ' 418' ' ' GLN . 67.6 t -55.08 -42.47 65.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.429 0.157 . . . . 10.0 111.178 -179.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 2.8 m -72.71 -34.42 67.11 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.962 0.411 . . . . 10.0 110.069 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -61.7 -52.84 62.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.946 -0.57 . . . . 10.0 109.782 178.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . 0.683 ' HB2' ' NZ ' ' A' ' 352' ' ' LYS . 0.4 OUTLIER -68.51 -19.38 64.52 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.925 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -70.8 -42.79 69.86 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.292 -1.003 . . . . 10.0 108.292 178.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 18.9 m0 -69.4 -33.71 73.41 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.691 -0.855 . . . . 10.0 108.691 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . 0.478 ' O ' ' HB2' ' C' ' 431' ' ' GLU . 12.6 t70 -67.89 -41.83 82.13 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.772 -0.825 . . . . 10.0 108.772 177.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . 0.732 HD21 ' HA ' ' A' ' 345' ' ' ARG . 16.0 t-20 -63.95 -38.79 92.37 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.572 -0.899 . . . . 10.0 108.572 177.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 30.1 mt -66.6 -27.78 67.98 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.707 -0.678 . . . . 10.0 109.986 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' C' ' 428' ' ' ASP . 18.3 mm-40 -68.18 -38.81 82.44 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 107.705 -1.22 . . . . 10.0 107.705 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -68.57 -41.83 79.18 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.52 -0.919 . . . . 10.0 108.52 177.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 56.3 mm-40 -58.96 -53.76 54.78 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 115.353 -0.84 . . . . 10.0 109.886 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 16.4 p -63.52 -37.05 85.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 10.0 112.073 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -69.59 -45.4 68.72 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -63.95 -48.47 75.7 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.271 -1.132 . . . . 10.0 110.271 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 20.4 mt -62.58 -28.47 69.9 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 109.974 -0.38 . . . . 10.0 109.974 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' C' ' 438' ' ' ARG . 7.6 mtt180 -65.3 -42.88 92.63 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 178.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -65.22 -44.34 88.55 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . 0.694 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 45.5 mt-10 -62.65 -55.17 29.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.434 -0.803 . . . . 10.0 110.375 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 87.0 mmm -59.61 -45.7 91.15 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 112.972 0.73 . . . . 10.0 112.972 -179.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 15.8 p -57.28 -51.18 70.39 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.913 -0.315 . . . . 10.0 111.08 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -65.84 -46.18 79.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.726 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . 0.654 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 0.1 OUTLIER -60.18 -43.57 95.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.214 -179.808 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . 0.467 ' O ' HG12 ' C' ' 448' ' ' VAL . 63.3 mt -70.69 -45.06 65.7 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.673 0.273 . . . . 10.0 111.175 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -59.98 -45.21 93.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.126 0.488 . . . . 10.0 110.345 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . 0.503 ' OE1' ' HE2' ' C' ' 451' ' ' LYS . 4.5 tt0 -74.87 -26.8 59.93 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.454 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . 0.654 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.3 OUTLIER -66.91 -35.0 73.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.769 0.319 . . . . 10.0 110.383 179.488 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -70.47 -34.0 71.91 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.48 -0.933 . . . . 10.0 108.48 177.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -82.2 -1.45 49.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.034 -0.984 . . . . 10.0 109.95 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . 0.503 ' HE2' ' OE1' ' C' ' 447' ' ' GLU . 14.3 mttm -105.5 -44.41 4.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.603 -0.726 . . . . 10.0 109.055 178.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . 0.431 HG23 ' O ' ' C' ' 448' ' ' VAL . 53.6 t -61.07 -34.95 62.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.894 -0.593 . . . . 10.0 110.376 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -56.99 -62.46 5.11 Favored Pre-proline 0 CA--C 1.537 0.469 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.148 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -65.5 -29.25 53.23 Favored 'Trans proline' 0 C--N 1.36 1.164 0 C-N-CA 121.6 1.534 . . . . 10.0 111.08 178.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . 0.403 ' HB2' ' HA ' ' C' ' 452' ' ' VAL . 0.4 OUTLIER -61.32 -56.0 25.34 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 178.67 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 41.9 mt -61.05 -40.86 95.22 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.424 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -59.59 -50.31 74.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.804 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -72.12 -37.29 69.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.776 -178.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -65.17 -47.62 76.34 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -67.11 -32.33 73.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.26 -0.427 . . . . 10.0 109.948 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . 0.409 ' HE3' ' HB2' ' C' ' 461' ' ' LYS . 0.4 OUTLIER -63.15 -52.16 63.57 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.979 -0.748 . . . . 10.0 108.979 178.444 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . 0.537 ' HE3' ' HG ' ' A' ' 316' ' ' LEU . 22.7 mttm -66.34 -34.32 77.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.188 -0.915 . . . . 10.0 110.108 179.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 6.9 m95 -68.64 -32.54 72.46 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.239 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . 0.454 ' O ' ' HG3' ' C' ' 468' ' ' GLU . 13.6 mm-40 -66.85 -44.26 81.48 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 107.875 -1.157 . . . . 10.0 107.875 177.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 0.681 ' HB2' ' HE1' ' A' ' 312' ' ' HIS . 29.6 mt-10 -62.78 -41.79 99.4 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.833 -0.802 . . . . 10.0 108.833 177.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.55 -44.03 95.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.971 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 9.0 mmt -61.26 -44.44 97.24 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.57 -0.53 . . . . 10.0 109.57 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' C' ' 464' ' ' GLN . 50.9 mt-10 -61.89 -52.55 63.64 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.955 -0.757 . . . . 10.0 108.955 178.112 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 1.103 HD21 ' HG3' ' A' ' 308' ' ' ARG . 96.2 mt -54.6 -49.21 70.99 Favored 'General case' 0 C--O 1.225 -0.187 0 CA-C-N 115.62 -0.718 . . . . 20.0 111.474 179.4 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -60.49 -45.7 92.83 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 116.42 -0.355 . . . . 10.0 111.093 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -68.17 -46.16 71.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.608 0.242 . . . . 10.0 111.286 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -69.07 -15.94 63.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.798 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . 0.619 ' O ' ' HB2' ' C' ' 477' ' ' LEU . 65.2 mttt -97.31 -51.96 3.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.154 178.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 24.7 t -59.44 -39.08 78.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.107 -0.497 . . . . 10.0 112.049 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -54.86 -63.77 2.61 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 112.238 0.458 . . . . 10.0 112.238 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -68.86 -27.49 30.9 Favored 'Trans proline' 0 C--N 1.354 0.866 0 C-N-CA 121.823 1.682 . . . . 10.0 111.141 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . 0.619 ' HB2' ' O ' ' C' ' 473' ' ' LYS . 10.4 tp -65.3 -51.5 60.28 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . 0.508 ' HA ' ' HB2' ' C' ' 481' ' ' LEU . 61.0 mtt180 -67.21 -31.61 72.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.607 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -63.85 -45.49 89.27 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.381 -0.6 . . . . 10.0 109.381 178.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.84 -30.46 56.35 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.298 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . 0.508 ' HB2' ' HA ' ' C' ' 478' ' ' ARG . 20.4 mt -69.47 -40.77 76.9 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 109.679 -0.489 . . . . 10.0 109.679 178.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -67.02 -46.07 75.61 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.826 -0.435 . . . . 10.0 109.826 178.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -64.6 -41.46 96.2 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.798 -0.816 . . . . 10.0 108.798 178.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . 0.518 ' HA2' ' HE3' ' A' ' 290' ' ' LYS . . . -64.42 -40.07 97.45 Favored Glycine 0 N--CA 1.443 -0.869 0 N-CA-C 110.88 -0.888 . . . . 10.0 110.88 178.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.39 -38.62 81.49 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 109.465 -0.569 . . . . 10.0 109.465 178.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -63.41 -43.71 96.71 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 108.797 -0.816 . . . . 10.0 108.797 178.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -65.04 -41.66 95.0 Favored 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 109.203 -0.666 . . . . 10.0 109.203 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . 0.479 ' HD2' ' HA ' ' C' ' 488' ' ' LYS . 28.4 tptt -65.41 -42.4 92.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.085 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 67.7 mt -65.87 -43.66 87.73 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -61.55 -45.88 92.28 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.497 -0.927 . . . . 10.0 108.497 178.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . 0.76 ' HG2' ' HE3' ' C' ' 495' ' ' LYS . 6.8 tt0 -57.19 -51.96 67.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.875 -1.057 . . . . 10.0 109.03 178.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 78.6 mt -63.93 -42.22 97.42 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.865 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -61.36 -44.28 97.45 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.612 0.244 . . . . 10.0 111.233 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -72.08 -2.05 17.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.009 0.433 . . . . 10.0 111.253 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.76 ' HE3' ' HG2' ' C' ' 491' ' ' GLU . 93.1 mttt -111.31 -47.42 3.19 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.91 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 93.7 mt -64.93 -28.29 69.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.729 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . 0.506 ' O ' ' HG3' ' C' ' 501' ' ' GLU . 46.8 m -68.25 -62.17 3.35 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 120.791 -0.363 . . . . 10.0 110.832 178.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -62.19 -38.42 55.62 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.63 1.554 . . . . 10.0 111.288 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . 0.522 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 13.0 mt -70.58 -32.39 69.76 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.581 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -63.65 -48.18 79.8 Favored Glycine 0 N--CA 1.449 -0.441 0 N-CA-C 110.807 -0.917 . . . . 10.0 110.807 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' C' ' 497' ' ' SER . 27.6 mt-10 -63.05 -39.94 96.24 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 178.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . 0.808 ' HG2' ' HE ' ' C' ' 506' ' ' ARG . 27.4 tt0 -64.61 -45.53 86.51 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.039 179.128 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . 0.663 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 85.2 mmm -60.62 -35.74 76.91 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.624 -0.51 . . . . 10.0 109.624 178.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 55.4 mtt180 -67.66 -41.58 83.56 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -63.13 -42.42 99.51 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.999 -0.741 . . . . 10.0 108.999 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.808 ' HE ' ' HG2' ' C' ' 502' ' ' GLU . 43.5 mtt180 -62.43 -47.32 84.6 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.45 -46.14 89.6 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 115.318 -0.856 . . . . 10.0 110.479 179.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -61.45 -46.03 91.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.784 0.326 . . . . 10.0 110.19 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . 0.452 ' HB1' ' CE ' ' A' ' 264' ' ' LYS . . . -63.96 -36.15 83.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.634 179.421 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -76.0 -45.9 32.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.839 179.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 76.3 t -67.45 -43.38 87.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.619 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.402 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 8.4 t70 -64.56 -35.84 82.29 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.025 -0.732 . . . . 10.0 109.025 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.62 -44.39 86.66 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 107.316 -1.365 . . . . 10.0 107.316 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 50.9 mt -59.8 -35.42 74.64 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.24 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . 0.402 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 67.6 mtt180 -62.02 -49.35 76.36 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.638 -0.504 . . . . 10.0 109.638 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 4.7 p -81.81 6.15 16.48 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.899 -0.591 . . . . 10.0 111.865 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . 0.504 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 49.2 m170 -116.96 -45.86 2.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.857 0.36 . . . . 10.0 110.954 179.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 97.8 mt -76.04 -38.23 57.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.481 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -58.47 -58.66 17.41 Favored Pre-proline 0 CA--C 1.533 0.315 0 N-CA-C 111.658 0.244 . . . . 10.0 111.658 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.55 -37.5 58.08 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 121.518 1.479 . . . . 10.0 111.094 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . 0.504 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 16.4 t80 -60.58 -47.54 85.76 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.802 0.334 . . . . 10.0 110.28 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 34.9 m -69.4 -32.35 71.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.066 -0.515 . . . . 10.0 109.94 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . 0.675 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 22.6 t70 -67.31 -41.65 85.0 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.288 -0.634 . . . . 10.0 109.288 178.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -63.74 -38.82 92.52 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 107.971 -1.122 . . . . 10.0 107.971 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' C' ' 521' ' ' TYR . 79.7 mt -65.15 -31.64 72.93 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 115.142 -0.935 . . . . 10.0 110.061 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . 0.675 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 66.3 mtt180 -63.39 -34.24 77.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.169 0.509 . . . . 10.0 109.706 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -80.04 -48.0 13.99 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.023 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 50.8 mtt180 -64.84 -50.86 64.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.738 -0.665 . . . . 10.0 111.835 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 70.5 mt -60.62 -33.03 72.16 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.329 -0.249 . . . . 10.0 110.329 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -66.55 -39.58 88.61 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.944 -0.761 . . . . 10.0 108.944 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.27 -41.39 81.11 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 109.216 -0.661 . . . . 10.0 109.216 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -60.89 -43.99 97.73 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.33 -0.85 . . . . 10.0 108.8 178.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 60.0 mt -67.97 -34.62 76.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.679 -0.692 . . . . 10.0 110.078 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.41 -42.63 99.58 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.179 -0.675 . . . . 10.0 109.179 178.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -66.92 -43.6 82.86 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.176 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 88.5 mt -66.02 -24.8 66.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.758 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -80.18 -42.85 22.61 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.78 -0.452 . . . . 10.0 109.78 178.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -67.68 -47.76 68.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.366 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -74.22 -35.87 63.9 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.426 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -63.94 -46.59 91.12 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.423 -1.071 . . . . 10.0 110.423 178.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.62 -41.96 99.75 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 110.5 -1.04 . . . . 10.0 110.5 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . 0.469 ' O ' ' HG3' ' C' ' 546' ' ' GLU . . . -62.73 -53.07 59.99 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' C' ' 543' ' ' ARG . 54.3 mtt85 -52.99 -46.81 68.49 Favored 'General case' 0 C--O 1.221 -0.427 0 O-C-N 123.781 0.676 . . . . 10.0 110.784 179.135 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . 0.648 ' O ' ' HB2' ' C' ' 548' ' ' HIS . 54.6 mt -59.34 -42.77 92.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.462 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -71.86 -42.85 66.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.756 0.312 . . . . 10.0 110.842 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . 0.577 ' O ' ' HD2' ' C' ' 550' ' ' LYS . 52.0 mt-10 -66.81 -52.72 40.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.633 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . 0.839 ' HA ' ' HB2' ' C' ' 550' ' ' LYS . 21.2 m-30 -65.45 -20.25 66.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.643 0.259 . . . . 10.0 111.174 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . 0.648 ' HB2' ' O ' ' C' ' 544' ' ' LEU . 2.8 t-80 -68.33 -39.4 81.96 Favored 'General case' 0 CA--C 1.519 -0.25 0 N-CA-C 107.619 -1.252 . . . . 10.0 107.619 177.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . 0.574 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -78.13 -32.74 50.53 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.15 -0.932 . . . . 10.0 108.768 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . 0.839 ' HB2' ' HA ' ' C' ' 547' ' ' TYR . 0.2 OUTLIER -64.11 -33.89 76.81 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.441 -0.8 . . . . 10.0 109.492 178.448 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.83 -45.51 89.26 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.443 -0.798 . . . . 10.0 109.103 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -33.76 76.48 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.262 179.135 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . 0.574 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 89.0 mt-10 -60.8 -37.28 81.41 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 108.49 -0.929 . . . . 10.0 108.49 178.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -80.14 -36.19 35.56 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.216 -0.902 . . . . 10.0 110.998 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 65.4 mt -63.75 -41.89 97.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.843 0.354 . . . . 10.0 111.072 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 2.7 p -67.43 -39.68 85.47 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.986 0.422 . . . . 10.0 110.342 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 7.5 p -74.21 -24.75 59.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.919 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 20.5 mt -74.89 -33.05 62.0 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.992 -0.744 . . . . 10.0 108.992 177.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 49.2 m -61.95 -26.82 68.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.298 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -65.34 -17.37 64.47 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-O 121.383 0.611 . . . . 10.0 110.26 178.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . 0.408 ' HA ' ' HB3' ' C' ' 565' ' ' ALA . 3.8 mptt -111.15 -35.08 5.99 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.899 179.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -63.96 -22.6 66.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.64 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . 0.964 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 75.9 mttt -114.15 -70.6 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.49 0 CA-C-O 119.313 -0.375 . . . . 10.0 111.951 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . 0.964 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 50.8 Cg_exo -58.43 -51.76 6.8 Favored 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 122.151 1.901 . . . . 10.0 113.2 -179.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . 0.408 ' HB3' ' HA ' ' C' ' 561' ' ' LYS . . . -63.82 -41.5 97.85 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.065 -0.254 . . . . 10.0 111.408 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 1.1 mt -63.88 -38.52 91.39 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.829 -0.348 . . . . 10.0 110.107 178.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . 0.47 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 26.6 mm-40 -66.84 -39.03 87.5 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 178.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.66 -41.16 96.29 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.726 -0.842 . . . . 10.0 108.726 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 51.5 mt -63.15 -42.97 99.54 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.762 178.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -64.9 -43.03 94.2 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.021 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.6 mt-30 -65.36 -20.53 66.43 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.733 -0.667 . . . . 20.0 111.591 179.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -92.86 -38.37 5.5 Favored Glycine 0 CA--C 1.523 0.548 0 N-CA-C 109.397 -1.481 . . . . 10.0 109.397 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 26.4 mt -54.78 -42.71 72.08 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.36 0.504 . . . . 10.0 112.36 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . 0.791 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 96.0 mt -58.99 -62.05 6.6 Favored Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 120.811 -0.356 . . . . 10.0 111.709 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . 0.791 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 53.0 Cg_exo -58.36 -38.64 89.59 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.231 1.954 . . . . 10.0 111.741 178.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 27.3 t -63.31 -46.75 94.73 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-O 120.722 0.296 . . . . 10.0 110.413 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 24.1 mt -64.61 -39.57 93.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.252 -0.277 . . . . 10.0 110.252 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . 0.499 ' O ' HG23 ' C' ' 582' ' ' VAL . 24.2 mt-10 -63.15 -48.95 76.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.33 -0.395 . . . . 10.0 110.631 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 23.1 p -65.79 -39.79 91.31 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.768 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.14 -40.77 96.87 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 116.22 -0.445 . . . . 10.0 109.831 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -61.26 -37.77 84.31 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.515 178.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . 0.499 HG23 ' O ' ' C' ' 578' ' ' GLU . 86.0 t -62.98 -46.21 96.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.21 -0.45 . . . . 10.0 109.874 179.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.17 -34.84 77.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.104 -0.498 . . . . 10.0 111.079 179.288 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -73.62 -44.77 56.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.158 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 15.8 mt -58.41 -47.38 84.1 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.393 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 14.1 p -64.11 -39.89 95.03 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.312 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -62.81 -50.71 69.91 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.998 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 67.9 mt -62.79 -28.64 70.13 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.166 0.432 . . . . 10.0 112.166 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -86.57 -33.15 20.32 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.556 0.576 . . . . 10.0 112.556 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -85.13 -38.7 18.76 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.65 0.611 . . . . 10.0 112.65 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -67.1 -29.24 68.94 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 112.25 0.463 . . . . 10.0 112.25 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.28 -30.21 70.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.848 0.356 . . . . 10.0 110.905 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -63.47 -26.62 68.81 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.928 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . 0.406 ' NZ ' ' HB2' ' A' ' 388' ' ' SER . 0.1 OUTLIER -94.97 -4.59 46.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.594 -179.103 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 82.8 mt -98.5 -15.79 19.44 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.359 -0.382 . . . . 10.0 111.398 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 . . . . . 0 C--O 1.246 0.877 0 CA-C-O 118.412 -0.804 . . . . 10.0 110.229 179.927 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.235 0.301 0 CA-C-O 120.793 0.33 . . . . 10.0 110.468 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -99.65 116.32 31.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.45 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -109.51 119.61 39.96 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.582 -179.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 6.8 mptt -93.86 122.89 36.81 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.617 HD22 HD23 ' B' ' 159' ' ' LEU . 42.4 mt -117.93 124.37 48.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.836 0.351 . . . . 10.0 111.232 -178.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 29.2 t -107.86 114.14 45.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.226 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 26.0 t -91.15 117.09 33.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.36 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 19.1 m -113.68 161.41 12.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.719 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 152.57 172.03 20.65 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 111.321 -0.711 . . . . 10.0 111.321 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.562 ' HB3' HG13 ' B' ' 14' ' ' VAL . . . -66.74 167.05 11.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.189 0.519 . . . . 10.0 112.081 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -67.66 -16.57 67.98 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 115.863 -0.608 . . . . 10.0 113.94 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -115.0 18.72 16.08 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.398 -0.906 . . . . 10.0 113.73 -179.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . 0.562 HG13 ' HB3' ' B' ' 11' ' ' ALA . 35.8 m -80.27 -32.27 13.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 117.691 0.746 . . . . 10.0 112.184 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.69 39.34 2.76 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.782 -0.723 . . . . 10.0 113.129 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -61.14 -47.99 83.67 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.9 p -62.49 -43.28 99.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.517 0.199 . . . . 10.0 111.106 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.01 -47.47 85.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.126 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 35.8 mt -61.82 -44.99 95.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.391 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . 0.425 ' O ' HG12 ' B' ' 24' ' ' ILE . 6.7 m -65.82 -51.4 59.26 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.041 -0.527 . . . . 10.0 112.283 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 50.3 mt -62.48 -30.27 48.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-O 120.932 0.396 . . . . 10.0 110.688 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.55 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 28.4 tp60 -66.28 -25.1 66.71 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.753 179.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 36.2 tp -95.15 -32.97 12.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.066 0.46 . . . . 10.0 110.219 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . 0.425 HG12 ' O ' ' B' ' 20' ' ' THR . 48.8 mm -73.27 -63.48 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.997 -0.547 . . . . 10.0 112.058 -179.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -110.04 -3.6 16.36 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 -178.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.55 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 20.1 m-80 66.57 38.51 4.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.4 0.619 . . . . 10.0 109.703 -178.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 21.2 t60 -123.52 114.21 19.77 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.55 -179.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -85.1 134.82 34.18 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.592 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 m -98.96 115.19 38.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 N-CA-C 109.668 -0.493 . . . . 10.0 109.668 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -85.84 -7.07 58.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.081 -0.508 . . . . 10.0 111.65 -178.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -101.39 161.61 13.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.077 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -85.81 91.7 8.41 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.084 0.469 . . . . 10.0 110.854 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.11 135.16 37.5 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.097 179.097 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.3 172.29 14.38 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.605 2.203 . . . . 10.0 112.364 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . 0.802 HG22 ' HA ' ' B' ' 59' ' ' ALA . 0.9 OUTLIER -165.6 136.13 3.68 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.398 -179.779 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 4.2 mp -130.56 -62.54 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 107.398 -1.334 . . . . 10.0 107.398 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.94 85.36 1.68 Allowed 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.029 -0.987 . . . . 10.0 109.031 178.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -120.86 110.41 16.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.611 -0.722 . . . . 10.0 111.006 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . 0.416 ' HB2' ' NE2' ' D' ' 818' ' ' GLN . 0.0 OUTLIER -100.51 149.1 24.05 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.464 -0.789 . . . . 10.0 112.292 -179.158 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -124.54 176.39 6.55 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.245 -0.888 . . . . 10.0 109.129 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' B' ' 41' ' ' ARG . 40.6 ttm180 -163.09 130.56 3.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.571 0.224 . . . . 10.0 111.268 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -157.49 158.02 34.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.401 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -120.83 128.0 52.44 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 7.9 m -139.53 173.52 10.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.999 0.428 . . . . 10.0 110.96 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 21.9 t -103.43 106.03 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.545 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 58.9 mt -102.99 114.42 42.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.684 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.829 ' HB2' HH22 ' B' ' 164' ' ' ARG . 29.7 m-20 61.32 27.19 16.89 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.947 -0.57 . . . . 10.0 111.571 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.63 -9.25 73.92 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.566 -0.826 . . . . 10.0 113.035 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -105.43 124.33 49.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.858 0.361 . . . . 10.0 110.903 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 12.7 t -80.85 136.91 36.17 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.723 -0.473 . . . . 10.0 109.723 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -154.68 161.0 41.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.727 0.299 . . . . 10.0 111.18 -179.256 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 29.7 tp -96.45 130.15 43.66 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 86.7 mt -109.3 115.86 30.78 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.925 0.393 . . . . 10.0 112.012 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -101.15 97.32 7.87 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.044 -1.095 . . . . 10.0 108.044 178.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 27.5 mt -93.5 129.24 44.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.897 -0.592 . . . . 10.0 112.496 -177.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 48.3 tp -119.26 115.59 24.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.861 -0.608 . . . . 10.0 109.91 178.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -89.59 119.31 29.9 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.793 -0.639 . . . . 10.0 110.293 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 40.2 p -75.74 156.83 34.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.881 -0.6 . . . . 10.0 112.074 -178.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . 0.802 ' HA ' HG22 ' B' ' 35' ' ' THR . . . -57.38 155.17 9.56 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.488 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.52 -53.14 26.22 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.636 -0.792 . . . . 10.0 111.587 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -132.77 128.79 37.59 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.854 -0.424 . . . . 20.0 109.854 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.476 ' HG2' ' H ' ' B' ' 63' ' ' GLU . 2.2 tt0 -140.09 171.41 14.21 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.152 -0.476 . . . . 10.0 109.77 -179.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . 0.476 ' H ' ' HG2' ' B' ' 62' ' ' GLU . 20.5 mt-10 -108.18 -86.54 0.51 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.198 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -164.38 93.29 0.67 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.029 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 31.5 t -118.42 153.56 33.89 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.894 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.93 -28.76 69.75 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.179 0.514 . . . . 10.0 110.188 179.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 11.2 mmm -64.08 -31.59 72.83 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.06 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.559 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 48.8 ttt85 -67.17 -52.47 40.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.397 -0.82 . . . . 10.0 110.572 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -31.77 67.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.602 -0.727 . . . . 10.0 110.099 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -61.71 -57.59 11.36 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.31 -0.859 . . . . 10.0 112.313 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . 0.559 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 4.9 p90 -71.07 -18.71 62.54 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.373 0.879 . . . . 10.0 113.373 -178.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 84.9 mtp -89.39 -5.51 57.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.09 0.472 . . . . 10.0 111.016 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 11.0 ttm105 -89.18 -33.1 17.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.671 -179.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -47.48 62.19 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.837 0.68 . . . . 10.0 112.837 -178.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.49 148.38 45.29 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.678 -0.772 . . . . 10.0 113.897 -178.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -107.52 -45.65 4.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.192 0.52 . . . . 10.0 109.795 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -92.05 133.77 11.91 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.239 -0.744 . . . . 10.0 111.239 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -125.69 132.1 52.47 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.329 0.492 . . . . 10.0 112.329 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.726 ' HG ' HD22 ' B' ' 159' ' ' LEU . 78.0 mt -97.3 114.35 26.1 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.762 179.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . 0.499 ' HB3' HD12 ' B' ' 93' ' ' ILE . 21.1 m -87.31 89.94 8.18 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 21.9 t -91.14 123.48 43.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.78 -0.645 . . . . 10.0 111.417 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.639 ' HB3' HD11 ' B' ' 93' ' ' ILE . 38.5 p90 -132.95 168.73 17.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.822 -0.626 . . . . 10.0 109.668 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -102.8 120.89 41.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 110.022 -0.362 . . . . 10.0 110.022 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . 0.924 HD11 ' HA ' ' B' ' 118' ' ' CYS . 42.2 pt -68.99 -7.75 8.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 112.124 0.416 . . . . 10.0 112.124 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -102.92 7.12 39.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.279 0.562 . . . . 10.0 110.603 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -141.77 100.54 3.77 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.065 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.9 -27.04 64.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.886 -0.597 . . . . 10.0 112.16 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 9.2 tmtm? -58.28 -47.58 83.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.515 -0.311 . . . . 10.0 110.939 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 71.1 p -67.75 -31.0 70.61 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.26 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -67.19 -40.74 86.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.091 0.472 . . . . 10.0 110.142 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -71.88 -29.36 64.27 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.727 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.57 -11.64 61.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.914 -0.584 . . . . 10.0 112.006 -179.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . 0.639 HD11 ' HB3' ' B' ' 82' ' ' PHE . 33.3 mm -59.46 -40.93 83.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.887 0.375 . . . . 10.0 110.086 179.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -64.18 -39.9 94.97 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 108.692 -0.855 . . . . 10.0 108.692 178.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 8.2 t-160 -63.26 -39.33 94.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.227 -0.897 . . . . 10.0 110.132 179.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . 0.401 ' O ' HG13 ' B' ' 100' ' ' ILE . 21.0 m-85 -69.88 -52.22 26.62 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.529 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . 0.573 ' NH1' ' HB3' ' B' ' 137' ' ' TYR . 8.6 ttt180 -54.1 -43.11 70.13 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.629 0.252 . . . . 10.0 111.435 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -65.39 -38.03 88.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.343 -0.389 . . . . 10.0 111.267 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.21 -36.45 77.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.965 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . 0.401 HG13 ' O ' ' B' ' 96' ' ' TYR . 73.8 mt -70.99 -37.86 69.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.344 178.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . 0.876 ' HD2' ' HG3' ' B' ' 107' ' ' GLU . 33.4 ttpt -60.39 -32.17 71.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.663 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 1.2 ttp-105 -68.01 -29.97 69.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.667 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.825 HG23 ' HE2' ' B' ' 104' ' ' LYS . 22.3 m -95.57 -9.35 9.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.541 -0.3 . . . . 10.0 111.536 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.825 ' HE2' HG23 ' B' ' 103' ' ' VAL . 14.0 mmtt -103.96 -18.22 14.68 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.572 -0.286 . . . . 10.0 110.861 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 15.2 t70 75.87 -39.0 0.36 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.644 -0.707 . . . . 10.0 112.527 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 5.0 m -107.73 156.29 19.26 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.726 0.298 . . . . 10.0 111.026 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . 0.876 ' HG3' ' HD2' ' B' ' 101' ' ' LYS . 35.1 mp0 -81.18 -19.66 42.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.944 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -79.16 84.12 5.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.522 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 19.8 t -127.39 132.6 24.41 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.858 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -65.53 99.23 0.36 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.581 2.188 . . . . 10.0 111.322 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . 0.441 ' HB2' HG21 ' B' ' 139' ' ' ILE . 66.9 mtt -121.56 153.79 37.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.592 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . 0.609 ' HB ' HD23 ' B' ' 79' ' ' LEU . 99.1 t -134.62 130.67 53.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 179.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . 0.486 ' HG ' ' HE1' ' B' ' 82' ' ' PHE . 14.6 tp -85.35 114.67 22.59 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.644 -0.502 . . . . 10.0 109.644 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 66.2 t -109.34 112.05 38.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.784 -178.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -93.93 97.82 2.26 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 110.339 -1.104 . . . . 10.0 110.339 178.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . 0.557 ' HA ' ' O ' ' B' ' 144' ' ' THR . 65.3 t30 -87.07 162.67 17.45 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.139 0.422 . . . . 10.0 112.139 -178.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 92.8 mttt 74.15 34.95 0.8 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.207 -0.906 . . . . 10.0 112.455 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . 0.924 ' HA ' HD11 ' B' ' 84' ' ' ILE . 5.4 p -71.74 -7.47 48.29 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.983 0.42 . . . . 10.0 111.457 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -90.33 -5.12 56.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.785 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 68.0 mt -96.52 129.22 33.76 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.267 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.79 1.1 8.47 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 123.191 2.594 . . . . 10.0 112.136 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.35 16.16 5.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.419 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -56.8 122.29 11.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.65 -0.705 . . . . 10.0 111.902 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.71 -22.54 11.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.318 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 38.9 t -98.55 118.18 44.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.56 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . 0.578 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 31.7 t70 -72.12 151.24 43.16 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.263 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 2.0 m -58.59 -42.55 88.31 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.243 0.46 . . . . 10.0 112.243 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -67.13 -34.67 78.09 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.678 0.251 . . . . 10.0 111.678 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . 0.578 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 50.6 mt-30 -61.36 -43.34 99.03 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.232 0.539 . . . . 10.0 109.931 179.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.53 -42.78 64.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.643 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -59.86 -43.97 94.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.053 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -61.25 -43.48 98.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.718 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 31.2 tp -65.04 -40.41 94.76 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.232 -0.44 . . . . 10.0 109.897 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.32 -46.43 88.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.707 -0.678 . . . . 10.0 110.402 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.425 HH11 ' HD3' ' B' ' 135' ' ' ARG . 7.0 tpt180 -64.54 -32.9 74.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.242 -0.436 . . . . 10.0 110.482 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 44.0 m -70.61 -18.31 62.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.593 179.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . 0.573 ' HB3' ' NH1' ' B' ' 97' ' ' ARG . 8.1 m-30 -106.08 1.11 26.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.852 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 66.69 28.93 74.01 Favored Glycine 0 CA--C 1.517 0.199 0 CA-C-N 115.914 -0.584 . . . . 10.0 112.801 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . 0.441 HG21 ' HB2' ' B' ' 111' ' ' MET . 49.4 pt -123.21 153.84 65.02 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.593 0.235 . . . . 10.0 110.874 -179.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -83.29 149.22 13.25 Favored 'Trans proline' 0 C--O 1.235 0.332 0 C-N-CA 122.435 2.09 . . . . 10.0 112.019 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -109.46 128.22 54.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.253 -0.431 . . . . 10.0 110.12 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 24.7 mm -126.48 123.99 64.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.085 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . 0.528 ' HG2' ' HB3' ' B' ' 118' ' ' CYS . 4.3 tt0 -83.01 127.01 33.17 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 107.792 -1.188 . . . . 10.0 107.792 178.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . 0.557 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 11.1 m -133.58 160.6 36.99 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.136 0.493 . . . . 10.0 112.21 -177.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . 0.437 ' HA ' ' OD1' ' B' ' 116' ' ' ASN . 12.7 t -157.58 123.53 4.72 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.025 -0.731 . . . . 10.0 109.025 178.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -76.89 -21.39 54.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.074 0.464 . . . . 10.0 110.065 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -73.06 -48.4 36.32 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.173 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 34.2 p -92.04 -6.21 51.48 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.032 0.444 . . . . 10.0 111.205 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . 0.41 ' HG3' ' CG ' ' B' ' 22' ' ' GLN . 3.4 ttt-85 58.86 38.13 24.64 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.354 -0.839 . . . . 10.0 111.484 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -107.22 136.07 47.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.057 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 76.44 -10.09 18.38 Favored Glycine 0 CA--C 1.518 0.254 0 O-C-N 123.531 0.519 . . . . 10.0 114.332 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 22.5 t -55.52 -54.82 21.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 112.117 0.414 . . . . 10.0 112.117 -178.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.91 -47.7 82.14 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.994 -178.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -62.46 -36.55 82.8 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.255 0.465 . . . . 10.0 112.255 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -59.42 -47.19 86.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.935 0.398 . . . . 10.0 110.48 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -68.81 -42.55 77.13 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.644 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 17.2 m-30 -61.67 -43.69 98.37 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.658 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.523 ' O ' ' HG2' ' B' ' 162' ' ' GLU . 97.0 m -59.11 -40.45 85.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.26 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.726 HD22 ' HG ' ' B' ' 79' ' ' LEU . 30.1 tp -57.5 -44.69 85.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.289 0.566 . . . . 10.0 109.56 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 44.5 t -65.73 -38.23 81.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.179 179.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . 0.516 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 76.6 mtt180 -63.04 -35.68 81.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.843 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' B' ' 158' ' ' THR . 10.3 mm-40 -69.83 -41.4 75.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.05 0.452 . . . . 10.0 110.004 179.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . 0.541 ' O ' ' HG2' ' B' ' 167' ' ' LYS . 85.1 mt -62.85 -43.64 99.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.31 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . 0.829 HH22 ' HB2' ' B' ' 47' ' ' ASP . 0.2 OUTLIER -55.34 -48.44 74.21 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.707 179.327 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 29.1 mtmm -64.77 -37.58 88.1 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.238 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -61.25 -43.05 99.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.845 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . 0.541 ' HG2' ' O ' ' B' ' 163' ' ' ILE . 72.3 mmtt -65.97 -46.6 77.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.39 179.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.63 -47.82 83.68 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.384 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -62.9 -34.92 78.45 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.014 0.376 . . . . 10.0 112.014 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 15.1 mmt -71.74 -34.92 69.92 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.901 0.381 . . . . 10.0 110.583 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 21.6 m . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.2 -0.455 . . . . 10.0 111.409 -179.929 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.036 -0.426 . . . . 10.0 112.036 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.28 131.75 53.78 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.806 0.336 . . . . 10.0 110.694 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 49.0 t -118.64 140.83 40.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.996 -178.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.96 123.11 34.2 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.353 178.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 812' ' ' VAL . . . . . 0.828 HG11 HD11 ' D' ' 834' ' ' LEU . 47.0 t -107.6 136.96 41.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 116.11 -0.496 . . . . 10.0 109.952 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -90.58 133.3 35.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.933 0.397 . . . . 10.0 111.487 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 83.7 mt -101.67 147.63 34.13 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.766 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 815' ' ' PRO . . . . . 0.487 ' HD3' ' HB ' ' D' ' 877' ' ' VAL . 60.4 Cg_endo -72.72 45.16 0.84 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 123.247 2.631 . . . . 10.0 113.458 -178.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -148.98 27.58 0.86 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.117 0.484 . . . . 10.0 109.998 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 49.3 mttm 60.37 44.16 12.57 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.176 -0.92 . . . . 10.0 111.826 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 818' ' ' GLN . . . . . 0.416 ' NE2' ' HB2' ' B' ' 39' ' ' SER . 76.8 mt-30 -147.91 177.1 9.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.952 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 819' ' ' ARG . . . . . 0.402 ' HD2' HH11 ' D' ' 819' ' ' ARG . 0.0 OUTLIER -143.97 168.46 19.92 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.858 0.361 . . . . 10.0 111.287 -178.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 12.0 t -147.63 151.55 36.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.737 -0.665 . . . . 10.0 109.283 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 4.2 t -104.9 117.46 50.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.809 0.338 . . . . 10.0 111.016 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 21.1 t -112.68 140.81 30.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.716 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.22 137.03 33.71 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.71 179.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 22.0 t -87.43 120.88 37.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.824 0.345 . . . . 10.0 110.15 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 825' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' D' ' 825' ' ' ARG . 16.5 mtp180 -129.34 135.11 48.32 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.698 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -78.84 49.37 0.9 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.92 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . -161.04 25.98 0.27 Allowed Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 120.457 -0.878 . . . . 10.0 112.34 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 11.6 ptm -151.94 159.06 43.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.626 0.25 . . . . 10.0 111.128 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 829' ' ' SER . . . . . 0.72 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 93.9 p -100.98 -179.71 4.13 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.737 -179.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 830' ' ' VAL . . . . . 0.543 HG11 HG21 ' D' ' 850' ' ' VAL . 98.6 t -67.1 -33.39 62.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 108.898 -0.779 . . . . 10.0 108.898 178.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 831' ' ' TYR . . . . . 0.47 ' O ' ' HB2' ' D' ' 835' ' ' ASP . 73.4 t80 -59.38 -43.14 92.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.463 -0.789 . . . . 10.0 110.546 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -68.73 -56.07 9.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.115 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 1.7 m -57.59 -37.22 72.84 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.383 0.883 . . . . 10.0 113.383 -178.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 834' ' ' LEU . . . . . 0.828 HD11 HG11 ' D' ' 812' ' ' VAL . 3.4 mm? -91.89 -8.98 44.87 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.915 0.709 . . . . 10.0 112.915 -178.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 835' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' D' ' 831' ' ' TYR . 24.2 t70 -62.07 -56.81 15.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.956 0.407 . . . . 10.0 110.499 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -59.93 -33.16 71.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.82 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -67.75 -36.57 80.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.491 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 838' ' ' LEU . . . . . 0.708 HD21 HG11 ' D' ' 877' ' ' VAL . 88.0 mt -86.13 -43.31 13.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.42 -0.355 . . . . 10.0 111.913 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 839' ' ' LYS . . . . . 0.493 ' HA ' ' HD3' ' D' ' 839' ' ' LYS . 16.1 mmtp -61.64 -30.71 70.89 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.16 0.429 . . . . 10.0 112.16 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 5.1 p -71.11 -17.82 20.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.926 0.394 . . . . 10.0 111.226 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 841' ' ' ARG . . . . . 0.444 ' HA ' ' HD2' ' D' ' 841' ' ' ARG . 0.6 OUTLIER -108.93 -2.85 18.01 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.893 0.331 . . . . 10.0 111.893 -179.758 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 83.91 33.52 20.98 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 120.934 -0.651 . . . . 10.0 113.057 179.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 64.3 mt -121.27 154.78 35.89 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -123.15 152.56 41.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.855 0.36 . . . . 10.0 111.035 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -66.73 -6.24 15.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.592 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -74.13 -27.1 60.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.691 -0.686 . . . . 10.0 111.599 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 1.9 m -124.38 20.57 8.79 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.655 0.264 . . . . 10.0 111.697 -178.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 82.6 m -143.9 157.34 44.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.926 0.393 . . . . 10.0 110.721 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 849' ' ' VAL . . . . . 0.551 ' HB ' HD11 ' D' ' 880' ' ' LEU . 4.4 p -144.43 156.54 14.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.87 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 850' ' ' VAL . . . . . 0.691 HG12 HG22 ' D' ' 877' ' ' VAL . 3.8 m -100.62 127.95 53.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.168 0.508 . . . . 10.0 112.3 -179.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 851' ' ' TYR . . . . . 0.475 ' CE1' HG22 ' D' ' 860' ' ' VAL . 74.5 m-85 -107.03 117.28 33.64 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 852' ' ' ARG . . . . . 0.671 ' HD2' ' OE1' ' D' ' 873' ' ' GLU . 12.7 mtm180 -75.93 127.39 32.89 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 110.126 -0.324 . . . . 10.0 110.126 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 853' ' ' LEU . . . . . 0.459 HD22 ' HA ' ' D' ' 853' ' ' LEU . 0.5 OUTLIER -90.66 87.66 6.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.008 0.433 . . . . 10.0 110.883 -179.243 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 54.1 mt -99.67 103.1 14.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.353 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt 52.91 28.7 6.83 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.42 0.896 . . . . 10.0 113.42 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 98.53 6.37 56.47 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.535 -0.841 . . . . 10.0 113.318 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 857' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' D' ' 857' ' ' ARG . 45.0 mmt-85 -113.99 117.03 30.18 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.387 -0.478 . . . . 10.0 111.143 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -73.43 109.59 7.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.819 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 4.0 m -104.42 117.4 34.08 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.422 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 860' ' ' VAL . . . . . 0.475 HG22 ' CE1' ' D' ' 851' ' ' TYR . 2.1 t -67.55 132.86 32.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.742 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 28.7 m -136.27 146.75 47.03 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.118 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -81.4 170.03 16.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.508 -179.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -83.26 -18.49 38.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.04 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.04 -16.41 63.15 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.702 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.19 148.38 43.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.273 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 866' ' ' ALA . . . . . 0.72 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -82.16 161.57 22.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.385 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 9.2 tp -89.32 -0.48 8.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.499 0.666 . . . . 10.0 110.861 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 868' ' ' ALA . . . . . 0.491 ' HB3' ' HD3' ' D' ' 869' ' ' PRO . . . -62.42 -51.33 74.1 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 113.193 0.812 . . . . 10.0 113.193 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 869' ' ' PRO . . . . . 0.491 ' HD3' ' HB3' ' D' ' 868' ' ' ALA . 2.9 Cg_exo -78.08 31.8 0.44 Allowed 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 122.491 2.127 . . . . 10.0 112.864 -179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 870' ' ' LEU . . . . . 0.5 HD11 ' HD3' ' D' ' 852' ' ' ARG . 3.4 mm? -117.62 25.96 10.04 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.239 0.542 . . . . 10.0 110.108 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -71.78 105.38 3.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.915 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 90.17 13.16 60.74 Favored Glycine 0 CA--C 1.517 0.217 0 C-N-CA 120.842 -0.694 . . . . 10.0 113.095 178.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 873' ' ' GLU . . . . . 0.671 ' OE1' ' HD2' ' D' ' 852' ' ' ARG . 5.1 tt0 -114.43 156.15 25.04 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 122.709 -0.289 . . . . 10.0 110.648 -179.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -114.4 154.5 28.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.577 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 875' ' ' LEU . . . . . 0.476 HD23 ' HG2' ' D' ' 852' ' ' ARG . 6.3 mt -128.21 135.56 49.87 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.409 -0.359 . . . . 10.0 111.696 -178.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 876' ' ' ILE . . . . . . . . . . . . . 63.9 mt -118.88 118.28 57.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 108.488 -0.93 . . . . 10.0 108.488 178.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 877' ' ' VAL . . . . . 0.708 HG11 HD21 ' D' ' 838' ' ' LEU . 11.9 t -90.02 124.3 42.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.566 0.222 . . . . 10.0 110.58 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -127.0 155.29 43.44 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.014 0.435 . . . . 10.0 111.045 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 13.5 t -76.28 143.55 12.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.426 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 880' ' ' LEU . . . . . 0.551 HD11 ' HB ' ' D' ' 849' ' ' VAL . 79.7 mt . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.438 -0.791 . . . . 10.0 111.313 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 46.8 mt . . . . . 0 C--O 1.213 -0.824 0 N-CA-C 111.166 0.062 . . . . 10.0 111.166 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 69.9 mtt180 -70.72 -44.38 66.98 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 178.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -64.78 -29.64 70.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.318 -0.856 . . . . 10.0 109.757 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . 0.634 ' HB3' HH21 ' C' ' 532' ' ' ARG . 15.5 mt-10 -86.93 -38.83 16.32 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.716 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . 0.478 ' HA ' ' HB2' ' A' ' 246' ' ' ASP . 1.7 mmt -62.01 -36.64 82.13 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.827 -0.17 . . . . 10.0 111.329 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 2.0 p -62.0 -39.99 94.11 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.79 -0.819 . . . . 10.0 108.79 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -73.35 -45.57 54.3 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.201 178.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . 0.478 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.4 OUTLIER -53.91 -54.26 41.25 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 115.892 -0.595 . . . . 10.0 109.462 179.048 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.58 ' HB3' ' HE2' ' A' ' 251' ' ' LYS . 75.7 mt -63.52 -44.17 95.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.142 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -58.69 -55.18 38.45 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 120.746 0.308 . . . . 10.0 110.815 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -63.89 -50.09 70.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.821 -0.627 . . . . 10.0 111.603 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . 0.644 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 46.1 t -59.55 -45.58 93.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 112.057 0.391 . . . . 10.0 112.057 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . 0.58 ' HE2' ' HB3' ' A' ' 247' ' ' LEU . 57.6 mtmt -72.48 -40.52 66.87 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.348 0.499 . . . . 10.0 112.348 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -68.68 -33.35 73.82 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.892 0.377 . . . . 10.0 110.696 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -88.12 -24.51 23.36 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.498 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.644 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.6 OUTLIER -63.45 -24.25 35.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.016 0.436 . . . . 10.0 110.005 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . 0.552 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 15.9 mt-30 -62.45 -64.5 2.98 Favored Pre-proline 0 N--CA 1.451 -0.419 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.43 178.258 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . 0.552 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 20.0 Cg_endo -63.59 -29.19 70.05 Favored 'Trans proline' 0 C--N 1.361 1.193 0 C-N-CA 121.802 1.668 . . . . 10.0 111.363 177.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . 0.494 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 5.0 m-30 -59.58 -57.77 11.52 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 109.424 -0.584 . . . . 10.0 109.424 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 72.7 mt -72.35 -32.86 66.85 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 115.686 -0.688 . . . . 10.0 111.003 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . 0.484 ' HB3' ' HA ' ' A' ' 256' ' ' PRO . 25.1 t70 -60.98 -49.06 78.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.748 0.309 . . . . 10.0 110.585 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -63.31 -44.97 93.48 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -61.41 -43.65 98.5 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.805 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -62.64 -46.23 89.19 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 110.258 -0.275 . . . . 10.0 110.258 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . 0.542 ' O ' ' HG3' ' A' ' 267' ' ' GLU . 71.0 mttt -59.6 -45.57 91.52 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.089 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.513 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 14.1 mptt -65.8 -46.02 80.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.0 179.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 4.0 m0 -58.51 -41.14 84.76 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.39 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -59.86 -48.12 82.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.817 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . 0.542 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 31.3 mt-10 -64.12 -41.63 97.16 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . 0.601 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 30.9 mt-10 -60.9 -40.1 91.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.861 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 96.2 mmm -75.6 -39.25 58.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.742 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -62.05 -52.58 63.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.286 0.565 . . . . 10.0 109.612 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.54 -22.44 66.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.504 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . 0.601 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 1.0 OUTLIER -78.63 -46.44 19.24 Favored 'General case' 0 C--O 1.221 -0.406 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 178.305 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 43.0 mtt85 -62.98 -33.96 76.52 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.271 0.558 . . . . 10.0 109.78 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -70.63 -7.02 41.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.338 -0.846 . . . . 10.0 110.477 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.714 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 49.5 mttp -112.62 -36.38 5.23 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.493 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . 0.6 ' O ' ' HB2' ' A' ' 280' ' ' ARG . 53.5 t -48.96 -49.08 15.96 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.673 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . 0.74 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 65.3 mt-10 -62.7 -59.04 13.77 Favored Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 111.747 0.277 . . . . 10.0 111.747 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . 0.74 ' HD3' ' HB2' ' A' ' 277' ' ' GLU . 53.3 Cg_exo -56.26 -44.05 50.11 Favored 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 122.032 1.821 . . . . 10.0 111.932 178.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.719 ' HB3' ' HE3' ' C' ' 495' ' ' LYS . 34.8 mt -64.74 -40.06 94.69 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 116.578 -0.283 . . . . 10.0 110.304 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . 0.6 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 5.5 ttt180 -65.9 -35.36 80.42 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 109.214 -0.661 . . . . 10.0 109.214 178.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.94 -44.18 90.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.738 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -61.98 -48.24 81.24 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.9 -43.85 97.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.32 -0.855 . . . . 10.0 110.584 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -63.62 -50.55 68.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.745 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . 0.635 ' HA ' ' HD2' ' A' ' 288' ' ' ARG . 8.4 mm-40 -59.15 -45.86 89.87 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.899 0.38 . . . . 10.0 110.139 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.38 -44.64 96.54 Favored Glycine 0 N--CA 1.442 -0.921 0 N-CA-C 111.015 -0.834 . . . . 10.0 111.015 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -62.22 -38.29 88.62 Favored 'General case' 0 C--O 1.221 -0.441 0 N-CA-C 110.438 -0.208 . . . . 10.0 110.438 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . 0.635 ' HD2' ' HA ' ' A' ' 285' ' ' GLU . 75.5 mtt180 -58.24 -43.61 87.88 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -71.16 -49.98 38.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.144 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 59.9 mttt -57.48 -49.34 76.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.538 -0.756 . . . . 10.0 111.507 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 69.8 mt -66.46 -34.35 77.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.519 -0.31 . . . . 10.0 110.986 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . 0.473 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 0.2 OUTLIER -62.77 -53.25 57.14 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.682 -0.488 . . . . 10.0 109.682 179.194 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.4 -37.55 81.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.633 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 60.8 mt -64.57 -48.63 74.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.8 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 15.3 mt-30 -69.74 -33.36 72.35 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.84 0.353 . . . . 10.0 111.037 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.5 -11.2 60.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.148 178.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . 0.438 ' HE3' HD11 ' A' ' 301' ' ' LEU . 9.8 mttp -103.3 -38.64 7.14 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.94 -0.573 . . . . 10.0 109.84 177.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . 0.418 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 59.0 mt -63.73 -19.9 65.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.727 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . 0.542 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 14.8 m -80.63 -64.7 0.29 Allowed Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 116.578 -0.283 . . . . 10.0 111.736 179.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . 0.542 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 40.7 Cg_endo -68.72 -51.3 0.51 Allowed 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.954 1.769 . . . . 10.0 111.964 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.616 HD13 ' HG2' ' C' ' 473' ' ' LYS . 93.0 mt -66.81 -25.09 66.28 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.938 0.399 . . . . 10.0 110.193 179.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . 0.418 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -72.88 -41.19 50.06 Favored Glycine 0 N--CA 1.444 -0.822 0 N-CA-C 109.075 -1.61 . . . . 10.0 109.075 177.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -64.41 -41.79 96.44 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 178.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -64.11 -31.87 73.23 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.156 -0.475 . . . . 10.0 109.851 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 11.0 tpt -67.68 -42.3 82.34 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.741 -0.837 . . . . 10.0 108.741 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 306' ' ' ARG . 61.6 mtt180 -69.82 -40.11 76.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.449 -0.796 . . . . 10.0 109.801 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . 0.518 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 7.1 t0 -62.37 -43.26 99.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.497 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . 1.128 ' HG3' HD11 ' C' ' 469' ' ' LEU . 23.1 mmt180 -70.06 -32.03 69.92 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.547 178.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -67.18 -38.65 85.77 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.738 -0.838 . . . . 10.0 108.738 178.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . 0.518 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 82.3 mtt180 -56.74 -54.68 43.47 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 108.993 -0.743 . . . . 10.0 108.993 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -64.13 -39.82 94.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.498 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . 0.408 ' HB2' ' O ' ' A' ' 308' ' ' ARG . 0.1 OUTLIER -57.37 -54.98 40.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.89 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 31.5 t -73.68 -36.2 46.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.636 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . 0.723 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 6.0 t70 -63.55 -44.52 93.92 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.874 -0.33 . . . . 10.0 110.553 179.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -63.95 -31.97 73.35 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.492 -0.929 . . . . 10.0 108.492 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . 0.847 ' HG ' ' HE3' ' C' ' 462' ' ' LYS . 7.3 mt -69.44 -37.36 77.33 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.276 -0.874 . . . . 10.0 109.044 178.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . 0.723 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 70.2 mtt180 -62.11 -47.2 85.69 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.997 -0.372 . . . . 10.0 109.997 178.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 1.6 m -69.16 -9.24 51.91 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.148 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -104.21 -46.57 4.39 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.642 179.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 96.4 mt -64.17 -34.51 78.23 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.42 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.71 -60.67 8.65 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-O 119.668 -0.206 . . . . 10.0 111.422 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -66.76 -31.29 39.84 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 121.632 1.554 . . . . 10.0 111.494 178.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . 0.402 ' CE1' ' HG2' ' C' ' 451' ' ' LYS . 4.6 m-30 -64.84 -42.01 95.26 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.824 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . 0.473 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 11.9 p -71.93 -38.54 69.83 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 178.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . 0.439 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 30.4 t0 -62.95 -44.27 96.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.192 0.52 . . . . 10.0 109.638 178.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -71.18 -31.23 67.39 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.42 -32.04 73.36 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.201 -0.666 . . . . 10.0 109.201 178.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' A' ' 324' ' ' SER . 80.9 mtt180 -64.62 -39.44 93.71 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.589 -0.893 . . . . 10.0 108.589 177.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -66.7 -40.43 88.47 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.956 -0.757 . . . . 10.0 108.956 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -63.83 -49.15 73.95 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.459 178.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 69.9 mt -58.81 -42.15 88.46 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.878 -0.601 . . . . 10.0 109.607 178.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -62.8 -50.42 71.07 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.591 178.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -56.28 -42.7 77.91 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.889 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . 0.451 ' HD3' ' HB3' ' C' ' 440' ' ' GLU . 35.9 mmt180 -71.34 -54.46 10.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.057 -0.52 . . . . 10.0 111.348 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . 0.547 ' O ' ' HG3' ' A' ' 339' ' ' LYS . 94.1 mt -63.22 -44.45 95.22 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.78 0.659 . . . . 10.0 112.78 -178.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -63.25 -42.24 99.15 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.543 0.211 . . . . 10.0 110.659 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.39 -38.77 91.0 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.778 -0.823 . . . . 10.0 108.778 178.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 39.5 mt -67.93 -18.85 64.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.955 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . 0.547 ' HG3' ' O ' ' A' ' 335' ' ' LEU . 82.5 mttt -75.84 -47.49 25.35 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.934 -0.765 . . . . 10.0 108.934 178.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -69.97 -50.35 42.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.545 -0.752 . . . . 10.0 109.3 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . 0.649 HD21 ' HA ' ' C' ' 433' ' ' GLU . 8.0 t-20 -61.85 -47.77 83.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.008 -0.996 . . . . 10.0 109.796 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -64.23 -41.25 98.37 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.961 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -58.46 -41.16 95.18 Favored Glycine 0 N--CA 1.45 -0.38 0 N-CA-C 111.05 -0.82 . . . . 10.0 111.05 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -70.36 -39.98 74.3 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . 0.518 ' O ' ' HB2' ' A' ' 349' ' ' TYR . 68.7 mtt180 -60.94 -44.24 97.52 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.368 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 66.6 mt -65.67 -44.0 87.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.502 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.65 -48.9 79.72 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . 0.423 ' HB3' ' NZ ' ' A' ' 352' ' ' LYS . 12.4 mt-10 -66.17 -33.24 75.33 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.399 -0.819 . . . . 10.0 110.75 179.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . 0.518 ' HB2' ' O ' ' A' ' 345' ' ' ARG . 1.3 t80 -62.94 -45.3 93.1 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.453 -0.573 . . . . 10.0 109.453 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 -69.33 -38.5 78.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.485 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.63 94.96 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.108 0.48 . . . . 10.0 110.083 178.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . 0.423 ' NZ ' ' HB3' ' A' ' 348' ' ' GLU . 14.4 mtmm -81.12 -18.36 46.74 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.117 178.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . 0.508 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -72.76 -42.29 64.16 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.259 -0.645 . . . . 10.0 109.259 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -62.39 -36.2 81.57 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.395 -0.595 . . . . 10.0 109.395 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -66.32 -34.57 78.29 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.941 -0.572 . . . . 10.0 109.465 178.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -69.1 -42.94 75.45 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.081 -1.081 . . . . 10.0 108.081 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 86.1 mt -65.15 -40.94 95.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.278 -0.873 . . . . 10.0 112.42 -179.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 1.7 p -61.74 -45.75 92.6 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.879 0.371 . . . . 10.0 110.844 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.4 p -70.97 -33.98 70.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.967 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 16.1 mt -66.35 -43.63 85.53 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.625 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 1.8 p -68.55 -28.87 67.35 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.101 0.477 . . . . 10.0 109.877 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -78.11 2.23 18.61 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-O 121.616 0.722 . . . . 10.0 110.034 178.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.451 ' O ' ' HB3' ' A' ' 367' ' ' ALA . 82.5 tttt -117.81 -36.83 3.55 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.401 -0.963 . . . . 10.0 108.401 177.322 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -72.1 -13.06 61.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.613 -0.722 . . . . 10.0 111.688 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.933 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 96.1 mttt -111.91 -70.1 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.552 0 C-N-CA 120.834 -0.346 . . . . 10.0 111.117 178.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.933 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 36.0 Cg_exo -60.04 -55.2 1.73 Allowed 'Trans proline' 0 C--N 1.355 0.868 0 C-N-CA 121.928 1.752 . . . . 10.0 112.302 -179.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -64.95 -41.07 95.81 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.304 0.483 . . . . 10.0 112.304 -179.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . 0.513 HD23 ' HA ' ' A' ' 368' ' ' LEU . 10.9 mt -66.01 -40.65 91.28 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.588 -0.445 . . . . 10.0 111.253 179.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -69.92 -32.34 70.59 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.886 -0.783 . . . . 10.0 108.886 178.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.78 -42.25 95.23 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.049 -1.093 . . . . 10.0 108.049 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . 0.434 HD12 HD23 ' A' ' 368' ' ' LEU . 51.6 mt -66.33 -34.4 77.9 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.154 -0.93 . . . . 10.0 109.936 178.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 368' ' ' LEU . 97.9 mtt180 -63.41 -44.87 93.4 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.05 -0.722 . . . . 10.0 109.05 178.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -73.03 -5.44 38.9 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.467 -0.788 . . . . 20.0 112.076 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -102.76 -41.15 2.36 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 109.748 -1.341 . . . . 10.0 109.748 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . 0.414 ' O ' HG12 ' A' ' 378' ' ' VAL . 89.1 mt -71.34 -37.99 71.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.463 -0.369 . . . . 10.0 111.439 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 58.5 mt -56.43 -59.64 11.49 Favored Pre-proline 0 CA--C 1.534 0.365 0 N-CA-C 112.212 0.449 . . . . 10.0 112.212 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -62.77 -35.37 68.88 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 121.84 1.693 . . . . 10.0 111.718 179.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . 0.414 HG12 ' O ' ' A' ' 375' ' ' LEU . 0.3 OUTLIER -67.16 -33.71 64.8 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 C-N-CA 120.652 -0.419 . . . . 10.0 110.643 179.646 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.73 -36.2 81.91 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . 0.433 ' O ' HG23 ' A' ' 384' ' ' VAL . 14.2 mt-10 -67.72 -44.17 78.25 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.92 -0.582 . . . . 10.0 109.74 178.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 13.7 m -62.25 -40.85 97.55 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.058 -0.719 . . . . 10.0 109.058 178.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -65.4 -43.01 91.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.247 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -57.78 -50.1 74.38 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.598 -0.274 . . . . 10.0 110.91 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 380' ' ' GLU . 81.7 t -59.07 -46.32 91.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.347 179.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 14.7 m -66.91 -40.67 87.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.914 -0.584 . . . . 10.0 111.682 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -68.44 -45.96 71.11 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.012 0.375 . . . . 10.0 112.012 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 37.4 mt -59.88 -43.29 94.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.034 0.445 . . . . 10.0 110.627 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . 0.437 ' O ' ' HB2' ' A' ' 392' ' ' GLU . 34.0 p -75.95 -16.2 60.04 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.502 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -87.0 -48.63 7.95 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.985 -0.376 . . . . 10.0 109.985 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 77.9 mt -59.9 -42.45 93.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.051 0.453 . . . . 10.0 109.834 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -64.75 -36.35 84.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.639 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . 0.47 ' OE1' ' HA ' ' A' ' 392' ' ' GLU . 0.0 OUTLIER -66.88 -49.56 65.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.533 -179.831 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -55.79 -50.03 71.57 Favored 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.743 0.652 . . . . 10.0 111.643 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 5.0 m -60.92 -32.73 72.22 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.589 -0.732 . . . . 10.0 111.089 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt . . . . . 0 CA--C 1.529 0.143 0 CA-C-O 120.658 0.266 . . . . 10.0 111.209 179.98 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 58.7 mt . . . . . 0 N--CA 1.455 -0.225 0 CA-C-O 120.631 0.253 . . . . 10.0 111.664 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -62.33 -23.84 67.0 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.061 0.457 . . . . 10.0 111.073 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -79.01 -50.07 11.69 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.118 -0.697 . . . . 10.0 109.118 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -58.79 -44.72 90.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.243 -0.89 . . . . 10.0 110.394 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 25.9 m0 -64.76 -32.58 74.32 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.953 -0.567 . . . . 10.0 111.419 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -61.67 -50.27 73.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.452 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -37.51 87.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.21 0.528 . . . . 10.0 110.602 179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 74.9 t -67.99 -41.86 84.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.964 178.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 81.9 m -62.71 -48.08 80.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.795 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 2.5 p -60.86 -46.2 91.55 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.683 0.278 . . . . 10.0 111.206 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 12.1 p -66.19 -39.01 89.36 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.906 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -66.24 -40.03 89.95 Favored 'General case' 0 CA--C 1.522 -0.106 0 CA-C-N 116.552 -0.295 . . . . 10.0 110.402 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . 0.407 ' O ' ' HG3' ' C' ' 417' ' ' GLU . 30.8 m -63.15 -48.22 79.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.438 . . . . 10.0 110.012 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -66.62 -29.11 69.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.681 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 53.0 tp -67.31 -46.38 73.71 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 61.2 mtt180 -62.59 -40.49 97.07 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.669 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . 0.624 ' O ' ' HD2' ' C' ' 421' ' ' PRO . 27.6 mt-10 -61.77 -48.6 79.93 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.778 -0.646 . . . . 10.0 109.813 178.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -60.18 -42.67 95.49 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.768 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 49.0 mt -57.48 -26.77 61.76 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.612 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -56.57 -78.09 0.14 Allowed Glycine 0 CA--C 1.52 0.377 0 C-N-CA 120.957 -0.64 . . . . 10.0 111.613 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . 0.624 ' HD2' ' O ' ' C' ' 417' ' ' GLU . 12.4 Cg_endo -57.64 -33.4 96.6 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.901 2.401 . . . . 10.0 111.95 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . 0.401 HG22 ' HG2' ' A' ' 352' ' ' LYS . 21.9 t -61.72 -49.15 85.49 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 CA-C-N 116.717 -0.22 . . . . 10.0 111.004 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 19.7 m -69.78 -34.7 74.11 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 110.075 -0.342 . . . . 10.0 110.075 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -61.92 -49.99 73.94 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.221 -0.659 . . . . 10.0 109.221 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . 0.421 ' HB3' ' NZ ' ' A' ' 352' ' ' LYS . 59.4 mt-10 -63.63 -40.79 97.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.703 -0.68 . . . . 10.0 109.212 178.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -58.27 -43.07 87.8 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.937 179.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 28.5 m0 -67.87 -36.48 80.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.865 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . 0.418 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 15.1 t70 -70.53 -30.13 66.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.504 0.668 . . . . 10.0 109.429 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . 0.452 HD21 ' HA ' ' A' ' 345' ' ' ARG . 7.0 t-20 -73.46 -38.95 65.3 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.232 -1.025 . . . . 10.0 108.232 177.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . 0.447 ' HA ' ' HB2' ' C' ' 433' ' ' GLU . 42.0 mt -68.31 -24.02 64.8 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 177.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -67.01 -47.94 69.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.118 -1.438 . . . . 10.0 107.118 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . 0.418 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 49.6 mttp -65.65 -36.73 84.52 Favored 'General case' 0 C--N 1.333 -0.11 0 N-CA-C 108.576 -0.898 . . . . 10.0 108.576 178.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . 0.649 ' HA ' HD21 ' A' ' 341' ' ' ASN . 3.7 tm-20 -59.47 -57.67 11.94 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.105 -0.952 . . . . 10.0 109.454 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 33.8 m -63.48 -42.93 98.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.59 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -63.15 -41.2 99.23 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.782 0.325 . . . . 10.0 110.457 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -66.54 -48.56 61.94 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 110.013 -1.235 . . . . 10.0 110.013 178.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 14.9 mt -59.82 -33.63 72.0 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 120.499 0.19 . . . . 10.0 110.527 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 27.7 mtt180 -62.62 -38.91 92.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.464 -0.335 . . . . 10.0 110.769 179.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -67.64 -40.19 84.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.341 0.591 . . . . 10.0 109.697 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . 0.451 ' HB3' ' HD3' ' A' ' 334' ' ' ARG . 35.8 mt-10 -72.04 -50.08 31.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.301 -0.863 . . . . 10.0 110.91 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 92.1 mmm -63.49 -37.53 87.66 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.795 1.035 . . . . 10.0 113.795 -178.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 4.4 p -59.47 -45.65 91.04 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . 0.419 ' O ' ' HB2' ' C' ' 447' ' ' GLU . 80.6 mttt -70.46 -42.13 71.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.461 -0.79 . . . . 10.0 109.82 178.35 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -58.23 -48.17 81.22 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.739 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 78.2 mt -61.86 -50.11 73.54 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.678 0.251 . . . . 10.0 111.678 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -62.82 -42.94 99.93 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.822 0.344 . . . . 10.0 110.412 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . 0.594 ' O ' ' HB2' ' C' ' 451' ' ' LYS . 3.1 mt-10 -66.05 -43.13 88.4 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.31 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 2.8 p -66.76 -33.95 66.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 121.087 -0.245 . . . . 10.0 111.204 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -73.93 -43.58 57.85 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.996 0.426 . . . . 10.0 110.069 178.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -72.01 -11.8 60.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.915 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . 0.594 ' HB2' ' O ' ' C' ' 447' ' ' GLU . 0.2 OUTLIER -104.09 -30.41 10.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.975 179.399 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 5.4 p -69.76 -29.9 42.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.746 0.308 . . . . 10.0 110.567 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . 0.804 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 16.9 mt-30 -62.84 -59.6 12.1 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.198 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . 0.804 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 37.2 Cg_exo -63.58 -29.56 70.29 Favored 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 122.079 1.853 . . . . 10.0 110.952 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . 0.545 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.1 OUTLIER -69.3 -48.08 62.64 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.264 179.528 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 18.0 mt -64.77 -38.39 90.81 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 178.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -63.57 -50.24 70.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.903 -0.589 . . . . 10.0 109.816 178.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . 0.546 ' O ' ' HG3' ' C' ' 462' ' ' LYS . 19.0 t70 -62.07 -45.66 92.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.824 -0.626 . . . . 10.0 109.691 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -62.24 -41.24 98.25 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.841 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -64.09 -40.06 95.41 Favored 'General case' 0 C--O 1.225 -0.225 0 N-CA-C 109.562 -0.533 . . . . 10.0 109.562 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 43.0 mttp -61.08 -41.91 97.53 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 108.703 -0.851 . . . . 10.0 108.703 178.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . 0.847 ' HE3' ' HG ' ' A' ' 316' ' ' LEU . 35.1 mttm -66.6 -42.05 87.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.358 -0.837 . . . . 10.0 109.906 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 13.8 m0 -64.2 -35.18 79.95 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.043 178.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -67.49 -46.06 74.05 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 1.088 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 42.2 mt-10 -60.24 -44.25 95.4 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 121.191 0.52 . . . . 10.0 109.901 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -71.61 -48.09 50.31 Favored 'General case' 0 C--O 1.217 -0.652 0 CA-C-N 115.486 -0.779 . . . . 10.0 112.402 -179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 11.3 mmt -60.17 -43.94 95.43 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.802 -0.359 . . . . 10.0 110.582 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -65.33 -46.53 79.89 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.793 -0.817 . . . . 10.0 108.793 178.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 1.128 HD11 ' HG3' ' A' ' 308' ' ' ARG . 96.2 mt -59.64 -46.3 89.42 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 115.39 -0.823 . . . . 20.0 111.499 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 19.3 m-30 -63.87 -44.14 93.99 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.99 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 19.5 ttm105 -65.23 -47.06 78.15 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.621 0.248 . . . . 10.0 111.219 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -65.01 -9.2 19.96 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.274 -0.421 . . . . 10.0 112.055 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . 0.616 ' HG2' HD13 ' A' ' 301' ' ' LEU . 87.4 mttt -111.84 -43.67 3.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.648 -0.251 . . . . 10.0 111.188 179.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 42.4 t -64.95 -38.57 83.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.79 -0.186 . . . . 10.0 110.848 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -58.13 -59.7 12.47 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 120.879 -0.328 . . . . 10.0 111.311 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -65.32 -35.67 39.24 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 121.649 1.566 . . . . 10.0 111.384 178.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . 0.42 ' HB2' ' O ' ' C' ' 473' ' ' LYS . 10.2 mt -62.08 -41.95 98.7 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 109.82 -0.437 . . . . 10.0 109.82 179.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -63.16 -35.05 79.01 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . 0.606 ' O ' ' HG2' ' C' ' 483' ' ' GLU . . . -68.71 -51.33 42.74 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.767 -0.652 . . . . 10.0 109.298 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -62.93 -36.87 84.85 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.335 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 35.9 mt -66.09 -35.25 80.02 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -69.84 -36.71 75.8 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . 0.606 ' HG2' ' O ' ' C' ' 479' ' ' ALA . 61.1 mm-40 -63.57 -48.83 75.81 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 107.699 -1.223 . . . . 10.0 107.699 177.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -65.85 -33.37 85.6 Favored Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 114.999 -1.0 . . . . 10.0 111.319 178.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.63 -44.79 73.48 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 110.356 -0.239 . . . . 10.0 110.356 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -63.83 -39.57 94.53 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.125 -0.694 . . . . 10.0 109.125 178.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -65.33 -49.35 69.75 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.659 -0.867 . . . . 10.0 108.659 177.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -59.04 -38.99 80.62 Favored 'General case' 0 CA--C 1.522 -0.11 0 CA-C-N 115.943 -0.572 . . . . 10.0 110.613 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 39.3 mt -63.32 -44.23 95.54 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -69.61 -37.24 76.78 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.666 -0.494 . . . . 10.0 109.666 178.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -60.16 -43.84 95.48 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 177.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 58.2 mt -71.6 -37.56 70.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.569 179.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -61.6 -40.41 94.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.646 0.26 . . . . 10.0 110.305 179.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -75.66 9.59 2.19 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.081 -0.509 . . . . 10.0 111.009 178.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.719 ' HE3' ' HB3' ' A' ' 279' ' ' LEU . 56.8 mttp -123.2 -55.14 1.78 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.621 -0.718 . . . . 10.0 109.192 178.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 91.5 mt -61.23 -33.71 73.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.855 -0.612 . . . . 10.0 112.39 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . 0.452 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 13.6 m -69.8 -61.04 3.25 Favored Pre-proline 0 CA--C 1.536 0.417 0 C-N-CA 120.734 -0.387 . . . . 10.0 111.668 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . 0.452 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 37.1 Cg_endo -65.17 -48.09 3.9 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 121.708 1.606 . . . . 10.0 111.801 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . 0.633 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 12.4 mt -66.26 -34.01 77.03 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-N 116.908 -0.133 . . . . 10.0 110.983 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.87 -50.94 55.74 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.524 -0.846 . . . . 10.0 111.002 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -67.0 -34.28 77.4 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.931 0.396 . . . . 10.0 110.337 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . 0.512 ' HG2' ' HE ' ' C' ' 506' ' ' ARG . 27.7 tt0 -69.2 -46.66 66.88 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 178.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . 0.707 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 58.4 mmm -61.22 -32.26 72.03 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 178.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -64.97 -44.5 89.17 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . 0.505 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 1.1 t0 -68.15 -38.53 82.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.887 -0.597 . . . . 10.0 109.872 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.707 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 52.0 mtt180 -61.26 -45.28 95.18 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 107.963 -1.125 . . . . 10.0 107.963 177.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -62.25 -42.93 99.76 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.342 -0.844 . . . . 10.0 109.596 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' C' ' 512' ' ' ASP . 63.7 mtt180 -58.86 -49.44 77.74 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.596 -0.52 . . . . 10.0 109.596 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -61.41 -38.52 87.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.69 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . 0.497 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 5.7 m-70 -70.18 -51.41 31.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.778 179.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 66.7 t -65.29 -42.17 93.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.667 -179.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.531 ' HB2' ' O ' ' C' ' 508' ' ' ARG . 0.1 OUTLIER -64.62 -34.56 78.57 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.589 -0.523 . . . . 10.0 109.589 179.24 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -69.97 -39.82 75.75 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.548 -1.279 . . . . 10.0 107.548 177.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . 0.505 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 81.9 mt -64.61 -28.67 69.78 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.901 -0.591 . . . . 10.0 109.899 178.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' C' ' 512' ' ' ASP . 28.8 mtt180 -62.37 -30.93 71.54 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.568 -0.53 . . . . 10.0 109.568 178.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.13 2.23 24.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.691 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . 0.505 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 50.7 m170 -115.07 -16.4 11.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.505 -179.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 93.2 mt -111.95 -55.0 2.56 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.652 -0.249 . . . . 10.0 111.448 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -50.71 -60.19 5.94 Favored Pre-proline 0 N--CA 1.468 0.465 0 N-CA-C 113.134 0.79 . . . . 10.0 113.134 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -66.5 -29.22 44.96 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.44 1.426 . . . . 10.0 110.98 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . 0.438 ' HA ' ' OE1' ' C' ' 524' ' ' GLU . 63.9 t80 -66.19 -45.03 82.23 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.188 -0.46 . . . . 10.0 109.992 179.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . 0.465 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 11.1 p -66.83 -29.22 69.1 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.882 -0.414 . . . . 10.0 109.882 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . 0.793 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 12.7 t70 -70.76 -41.02 72.31 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 178.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . 0.438 ' OE1' ' HA ' ' C' ' 521' ' ' TYR . 72.7 mt-10 -63.22 -39.54 94.91 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 107.704 -1.221 . . . . 10.0 107.704 177.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 32.9 mt -64.0 -36.25 83.35 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.151 -0.931 . . . . 10.0 109.426 177.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . 0.793 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 78.6 mtt180 -60.59 -38.78 85.78 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -65.28 -45.37 84.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.24 0.543 . . . . 10.0 109.694 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -68.25 -41.31 81.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.443 -0.799 . . . . 10.0 110.121 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 53.3 mt -65.21 -35.08 79.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.204 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . 0.537 ' O ' ' HG2' ' C' ' 534' ' ' GLU . . . -61.36 -46.4 90.37 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.38 -39.39 89.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.821 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . 0.634 HH21 ' HB3' ' A' ' 242' ' ' GLU . 4.4 ttm180 -60.79 -39.69 89.79 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 178.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . 0.404 ' O ' ' HG3' ' C' ' 537' ' ' LYS . 71.5 mt -72.05 -33.96 68.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.575 -0.738 . . . . 10.0 109.914 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' C' ' 530' ' ' ALA . 71.1 mm-40 -59.36 -43.91 92.76 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 178.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.61 -40.88 98.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.366 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 94.9 mt -69.66 -11.37 60.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.778 -0.646 . . . . 10.0 111.171 179.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' C' ' 533' ' ' LEU . 77.9 mttt -94.18 -51.87 4.63 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.924 -0.769 . . . . 10.0 108.924 178.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -59.28 -54.75 43.28 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.585 -0.734 . . . . 10.0 110.044 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -75.83 -23.97 55.81 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.725 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.22 -54.33 24.53 Favored Glycine 0 N--CA 1.449 -0.484 0 N-CA-C 111.176 -0.769 . . . . 10.0 111.176 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.7 -34.34 89.37 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 110.988 -0.845 . . . . 10.0 110.988 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -66.28 -53.21 39.4 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 55.2 mtt85 -59.57 -34.89 73.27 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.378 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 58.7 mt -63.27 -41.09 98.99 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.142 0.496 . . . . 10.0 109.775 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -72.83 -40.84 65.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.611 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . 0.404 ' O ' ' HD2' ' C' ' 550' ' ' LYS . 44.2 mt-10 -60.65 -50.49 73.29 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.816 -0.629 . . . . 10.0 109.544 178.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -58.92 -38.61 79.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.062 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.55 -43.17 94.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.155 179.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . 0.45 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -66.15 -49.77 66.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.753 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . 0.404 ' HD2' ' O ' ' C' ' 546' ' ' GLU . 0.0 OUTLIER -61.4 -36.64 80.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.851 179.491 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.06 -40.84 95.28 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 71.0 m -62.54 -49.17 76.39 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.944 -0.761 . . . . 10.0 108.944 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 44.3 mt-10 -60.49 -38.71 85.19 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.175 178.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -66.45 -38.37 87.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.278 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 75.2 mt -67.44 -35.69 79.73 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 178.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 16.9 m -70.01 -37.69 75.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.259 0.552 . . . . 10.0 109.796 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 3.1 p -78.55 -5.0 51.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.519 0.676 . . . . 10.0 110.156 179.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 19.7 mt -98.88 -30.42 12.39 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.25 -0.886 . . . . 10.0 109.64 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.97 -30.33 69.59 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.027 0.441 . . . . 10.0 110.117 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -71.36 -5.76 34.96 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 121.505 0.669 . . . . 10.0 110.06 178.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . 0.479 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 11.3 mptt -113.12 -35.17 5.46 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.516 -0.766 . . . . 10.0 109.175 177.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -65.65 -24.91 67.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.248 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . 0.957 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 39.6 mtmt -102.89 -73.14 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.463 0 CA-C-O 119.208 -0.425 . . . . 10.0 111.969 179.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . 0.957 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 31.2 Cg_exo -58.95 -51.38 6.96 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 122.444 2.096 . . . . 10.0 113.735 -178.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . 0.479 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -64.13 -52.28 59.85 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.617 0.228 . . . . 10.0 111.617 -179.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . 0.599 HD23 HD12 ' C' ' 569' ' ' LEU . 16.5 mt -59.88 -40.73 89.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.864 -0.153 . . . . 10.0 111.4 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . 0.536 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 22.1 mm-40 -63.06 -45.43 92.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.719 0.295 . . . . 10.0 110.709 178.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -66.67 -32.57 73.96 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.732 -0.387 . . . . 10.0 110.382 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . 0.599 HD12 HD23 ' C' ' 566' ' ' LEU . 38.1 mt -63.2 -39.09 93.63 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 177.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . 0.434 ' HA ' ' HB2' ' C' ' 573' ' ' LEU . 84.4 mtt180 -71.95 -36.92 70.02 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.154 -0.684 . . . . 10.0 109.154 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . 0.536 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.7 mt-30 -64.01 -23.38 67.31 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.218 -0.901 . . . . 20.0 111.292 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -94.91 -33.0 6.84 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 109.317 -1.513 . . . . 10.0 109.317 178.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . 0.588 ' HA ' HG12 ' C' ' 576' ' ' VAL . 13.9 mt -62.46 -41.0 98.45 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.938 0.347 . . . . 10.0 111.938 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . 0.402 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 90.0 mt -58.26 -60.12 11.2 Favored Pre-proline 0 C--N 1.327 -0.389 0 C-N-CA 121.145 -0.222 . . . . 10.0 111.543 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . 0.402 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 30.0 Cg_endo -65.08 -31.42 54.99 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 122.052 1.835 . . . . 10.0 112.155 178.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . 0.588 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.8 OUTLIER -68.13 -36.51 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 C-N-CA 120.7 -0.4 . . . . 10.0 110.251 179.145 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 34.5 mt -71.26 -35.77 71.52 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . 0.456 ' O ' HG23 ' C' ' 582' ' ' VAL . 68.7 mt-10 -64.8 -50.35 67.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.125 178.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 2.7 p -64.6 -42.1 95.78 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.424 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . 0.519 ' HB2' ' O ' ' C' ' 576' ' ' VAL . 0.5 OUTLIER -60.48 -42.05 95.49 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 178.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . 0.442 ' O ' ' HG ' ' C' ' 585' ' ' LEU . 66.3 mttt -65.38 -38.86 91.3 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-N 115.932 -0.577 . . . . 10.0 110.679 178.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . 0.456 HG23 ' O ' ' C' ' 578' ' ' GLU . 49.0 t -59.38 -49.56 83.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 N-CA-C 109.437 -0.579 . . . . 10.0 109.437 178.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 4.6 m -62.78 -40.12 96.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.876 178.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . 0.462 ' O ' ' HG ' ' C' ' 588' ' ' LEU . 0.8 OUTLIER -63.59 -45.63 89.54 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.958 -0.565 . . . . 10.0 111.066 179.425 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' C' ' 581' ' ' LYS . 52.7 mt -59.97 -42.3 93.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.306 -0.407 . . . . 10.0 110.272 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . 0.504 ' O ' ' HG3' ' C' ' 590' ' ' GLU . 20.8 m -67.56 -46.91 71.35 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.01 -0.737 . . . . 10.0 109.01 178.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -55.9 -50.92 69.34 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.596 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' C' ' 584' ' ' PHE . 97.0 mt -55.41 -54.0 49.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.845 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . 0.407 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 18.4 mt-10 -65.07 -50.08 67.55 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.941 0.348 . . . . 10.0 111.941 -179.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . 0.504 ' HG3' ' O ' ' C' ' 586' ' ' SER . 35.7 mt-10 -60.38 -37.44 80.78 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -179.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -71.18 -39.85 71.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.536 0.207 . . . . 10.0 111.069 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 83.8 m -59.52 -33.81 71.84 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.963 0.411 . . . . 10.0 110.401 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 93.8 mttt -63.93 -22.36 66.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.833 -0.621 . . . . 10.0 111.583 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . 0.408 ' NZ ' ' HB2' ' A' ' 388' ' ' SER . 0.0 OUTLIER -101.67 -24.62 14.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.896 0.379 . . . . 10.0 110.699 179.093 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 81.3 mt -75.95 -31.19 58.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.326 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 . . . . . 0 C--O 1.245 0.823 0 CA-C-O 118.566 -0.731 . . . . 10.0 110.495 179.823 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 2.7 m . . . . . 0 C--O 1.234 0.24 0 CA-C-O 121.126 0.488 . . . . 10.0 111.085 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -81.39 144.51 31.38 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.292 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -128.93 109.48 11.28 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.661 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 40.8 mmtt -93.41 106.07 18.07 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.356 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.536 ' HB3' HD23 ' B' ' 159' ' ' LEU . 8.7 mt -102.6 108.4 19.66 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.733 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 49.9 t -99.89 115.04 40.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.189 0.518 . . . . 10.0 110.61 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.495 HG22 HD12 ' B' ' 79' ' ' LEU . 39.3 t -87.73 112.35 23.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.594 HG21 HD11 ' B' ' 100' ' ' ILE . 17.6 m -108.95 160.16 7.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.826 0.346 . . . . 10.0 111.038 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 158.35 171.86 24.76 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.596 -0.812 . . . . 10.0 111.938 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.41 -176.82 3.31 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.156 0.503 . . . . 10.0 112.13 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -92.51 111.41 4.06 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.005 -0.617 . . . . 10.0 112.489 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 124.08 -20.28 7.16 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.905 -0.664 . . . . 10.0 111.959 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . 0.446 HG23 ' HG3' ' B' ' 16' ' ' LYS . 24.8 m -53.38 -51.67 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 112.658 0.614 . . . . 10.0 112.658 -179.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.55 29.54 1.41 Allowed Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.461 -0.876 . . . . 10.0 113.944 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . 0.446 ' HG3' HG23 ' B' ' 14' ' ' VAL . 49.8 mtmt -58.73 -51.21 70.92 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.258 0.551 . . . . 10.0 110.715 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.09 -44.66 91.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.325 -0.852 . . . . 10.0 111.484 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.32 -46.22 89.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.35 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 46.4 mt -62.6 -39.15 92.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.837 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 18.6 m -67.8 -45.86 73.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.791 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 67.5 mt -65.48 -31.67 54.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.173 0.511 . . . . 10.0 110.087 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.484 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 6.4 tp-100 -69.58 -20.53 63.65 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.332 179.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 6.8 tp -92.16 -46.74 7.6 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.415 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . 0.455 HD11 HD13 ' B' ' 55' ' ' ILE . 40.8 mm -75.73 -63.8 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 112.781 0.66 . . . . 10.0 112.781 -178.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -87.79 -15.86 35.73 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.025 0.38 . . . . 10.0 112.025 -178.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.484 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 64.6 t30 66.21 47.67 1.8 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.629 0.728 . . . . 10.0 110.046 -179.373 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 51.6 t60 -143.14 134.62 26.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.458 -0.792 . . . . 10.0 110.388 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -93.35 133.65 36.38 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.381 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 6.1 m -98.19 137.45 25.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.095 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -94.26 -18.15 21.95 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.359 0.599 . . . . 10.0 110.467 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -93.2 175.88 6.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.692 -0.686 . . . . 10.0 111.684 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.615 ' O ' ' HD3' ' B' ' 34' ' ' PRO . 70.5 t80 -94.95 133.99 38.1 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.872 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -101.31 95.81 5.35 Favored Pre-proline 0 C--O 1.235 0.298 0 N-CA-C 110.113 -0.328 . . . . 10.0 110.113 178.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . 0.615 ' HD3' ' O ' ' B' ' 32' ' ' TYR . 23.0 Cg_exo -66.31 103.97 0.7 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.545 2.163 . . . . 10.0 108.509 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 87.8 m -120.32 141.12 50.32 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 114.117 1.154 . . . . 10.0 114.117 -176.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.463 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 5.0 mp -113.82 -28.58 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 N-CA-C 106.583 -1.636 . . . . 10.0 106.583 176.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.434 ' HB3' HG23 ' D' ' 821' ' ' VAL . 30.1 tt0 -176.65 103.5 0.06 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 114.651 -1.159 . . . . 10.0 110.378 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . 1.034 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 52.6 m-20 -114.35 139.03 49.8 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . 0.558 ' HB2' ' HB3' ' D' ' 818' ' ' GLN . 4.0 m -116.01 131.0 57.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.91 0.385 . . . . 10.0 111.8 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . 0.401 ' HB3' HG13 ' B' ' 24' ' ' ILE . 93.2 m-85 -129.81 150.06 51.27 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.111 -0.7 . . . . 10.0 109.111 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . 0.483 ' HB2' ' NE2' ' D' ' 818' ' ' GLN . 35.4 ttp180 -165.1 136.98 4.23 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.08 -0.248 . . . . 10.0 111.436 -178.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 7.4 tttm -150.58 162.9 39.75 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.376 -0.601 . . . . 10.0 109.376 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -103.09 118.15 36.16 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.886 -0.412 . . . . 10.0 109.886 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 9.1 m -139.36 166.99 20.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-O 121.056 0.455 . . . . 10.0 111.303 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.555 ' HA ' ' HA ' ' B' ' 50' ' ' THR . 10.9 t -96.93 129.23 47.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 109.122 -0.696 . . . . 10.0 109.122 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . 0.727 HD13 HG11 ' B' ' 160' ' ' VAL . 9.6 mt -113.29 94.38 3.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.752 0.311 . . . . 10.0 111.095 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 61.56 41.17 12.74 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.521 -0.763 . . . . 10.0 111.744 178.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.56 -33.19 6.04 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.532 -0.758 . . . . 10.0 112.284 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -91.87 111.67 23.29 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.778 0.323 . . . . 10.0 110.928 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.555 ' HA ' ' HA ' ' B' ' 45' ' ' VAL . 3.8 m -76.74 132.3 39.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.782 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 73.5 m -148.75 175.64 11.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.749 0.309 . . . . 10.0 111.368 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 22.3 tp -106.56 126.27 52.05 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.596 -0.52 . . . . 10.0 109.596 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.462 HD22 HD11 ' B' ' 6' ' ' LEU . 66.7 mt -105.76 126.82 52.61 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.5 0.556 . . . . 10.0 112.5 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -106.56 117.04 33.0 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.129 -1.063 . . . . 10.0 108.129 178.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.455 HD13 HD11 ' B' ' 24' ' ' ILE . 4.0 mp -113.5 143.53 23.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 120.598 0.237 . . . . 10.0 111.125 -178.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 12.4 tp -128.1 122.71 32.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.895 0.378 . . . . 10.0 111.823 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 1.034 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 12.6 t0 -88.51 105.95 17.96 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 107.429 -1.323 . . . . 10.0 107.429 178.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 27.1 p -80.9 164.65 22.47 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.539 0.94 . . . . 10.0 113.539 -177.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . 0.463 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -73.22 140.0 46.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.218 179.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.68 -9.78 60.95 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.607 -0.806 . . . . 10.0 112.413 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -141.13 79.21 1.68 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.198 0.523 . . . . 20.0 110.241 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -134.62 152.83 52.06 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.057 -179.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -103.42 -154.45 0.5 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.319 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -82.79 103.0 11.95 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.3 -0.56 . . . . 10.0 111.099 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -123.14 143.07 50.24 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.708 -0.678 . . . . 10.0 109.84 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.37 -30.98 71.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.949 0.404 . . . . 10.0 110.396 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 1.1 mmt -61.42 -45.95 92.15 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.561 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.446 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 14.4 ttm180 -64.21 -43.58 94.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.545 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.444 ' O ' ' HB2' ' B' ' 73' ' ' ARG . 0.1 OUTLIER -62.4 -19.2 63.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.761 -0.654 . . . . 10.0 111.357 179.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -97.03 -45.75 6.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.298 179.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' B' ' 68' ' ' ARG 0.282 0.6 OUTLIER -69.05 -25.44 64.47 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 113.124 0.787 . . . . 10.0 113.124 -179.077 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 34.0 mtp -93.72 2.25 56.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.237 0.541 . . . . 10.0 110.134 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' B' ' 69' ' ' ASP . 10.8 ttm180 -95.54 -25.86 16.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.731 -179.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.44 -4.17 58.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.7 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -83.81 156.53 33.08 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.752 -0.737 . . . . 10.0 112.687 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -113.88 -46.49 3.02 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.188 0.518 . . . . 10.0 109.693 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . 0.426 ' HA3' HD11 ' B' ' 163' ' ' ILE . . . -111.63 137.26 14.16 Favored Glycine 0 N--CA 1.444 -0.797 0 N-CA-C 110.161 -1.176 . . . . 10.0 110.161 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -122.02 124.11 43.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.26 0.552 . . . . 10.0 112.406 -178.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.929 ' HG ' HD22 ' B' ' 159' ' ' LEU . 70.2 mt -97.18 110.27 22.85 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.472 -0.785 . . . . 10.0 109.685 179.068 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . 0.54 ' HB3' HD12 ' B' ' 93' ' ' ILE . 26.3 m -85.94 92.81 8.78 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.491 HG22 ' HB ' ' B' ' 114' ' ' VAL . 47.1 t -91.36 121.96 42.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.847 -0.615 . . . . 10.0 112.203 -178.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.736 ' HB3' HD11 ' B' ' 93' ' ' ILE . 29.7 p90 -128.33 158.95 36.8 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.419 -0.81 . . . . 10.0 109.066 178.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -100.13 126.05 46.33 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 110.088 -0.338 . . . . 10.0 110.088 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . 0.769 HD11 ' HA ' ' B' ' 118' ' ' CYS . 32.0 pt -69.49 -9.98 12.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.394 0.616 . . . . 10.0 110.288 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . 0.415 ' HA ' ' O ' ' B' ' 122' ' ' SER . 0.0 OUTLIER -87.68 -11.83 47.18 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.095 -0.957 . . . . 10.0 110.353 179.298 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -133.08 106.86 7.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.028 -178.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.26 -31.67 70.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.698 -0.683 . . . . 10.0 112.357 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -61.42 -35.58 77.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.696 0.284 . . . . 10.0 110.493 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 15.6 m -66.5 -32.69 74.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.475 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . 0.439 ' CE1' ' HA ' ' B' ' 130' ' ' ALA . 51.5 t80 -68.64 -39.08 80.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.55 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -76.67 -25.76 54.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.259 0.552 . . . . 10.0 110.621 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -68.63 -17.64 64.15 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.841 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . 0.736 HD11 ' HB3' ' B' ' 82' ' ' PHE . 34.2 mm -57.92 -39.53 72.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.742 179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 67.0 t60 -67.5 -37.5 82.93 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.61 -0.515 . . . . 10.0 109.61 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -63.45 -36.09 82.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.577 -0.738 . . . . 10.0 110.022 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . 0.483 ' CD1' ' HB ' ' B' ' 9' ' ' VAL . 1.1 m-85 -80.01 -40.41 27.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.435 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' B' ' 97' ' ' ARG . 1.9 ttm180 -56.65 -45.25 81.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.558 -0.292 . . . . 10.0 111.177 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 63.1 mm-40 -64.35 -38.76 92.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.906 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -62.71 -42.49 99.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.0 -0.545 . . . . 10.0 109.718 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . 0.594 HD11 HG21 ' B' ' 9' ' ' VAL . 57.9 mt -66.26 -47.47 84.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.757 179.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . 0.886 ' HG2' ' HA ' ' B' ' 107' ' ' GLU . 49.6 mtpt -57.15 -41.38 79.02 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.86 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 55.4 ttp85 -68.45 -46.55 69.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.909 -0.587 . . . . 10.0 112.313 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 35.1 m -68.27 -30.78 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.177 0 N-CA-C 112.551 0.575 . . . . 10.0 112.551 -179.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -87.15 -9.34 55.51 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 121.152 -0.219 . . . . 10.0 111.14 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 5.9 t70 63.06 29.91 16.27 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 123.803 0.69 . . . . 10.0 111.25 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 53.1 m -163.48 145.08 9.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.486 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . 0.886 ' HA ' ' HG2' ' B' ' 101' ' ' LYS . 0.0 OUTLIER -90.29 -11.34 41.1 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.541 0.686 . . . . 10.0 109.271 178.574 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -91.24 72.63 6.22 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.794 -1.094 . . . . 10.0 109.532 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.455 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 58.6 t -123.09 133.43 24.51 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.361 -179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 26.8 Cg_exo -63.0 107.89 0.69 Allowed 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.819 2.346 . . . . 10.0 111.555 179.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 54.4 mtt -127.0 153.15 46.29 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.118 -0.492 . . . . 10.0 109.91 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . 0.705 ' HB ' HD23 ' B' ' 79' ' ' LEU . 92.6 t -134.11 132.57 55.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 109.307 -0.627 . . . . 10.0 109.307 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 20.1 tp -85.89 117.94 25.06 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . 0.491 ' HB ' HG22 ' B' ' 81' ' ' VAL . 23.2 t -114.52 117.88 56.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.972 0.415 . . . . 10.0 111.496 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -101.14 110.51 3.9 Favored Glycine 0 N--CA 1.45 -0.407 0 N-CA-C 110.517 -1.033 . . . . 10.0 110.517 178.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -97.75 166.38 11.51 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.031 0.382 . . . . 10.0 112.031 -178.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 36.8 mttm 72.55 35.05 1.17 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 123.702 0.801 . . . . 10.0 112.187 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . 0.769 ' HA ' HD11 ' B' ' 84' ' ' ILE . 31.7 p -71.47 -13.36 61.79 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.064 0.394 . . . . 10.0 112.064 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -88.99 2.53 53.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.967 0.413 . . . . 10.0 111.172 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 38.0 mt -98.07 137.51 20.86 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.044 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -74.73 -14.14 21.9 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.768 2.312 . . . . 10.0 111.899 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . 0.415 ' O ' ' HA ' ' B' ' 85' ' ' ASN . 0.6 OUTLIER -79.25 37.25 0.32 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.295 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -71.21 110.43 5.86 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.378 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.58 -18.22 14.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.063 179.136 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 40.4 t -105.68 113.9 43.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 115.658 -0.701 . . . . 10.0 109.543 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -76.39 152.43 36.28 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.662 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.5 -44.05 93.19 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.768 -0.651 . . . . 10.0 112.401 -179.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 8.4 tmtm? -61.25 -40.1 92.8 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.946 0.403 . . . . 10.0 110.908 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -63.45 -44.48 94.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.683 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . 0.439 ' HA ' ' CE1' ' B' ' 90' ' ' PHE . . . -66.63 -44.93 80.68 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.236 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -62.35 -36.16 81.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.748 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.47 -47.87 80.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.778 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 18.9 tp -63.96 -41.84 97.45 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.501 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.69 -47.1 86.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.436 179.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -62.95 -34.96 78.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.977 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 14.7 m -66.55 -25.75 66.81 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.213 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 16.2 m-30 -99.69 -4.73 30.16 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.473 -0.331 . . . . 10.0 111.481 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 71.53 33.24 64.01 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 111.624 -0.59 . . . . 10.0 111.624 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 48.8 pt -123.54 147.71 53.69 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-O 120.574 0.226 . . . . 10.0 110.813 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . 0.437 ' HG2' HG22 ' B' ' 112' ' ' VAL . 59.2 Cg_endo -73.07 151.92 50.45 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.625 2.216 . . . . 10.0 111.714 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -114.2 127.16 55.77 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.766 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 34.4 mm -125.14 122.05 62.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.082 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -90.89 124.37 35.13 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.595 -0.891 . . . . 10.0 108.595 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . 0.476 ' HA ' ' O ' ' B' ' 150' ' ' GLN . 44.6 p -130.34 172.66 11.6 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 122.105 0.955 . . . . 10.0 113.373 -177.094 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . 0.431 ' HB2' ' SG ' ' B' ' 118' ' ' CYS . 6.0 t -160.99 117.08 2.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.045 -1.434 . . . . 10.0 107.341 178.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.57 -17.87 62.91 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.769 0.319 . . . . 10.0 111.244 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 70.5 tttt -84.0 -44.61 13.98 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.209 0.448 . . . . 10.0 112.209 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 36.6 p -93.8 -13.69 27.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.735 0.302 . . . . 10.0 111.317 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 18.6 ttt-85 67.49 44.98 1.64 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.078 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . 0.476 ' O ' ' HA ' ' B' ' 144' ' ' THR . 21.6 tt0 -85.33 103.24 14.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.486 -0.779 . . . . 10.0 111.592 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 58.9 37.23 90.62 Favored Glycine 0 CA--C 1.519 0.285 0 CA-C-N 115.889 -0.596 . . . . 10.0 114.306 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 70.4 t -66.25 -54.52 25.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.911 0.386 . . . . 10.0 110.711 -179.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.45 -32.38 71.28 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -58.17 -42.62 86.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.85 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.89 -48.19 82.29 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.966 0.412 . . . . 10.0 110.64 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -65.17 -43.15 92.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.808 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 16.0 m-30 -60.71 -41.89 96.15 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.419 179.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 32.8 m -58.93 -38.16 78.34 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.501 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.929 HD22 ' HG ' ' B' ' 79' ' ' LEU . 24.2 tp -62.4 -46.11 90.08 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.047 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . 0.727 HG11 HD13 ' B' ' 46' ' ' ILE . 43.2 t -64.04 -39.35 85.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.987 -0.552 . . . . 10.0 109.571 178.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -63.53 -29.96 71.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.705 -0.679 . . . . 10.0 110.683 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -77.97 -43.72 28.84 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.208 178.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . 0.426 HD11 ' HA3' ' B' ' 77' ' ' GLY . 93.2 mt -60.17 -45.32 96.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.475 179.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -59.48 -48.12 82.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.356 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -66.39 -36.13 82.07 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.966 0.412 . . . . 10.0 110.821 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -63.04 -44.19 96.58 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.524 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -71.77 -39.41 69.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.604 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -57.55 -40.75 79.58 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.259 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -59.93 -36.04 76.21 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.936 -0.574 . . . . 10.0 112.165 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 25.3 mmt -90.44 -22.96 21.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.87 0.367 . . . . 10.0 111.556 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 31.4 t . . . . . 0 C--N 1.326 -0.436 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.968 -179.586 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.285 0 N-CA-C 111.503 -0.639 . . . . 10.0 111.503 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.01 136.73 52.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.737 0.303 . . . . 10.0 111.404 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 20.9 t -122.57 142.07 40.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.977 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 811' ' ' LYS . . . . . 0.656 ' HG2' HG22 ' D' ' 821' ' ' VAL . 70.1 mttt -93.92 125.78 38.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.033 0.444 . . . . 10.0 111.641 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 59.4 t -99.47 118.22 45.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.082 -0.71 . . . . 10.0 109.082 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 813' ' ' TYR . . . . . 0.437 ' HB2' HG22 ' D' ' 876' ' ' ILE . 83.9 m-85 -91.84 113.79 26.16 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.173 0.511 . . . . 10.0 111.185 -179.004 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 814' ' ' LEU . . . . . 0.68 HD13 ' HD2' ' D' ' 841' ' ' ARG . 23.6 mt -81.04 150.39 68.46 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.329 -0.851 . . . . 10.0 110.94 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 815' ' ' PRO . . . . . 0.721 ' HD3' ' HB ' ' D' ' 877' ' ' VAL . 37.3 Cg_endo -65.24 -7.41 15.6 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.178 2.585 . . . . 10.0 113.295 -179.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -90.28 17.22 7.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.986 0.422 . . . . 10.0 110.618 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 53.8 tttt 66.23 45.03 2.38 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 115.429 -0.805 . . . . 10.0 111.72 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 818' ' ' GLN . . . . . 0.558 ' HB3' ' HB2' ' B' ' 39' ' ' SER . 54.5 mt-30 -146.33 175.48 10.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.608 179.248 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.33 167.76 23.51 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.894 0.702 . . . . 10.0 112.894 -178.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 2.6 t -147.63 145.26 28.9 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.101 -0.954 . . . . 10.0 108.833 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 821' ' ' VAL . . . . . 0.656 HG22 ' HG2' ' D' ' 811' ' ' LYS . 21.9 t -101.1 115.25 42.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.963 0.411 . . . . 10.0 111.328 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 24.1 t -110.66 141.54 25.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.449 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 1.2 m -80.84 128.13 33.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 42.5 t -66.28 127.86 28.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.735 0.302 . . . . 10.0 110.477 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 825' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' D' ' 825' ' ' ARG . 0.6 OUTLIER -118.91 127.4 53.45 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.983 0.42 . . . . 10.0 110.881 179.909 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -77.05 74.6 3.63 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.675 -0.693 . . . . 10.0 112.349 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 165.41 -40.18 0.28 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.506 -0.854 . . . . 10.0 112.769 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 10.5 ptm -75.22 154.85 37.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.041 0.448 . . . . 10.0 111.738 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 829' ' ' SER . . . . . 0.58 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.5 OUTLIER -98.81 169.4 9.49 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.164 -179.473 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 87.6 t -57.95 -42.92 83.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.515 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 831' ' ' TYR . . . . . 0.732 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 83.0 t80 -56.03 -34.72 66.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.828 -0.624 . . . . 10.0 111.321 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -77.27 -49.39 15.16 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.306 -0.406 . . . . 10.0 111.133 -179.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 3.4 m -63.39 -40.79 98.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.396 -0.366 . . . . 10.0 111.626 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -71.58 -24.11 61.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.536 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -63.8 -32.55 74.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.037 0.446 . . . . 10.0 110.274 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 14.0 tttm -72.47 -6.42 43.62 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.552 -0.749 . . . . 10.0 111.282 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 837' ' ' ALA . . . . . 0.439 ' HB1' HD21 ' D' ' 814' ' ' LEU . . . -117.73 -46.77 2.64 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.967 0.413 . . . . 10.0 111.49 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 838' ' ' LEU . . . . . 0.427 HD12 ' HG3' ' D' ' 845' ' ' GLN . 74.8 mt -65.73 -43.92 87.56 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.819 0.674 . . . . 10.0 112.819 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -67.75 -21.24 65.28 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.131 0.419 . . . . 10.0 112.131 -179.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 50.5 t -75.54 -23.67 16.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.042 0.449 . . . . 10.0 110.583 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 841' ' ' ARG . . . . . 0.68 ' HD2' HD13 ' D' ' 814' ' ' LEU . 5.6 mtt-85 -106.55 -6.9 17.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.628 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 85.1 40.22 8.11 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.786 -0.721 . . . . 10.0 112.633 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 76.1 mt -114.68 129.04 56.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.791 0.329 . . . . 10.0 110.65 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -90.53 134.61 34.25 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.052 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 845' ' ' GLN . . . . . 0.427 ' HG3' HD12 ' D' ' 838' ' ' LEU . 14.7 mp0 -57.61 -34.25 69.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.965 -0.562 . . . . 10.0 112.096 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -72.01 -5.6 36.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.137 0.494 . . . . 10.0 111.565 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 3.6 m -126.04 25.43 6.75 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.081 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 64.3 m -145.31 165.22 29.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.01 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 11.4 p -143.66 145.86 21.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.886 -0.412 . . . . 10.0 109.886 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 850' ' ' VAL . . . . . 0.45 HG22 HG22 ' D' ' 877' ' ' VAL . 60.2 t -114.43 135.75 53.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.9 0.381 . . . . 10.0 110.944 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 851' ' ' TYR . . . . . 0.725 ' HB2' HG13 ' D' ' 876' ' ' ILE . 78.4 m-85 -118.69 141.35 48.69 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.194 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 852' ' ' ARG . . . . . 0.539 ' HD3' HD11 ' D' ' 870' ' ' LEU . 34.3 mtm180 -94.08 121.9 36.04 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.136 -0.69 . . . . 10.0 109.136 178.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 853' ' ' LEU . . . . . 0.502 ' HB3' ' HB2' ' D' ' 874' ' ' GLU . 1.1 tm? -84.19 113.67 21.25 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.113 -179.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 15.9 mt -111.07 72.96 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.685 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 96.1 mttt 66.43 9.09 6.22 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.998 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 147.28 -42.44 0.9 Allowed Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 121.109 -0.567 . . . . 10.0 111.848 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 7.3 mmt180 -69.74 139.94 53.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.737 0.303 . . . . 10.0 111.27 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -108.86 120.75 43.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.366 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 6.9 m -115.31 132.0 56.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.864 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 860' ' ' VAL . . . . . 0.575 HG22 ' HE1' ' D' ' 851' ' ' TYR . 11.5 t -65.73 137.78 24.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.646 -0.252 . . . . 10.0 111.052 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -124.5 149.3 47.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.528 -0.306 . . . . 10.0 110.268 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -92.74 163.99 13.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.83 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 863' ' ' TRP . . . . . 0.732 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 88.2 m95 -80.35 -34.44 36.52 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.237 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -72.36 -10.66 60.07 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.677 0.621 . . . . 10.0 112.677 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 2.7 m -68.01 148.61 50.79 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 110.032 -0.358 . . . . 10.0 110.032 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 866' ' ' ALA . . . . . 0.58 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -80.22 152.46 29.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.506 0.193 . . . . 10.0 110.7 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 6.0 tp -89.76 -4.92 10.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.241 0.543 . . . . 10.0 110.871 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -56.99 -50.99 85.03 Favored Pre-proline 0 CA--C 1.539 0.543 0 N-CA-C 113.342 0.867 . . . . 10.0 113.342 -179.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -76.61 6.02 4.37 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 121.912 1.741 . . . . 10.0 113.171 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 870' ' ' LEU . . . . . 0.539 HD11 ' HD3' ' D' ' 852' ' ' ARG . 3.4 mm? -90.75 47.03 1.37 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.218 0.532 . . . . 10.0 111.151 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -93.33 108.35 20.02 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.464 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 90.83 -0.23 76.17 Favored Glycine 0 CA--C 1.517 0.193 0 C-N-CA 121.069 -0.586 . . . . 10.0 113.617 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 873' ' ' GLU . . . . . 0.464 ' OE1' ' HD2' ' D' ' 852' ' ' ARG . 5.4 mt-10 -98.73 134.88 41.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.861 0.331 . . . . 10.0 111.286 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 874' ' ' GLU . . . . . 0.502 ' HB2' ' HB3' ' D' ' 853' ' ' LEU . 51.7 mt-10 -83.85 139.92 32.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 10.0 109.937 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 96.1 mt -114.13 118.2 33.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.109 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 876' ' ' ILE . . . . . 0.725 HG13 ' HB2' ' D' ' 851' ' ' TYR . 1.3 pt -111.69 120.36 61.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.385 179.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 877' ' ' VAL . . . . . 0.721 ' HB ' ' HD3' ' D' ' 815' ' ' PRO . 6.1 t -97.64 142.8 13.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.333 -178.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -125.26 160.04 30.22 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.547 178.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 80.8 t -93.79 132.46 37.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 116.258 -0.428 . . . . 10.0 109.999 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 44.6 mt . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.377 -0.82 . . . . 10.0 109.589 179.158 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 20.8 mt . . . . . 0 C--O 1.217 -0.626 0 CA-C-O 120.265 0.079 . . . . 10.0 110.845 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -70.69 -39.9 73.23 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.962 -0.384 . . . . 10.0 109.962 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . 0.405 HE21 ' HB3' ' A' ' 241' ' ' GLN . 6.3 tt0 -59.6 -40.8 88.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.623 179.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . 0.492 ' HB3' HH21 ' C' ' 532' ' ' ARG . 35.2 mt-10 -81.67 -30.83 32.54 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.327 -0.851 . . . . 10.0 110.236 179.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 49.7 ttm -64.6 -44.87 89.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.489 -0.323 . . . . 10.0 110.868 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 13.1 p -62.87 -45.27 93.33 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.863 -0.792 . . . . 10.0 108.863 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . 0.404 ' O ' ' HG3' ' A' ' 249' ' ' GLU . 15.1 mttm -60.43 -55.19 36.52 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.487 -0.779 . . . . 10.0 109.881 178.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -56.43 -45.96 80.51 Favored 'General case' 0 C--O 1.225 -0.222 0 O-C-N 123.652 0.595 . . . . 10.0 110.753 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 24.2 mt -60.35 -45.34 93.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.766 -0.197 . . . . 10.0 111.029 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 71.1 mt-10 -66.16 -41.8 89.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.63 0.252 . . . . 10.0 110.433 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 245' ' ' LYS . 88.2 mt-10 -64.39 -43.76 93.44 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.67 -0.493 . . . . 10.0 109.67 178.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . 0.562 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 35.5 t -65.31 -44.16 94.9 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.641 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.256 179.102 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . 0.472 ' O ' ' HG3' ' A' ' 255' ' ' GLN . 92.3 mttt -62.49 -48.21 80.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.041 0.448 . . . . 10.0 111.062 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.58 -41.87 98.33 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.178 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -77.18 -28.26 53.95 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 111.676 0.25 . . . . 10.0 111.676 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.587 HG22 ' HG ' ' A' ' 258' ' ' LEU . 0.4 OUTLIER -71.43 -20.14 20.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 C-N-CA 121.186 -0.206 . . . . 10.0 110.73 179.778 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . 0.472 ' HG3' ' O ' ' A' ' 251' ' ' LYS . 22.3 mt-30 -59.36 -61.07 8.59 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.505 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -65.23 -28.62 55.72 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.515 1.477 . . . . 10.0 111.059 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . 0.44 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 7.9 m-30 -64.04 -58.25 7.25 Favored 'General case' 0 C--O 1.231 0.091 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . 0.587 ' HG ' HG22 ' A' ' 254' ' ' VAL . 80.8 mt -65.45 -37.51 87.11 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.731 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -62.47 -44.89 95.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.917 0.389 . . . . 10.0 110.192 179.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . 0.898 ' HA ' ' HE2' ' A' ' 263' ' ' LYS . 10.9 t0 -64.3 -52.21 59.63 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.077 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . 0.529 ' HZ ' ' HG ' ' C' ' 514' ' ' LEU . 18.5 m-85 -62.02 -29.05 70.02 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.81 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . 0.513 ' HB2' ' O ' ' A' ' 258' ' ' LEU . 7.1 tt0 -66.44 -49.13 67.74 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . 0.898 ' HE2' ' HA ' ' A' ' 260' ' ' ASP . 23.9 mtmt -63.05 -44.94 94.48 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.824 -0.626 . . . . 10.0 109.336 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.453 ' CE ' ' HB1' ' C' ' 509' ' ' ALA . 13.9 mptt -58.26 -50.16 74.57 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.604 -0.726 . . . . 10.0 109.724 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . 0.497 ' HB2' ' O ' ' A' ' 261' ' ' PHE . 0.0 OUTLIER -61.41 -39.35 90.44 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.618 179.714 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . 0.42 HE21 ' HB3' ' A' ' 266' ' ' GLN . 8.0 mt-30 -60.8 -47.62 85.49 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 178.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -63.88 -42.07 97.58 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . 0.456 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 35.8 mt-10 -58.99 -49.2 78.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.393 178.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 99.7 mmm -67.23 -40.08 86.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.464 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -60.7 -49.68 76.55 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 110.003 -0.369 . . . . 10.0 110.003 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 66.1 mt -64.84 -35.49 81.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.844 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . 0.702 ' HD2' HH22 ' C' ' 506' ' ' ARG . 0.3 OUTLIER -64.73 -42.52 95.17 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.206 178.978 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . 0.648 ' HA ' HG12 ' A' ' 276' ' ' VAL . 15.1 mtt85 -74.25 -38.66 63.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.84 0.352 . . . . 10.0 110.788 179.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -65.83 -26.23 67.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.367 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.796 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 93.6 mttt -95.2 -37.51 11.01 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.862 179.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . 0.648 HG12 ' HA ' ' A' ' 273' ' ' ARG . 2.2 p -62.22 -24.86 36.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 C-N-CA 121.31 -0.156 . . . . 10.0 111.355 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . 0.508 ' HB3' ' CD ' ' A' ' 278' ' ' PRO . 5.0 tp10 -62.93 -62.47 5.6 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 178.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . 0.508 ' CD ' ' HB3' ' A' ' 277' ' ' GLU . 18.5 Cg_endo -63.86 -31.54 67.54 Favored 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 121.694 1.596 . . . . 10.0 111.068 177.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.796 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 40.8 mt -65.09 -37.05 86.25 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 18.9 mtt180 -67.81 -34.88 77.61 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 178.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -67.74 -40.39 84.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.346 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 85.9 mt-10 -61.43 -47.93 83.47 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 108.89 -0.781 . . . . 10.0 108.89 178.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 48.6 mt -65.1 -38.71 91.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.335 -0.848 . . . . 10.0 110.537 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -66.57 -59.44 3.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.327 -0.397 . . . . 10.0 111.099 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -61.49 -37.85 85.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.048 0.451 . . . . 10.0 110.223 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -64.59 -49.0 66.98 Favored Glycine 0 N--CA 1.441 -0.996 0 N-CA-C 110.755 -0.938 . . . . 10.0 110.755 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.33 -35.11 79.81 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 110.249 -0.278 . . . . 10.0 110.249 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . 0.595 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 54.8 mtt180 -57.37 -45.7 84.14 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.794 -0.447 . . . . 10.0 109.794 178.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -71.04 -49.04 49.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.09 178.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -55.4 -43.2 75.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.724 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 64.0 mt -74.0 -39.28 63.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.891 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . 0.595 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 2.1 t-80 -60.99 -47.87 84.45 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 120.936 0.398 . . . . 10.0 109.936 179.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.87 -39.32 94.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.623 -0.717 . . . . 10.0 109.959 179.07 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 26.7 mt -67.37 -42.77 82.89 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.751 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -64.54 -43.73 93.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.763 0.316 . . . . 10.0 110.48 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.7 -3.94 21.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.257 0.551 . . . . 10.0 110.702 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -108.08 -34.67 6.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.484 -0.78 . . . . 10.0 109.125 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 57.7 mt -64.3 -31.34 72.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.22 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . 0.498 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 2.6 m -68.27 -62.41 3.14 Favored Pre-proline 0 CA--C 1.54 0.564 0 CA-C-N 116.602 -0.272 . . . . 10.0 111.431 179.208 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . 0.498 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 35.1 Cg_endo -65.04 -50.98 1.79 Allowed 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 121.853 1.702 . . . . 10.0 112.229 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.688 ' HB3' ' HE2' ' C' ' 473' ' ' LYS . 92.0 mt -65.85 -25.55 67.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.767 0.318 . . . . 10.0 110.87 -179.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -76.74 -48.55 8.69 Favored Glycine 0 N--CA 1.443 -0.848 0 N-CA-C 110.49 -1.044 . . . . 10.0 110.49 178.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -64.06 -42.3 97.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.394 0.14 . . . . 10.0 110.776 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . 0.44 ' O ' ' HG2' ' A' ' 308' ' ' ARG . 15.9 mt-10 -64.09 -35.59 81.26 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.977 0.418 . . . . 10.0 110.158 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 27.0 ttt -68.11 -39.41 82.81 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . 0.463 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 66.4 mtt180 -67.32 -36.74 82.08 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 178.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . 0.553 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 7.9 t0 -65.05 -44.44 89.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.841 -0.618 . . . . 10.0 109.391 178.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . 0.997 ' HG3' HD21 ' C' ' 469' ' ' LEU . 13.4 mmt180 -66.28 -37.92 86.58 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 177.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -62.85 -35.02 78.59 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 115.488 -0.778 . . . . 10.0 109.649 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . 0.553 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 77.9 mtt180 -59.85 -45.64 91.79 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.771 -0.826 . . . . 10.0 108.771 178.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -69.59 -42.45 74.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.853 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . 0.659 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 2.8 m-70 -54.39 -53.23 56.78 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.826 -0.624 . . . . 10.0 109.723 179.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 95.6 t -70.37 -41.7 78.48 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.36 0 CA-C-N 115.389 -0.823 . . . . 10.0 111.538 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -58.61 -53.89 53.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.625 0.25 . . . . 10.0 111.17 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -60.32 -33.83 72.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.265 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 8.9 mt -72.89 -40.71 65.34 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.928 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.7 ttm105 -62.7 -51.55 66.75 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.548 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 3.6 m -67.15 -13.4 61.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.237 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -96.15 -43.63 7.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.85 0.357 . . . . 10.0 110.127 178.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 57.6 mt -64.63 -33.56 76.21 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.21 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . 0.428 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -54.52 -60.96 6.39 Favored Pre-proline 0 CA--C 1.534 0.328 0 O-C-N 123.149 0.281 . . . . 10.0 111.352 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . 0.428 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 36.6 Cg_endo -68.62 -34.84 18.4 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 121.599 1.532 . . . . 10.0 110.69 178.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . 0.477 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 4.0 m-30 -57.31 -50.05 74.17 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.227 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 8.4 p -64.69 -36.71 85.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.529 -0.305 . . . . 10.0 110.801 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . 0.602 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 1.0 OUTLIER -68.89 -39.96 79.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.139 0.495 . . . . 10.0 109.977 179.117 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . 0.418 ' O ' ' HB3' ' A' ' 329' ' ' GLN . 35.8 mt-10 -67.27 -34.4 77.35 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.032 -0.729 . . . . 10.0 109.032 177.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 63.8 mt -68.09 -33.02 73.75 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 108.708 -0.849 . . . . 10.0 108.708 177.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . 0.602 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 84.7 mtt180 -67.4 -39.31 85.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.167 -1.049 . . . . 10.0 108.167 177.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . 0.418 ' HB3' ' O ' ' A' ' 326' ' ' GLU . 5.7 tt0 -61.04 -42.15 97.93 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.895 -1.15 . . . . 10.0 107.895 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . 0.649 HH12 HG23 ' C' ' 448' ' ' VAL . 57.8 mtt180 -63.07 -53.95 45.66 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.391 -0.822 . . . . 10.0 109.08 178.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 98.3 mt -53.3 -42.74 66.94 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.851 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . 0.643 ' O ' ' HB2' ' A' ' 336' ' ' GLU . . . -60.69 -45.32 94.64 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.239 -0.437 . . . . 10.0 109.949 178.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -68.99 -46.58 67.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.37 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . 0.633 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 4.3 mmt85 -60.92 -52.73 63.8 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.505 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 339' ' ' LYS . 83.9 mt -63.15 -34.92 78.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.993 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . 0.643 ' HB2' ' O ' ' A' ' 332' ' ' ALA . 0.3 OUTLIER -64.82 -44.32 90.23 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.221 -0.659 . . . . 10.0 109.221 178.83 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.12 -39.78 94.77 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.401 -0.963 . . . . 10.0 108.401 178.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 70.2 mt -66.68 -22.55 66.08 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.971 178.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 335' ' ' LEU . 91.2 mttt -75.38 -48.13 24.37 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.017 -0.734 . . . . 10.0 109.017 178.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -68.93 -47.75 64.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.637 -0.71 . . . . 10.0 109.829 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . 0.791 HD21 ' HA ' ' C' ' 433' ' ' GLU . 47.9 t-20 -65.85 -49.76 67.0 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.627 179.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.85 -37.76 94.86 Favored Glycine 0 C--N 1.33 0.227 0 CA-C-N 115.929 -0.578 . . . . 10.0 112.445 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.38 -46.21 94.75 Favored Glycine 0 N--CA 1.449 -0.457 0 N-CA-C 110.829 -0.908 . . . . 10.0 110.829 178.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -70.3 -37.33 74.76 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . 0.665 ' HA ' HD21 ' C' ' 429' ' ' ASN . 19.0 mtt180 -57.46 -58.72 7.05 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.269 179.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . 0.563 ' O ' ' HB2' ' A' ' 350' ' ' HIS . 92.7 mt -58.3 -39.82 80.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.565 -179.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -64.9 -49.21 71.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.768 0.318 . . . . 10.0 110.323 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -64.94 -43.73 91.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.182 -0.463 . . . . 10.0 111.209 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 22.7 m-30 -63.53 -39.69 95.09 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.922 -0.399 . . . . 10.0 109.922 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . 0.563 ' HB2' ' O ' ' A' ' 346' ' ' LEU . 0.6 OUTLIER -64.92 -44.17 90.42 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.705 178.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -59.25 -44.73 92.38 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.256 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . 0.452 ' HD3' ' HA ' ' C' ' 422' ' ' VAL . 16.4 mtmm -68.33 -27.14 66.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.525 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.23 -43.48 73.95 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 178.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.47 -45.19 94.62 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -63.36 -38.46 91.25 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.888 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . 0.425 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 5.2 m-70 -66.91 -35.61 80.39 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.142 178.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 78.4 mt -71.21 -39.87 71.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.192 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 68.7 m -62.78 -44.55 95.89 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 178.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 4.4 p -76.16 -16.57 59.84 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.417 179.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 356' ' ' HIS . 0.5 OUTLIER -76.18 -35.41 59.15 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 107.488 -1.301 . . . . 10.0 107.488 177.411 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 29.1 m -67.71 -25.32 65.6 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -72.36 -2.4 19.12 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.21 -0.904 . . . . 10.0 109.923 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.416 ' O ' ' HB3' ' A' ' 367' ' ' ALA . 31.2 mttp -123.16 -42.31 2.27 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 178.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -63.28 -22.25 66.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.535 -0.757 . . . . 10.0 111.429 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.899 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 96.6 mttt -102.12 -67.91 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.454 0 C-N-CA 120.819 -0.352 . . . . 10.0 111.544 179.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.899 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 21.9 Cg_exo -65.52 -55.36 0.45 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 122.268 1.979 . . . . 10.0 113.316 -178.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -60.89 -38.85 87.11 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.285 0.476 . . . . 10.0 112.285 -179.075 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 368' ' ' LEU . 3.0 mt -67.03 -42.25 85.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.776 0.322 . . . . 10.0 110.478 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . 1.059 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 2.7 mt-10 -69.19 -29.85 67.92 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.746 -0.464 . . . . 10.0 109.746 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -69.98 -44.42 69.47 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 178.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.72 -46.85 88.8 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.385 -0.825 . . . . 10.0 109.634 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 52.5 mtt85 -65.62 -36.69 84.44 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 1.059 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.7 mt-30 -63.08 -30.52 71.66 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.546 -0.752 . . . . 20.0 111.297 179.237 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -86.44 -36.09 9.99 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 109.149 -1.58 . . . . 10.0 109.149 178.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 17.6 mt -58.09 -40.31 80.82 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.011 0.374 . . . . 10.0 112.011 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 83.4 mt -55.4 -62.92 3.63 Favored Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 112.069 0.396 . . . . 10.0 112.069 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -63.19 -32.49 73.98 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 121.969 1.78 . . . . 10.0 111.564 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 6.5 t -63.45 -44.79 99.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 N-CA-C 109.916 -0.401 . . . . 10.0 109.916 178.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 33.7 mt -60.92 -35.63 77.19 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.438 -0.578 . . . . 10.0 109.438 178.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -62.86 -52.03 64.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.874 178.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.2 -38.11 85.38 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.611 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -67.97 -43.12 79.73 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.707 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -62.0 -48.42 80.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.486 -0.325 . . . . 10.0 110.538 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 75.8 t -57.51 -42.77 81.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.467 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 5.3 p -74.82 -55.03 6.24 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.174 0.435 . . . . 10.0 112.174 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -60.53 -44.53 95.97 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.311 0.856 . . . . 10.0 113.311 -178.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.484 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 56.8 mt -61.29 -41.98 97.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.689 0.281 . . . . 10.0 111.335 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 93.5 p -79.12 -26.12 42.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.329 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -65.92 -39.99 91.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 95.4 mt -61.85 -35.14 77.4 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.945 -0.571 . . . . 10.0 109.953 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 37.9 mt-10 -68.1 -42.4 80.37 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.55 -0.907 . . . . 10.0 108.55 178.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . 0.601 ' HA ' ' HD2' ' A' ' 395' ' ' LYS . 0.4 OUTLIER -61.7 -40.37 94.78 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.545 -0.752 . . . . 10.0 111.085 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -63.63 -51.82 63.54 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.493 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 4.8 m -58.63 -30.58 67.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.725 -0.671 . . . . 10.0 111.452 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . 0.601 ' HD2' ' HA ' ' A' ' 392' ' ' GLU . 93.1 mttt . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.601 -0.272 . . . . 10.0 111.684 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 55.9 mt . . . . . 0 CA--C 1.529 0.16 0 CA-C-O 121.185 0.517 . . . . 10.0 111.515 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.12 -37.99 84.83 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.011 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.87 -38.83 61.82 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.387 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . 0.453 ' O ' HG23 ' C' ' 408' ' ' VAL . 14.7 t-20 -57.56 -41.63 81.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.318 -0.856 . . . . 10.0 109.013 178.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -64.67 -33.99 77.23 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 115.415 -0.811 . . . . 10.0 111.847 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.68 -50.06 75.3 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.893 0.378 . . . . 10.0 110.21 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 1.2 m -63.79 -34.79 78.7 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.579 -0.526 . . . . 10.0 109.579 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . 0.453 HG23 ' O ' ' C' ' 404' ' ' ASN . 50.6 t -64.82 -41.38 92.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.003 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 2.8 m -61.05 -46.55 90.23 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 42.3 m -60.55 -38.33 84.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.86 178.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 91.5 m -63.15 -44.99 93.99 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.093 -0.503 . . . . 10.0 109.889 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . 0.453 ' O ' ' HG3' ' C' ' 416' ' ' ARG . 4.0 m-85 -64.72 -41.41 96.0 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.389 178.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 15.0 m -62.84 -44.34 96.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.019 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -66.88 -26.72 67.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.231 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 30.5 mt -70.86 -38.05 73.12 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 178.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' C' ' 412' ' ' PHE . 86.9 mtt180 -66.96 -40.11 87.41 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 108.751 -0.833 . . . . 10.0 108.751 178.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -65.16 -23.52 67.14 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 115.421 -0.809 . . . . 10.0 110.379 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -82.57 -48.25 11.2 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.57 -0.9 . . . . 10.0 108.57 177.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 84.6 mt -52.88 -35.05 57.33 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.203 -0.908 . . . . 10.0 112.151 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' C' ' 424' ' ' GLN . . . -52.94 -77.67 0.13 Allowed Glycine 0 CA--C 1.52 0.352 0 N-CA-C 111.84 -0.504 . . . . 10.0 111.84 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -56.94 -32.6 93.16 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.807 2.338 . . . . 10.0 111.742 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . 0.452 ' HA ' ' HD3' ' A' ' 352' ' ' LYS . 5.6 t -60.0 -50.21 81.02 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.226 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.925 179.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 21.4 p -70.78 -36.43 73.04 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.499 0.19 . . . . 10.0 110.901 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' C' ' 420' ' ' GLY . 29.8 mt-30 -57.82 -48.78 78.74 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.566 -0.531 . . . . 10.0 109.566 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . 0.422 ' OE1' ' HG3' ' A' ' 352' ' ' LYS . 97.2 mt-10 -76.33 -29.73 57.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.669 -0.696 . . . . 10.0 110.543 179.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . 0.44 ' HB2' ' O ' ' C' ' 422' ' ' VAL . 32.7 t80 -66.3 -46.99 75.05 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.824 0.345 . . . . 10.0 110.14 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . 0.531 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 47.3 m0 -64.86 -37.5 87.82 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 179.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.39 -34.19 75.6 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.574 178.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . 0.665 HD21 ' HA ' ' A' ' 345' ' ' ARG . 20.0 t-20 -68.95 -39.35 79.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.761 -1.2 . . . . 10.0 107.761 177.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . 0.65 ' HA ' ' HB2' ' C' ' 433' ' ' GLU . 69.1 mt -66.33 -25.9 67.05 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.251 -0.886 . . . . 10.0 110.287 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 35.5 mm-40 -63.0 -53.33 55.61 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.874 -0.787 . . . . 10.0 108.874 178.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -66.87 -31.52 72.17 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . 0.791 ' HA ' HD21 ' A' ' 341' ' ' ASN . 0.8 OUTLIER -64.0 -53.81 44.16 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.56 -0.745 . . . . 10.0 110.614 179.148 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 9.5 p -69.87 -40.27 75.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.855 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -67.0 -44.54 80.1 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.639 0.257 . . . . 10.0 110.726 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -61.8 -48.6 82.93 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 110.117 -1.193 . . . . 10.0 110.117 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 16.9 mt -61.16 -34.51 75.15 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 110.017 -0.364 . . . . 10.0 110.017 178.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 20.9 mtt85 -65.97 -43.28 88.31 Favored 'General case' 0 C--O 1.22 -0.454 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 178.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . 0.487 ' O ' ' HE2' ' C' ' 443' ' ' LYS . 28.8 mt-30 -62.92 -33.82 76.13 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-O 121.328 0.585 . . . . 10.0 109.678 178.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . 0.633 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 52.4 mt-10 -74.43 -59.6 2.65 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.09 178.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 75.1 mtm -62.36 -27.9 69.39 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 114.538 1.31 . . . . 10.0 114.538 -177.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 25.4 p -57.52 -59.07 5.72 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.259 0.552 . . . . 10.0 110.144 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . 0.487 ' HE2' ' O ' ' C' ' 439' ' ' GLN . 21.6 pttt -74.04 -31.27 62.82 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.334 179.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . 0.579 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 0.4 OUTLIER -61.38 -43.28 99.13 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.286 -0.415 . . . . 10.0 110.577 179.759 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . 0.441 ' HA ' ' HB ' ' C' ' 448' ' ' VAL . 81.2 mt -76.46 -42.23 44.5 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.418 -0.355 . . . . 10.0 111.311 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -62.62 -40.6 97.47 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.095 0.474 . . . . 10.0 110.055 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.11 -30.43 62.32 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.961 -0.755 . . . . 10.0 108.961 178.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . 0.649 HG23 HH12 ' A' ' 330' ' ' ARG . 1.2 t -57.83 -43.89 85.16 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 CA-C-N 116.068 -0.514 . . . . 10.0 109.819 178.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -67.35 -40.51 85.85 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -69.69 -10.19 57.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.099 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . 0.603 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 0.0 OUTLIER -104.62 -39.72 6.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.15 179.14 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 50.4 t -70.13 -36.4 67.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.797 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -55.08 -61.5 5.8 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 116.778 -0.192 . . . . 10.0 111.429 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.51 -26.37 40.42 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 121.823 1.682 . . . . 10.0 111.502 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . 0.603 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.1 OUTLIER -69.33 -47.93 62.93 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.796 -0.446 . . . . 10.0 109.796 179.342 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' C' ' 456' ' ' LEU . 17.5 mt -67.42 -32.22 72.96 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.29 -0.633 . . . . 10.0 109.29 178.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -67.11 -47.88 69.82 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.114 -0.699 . . . . 10.0 109.114 178.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . 0.584 ' HA ' ' HE2' ' C' ' 461' ' ' LYS . 41.3 t0 -66.81 -41.11 88.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.962 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -64.9 -40.09 94.54 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.931 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -62.94 -43.51 98.6 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . 0.584 ' HE2' ' HA ' ' C' ' 458' ' ' ASP . 27.5 mtmt -63.13 -46.39 87.47 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 15.5 mtmm -64.65 -36.97 85.98 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.221 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 36.1 t90 -66.33 -37.23 84.87 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.899 -0.778 . . . . 10.0 108.899 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -64.68 -45.17 87.8 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.536 -0.912 . . . . 10.0 108.536 177.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 0.804 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 45.6 mt-10 -61.2 -42.76 99.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.653 178.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . 0.861 ' OE1' HD12 ' C' ' 469' ' ' LEU . 0.4 OUTLIER -67.19 -39.51 86.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.968 -0.56 . . . . 10.0 109.877 178.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.11 -43.46 98.36 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 108.989 -0.745 . . . . 10.0 108.989 178.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -63.71 -45.11 91.47 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.133 -1.062 . . . . 10.0 108.133 177.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 0.997 HD21 ' HG3' ' A' ' 308' ' ' ARG . 96.5 mt -56.09 -45.11 79.53 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 115.35 -0.841 . . . . 20.0 109.782 177.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 15.4 m-30 -64.89 -41.82 95.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.521 179.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 59.6 mtt180 -66.57 -44.67 81.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.977 0.418 . . . . 10.0 111.174 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -78.0 -2.94 39.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.043 -0.526 . . . . 10.0 112.188 -179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . 0.688 ' HE2' ' HB3' ' A' ' 301' ' ' LEU . 62.5 mttt -116.08 -63.2 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.518 0.199 . . . . 10.0 111.29 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 66.1 t -57.54 -43.23 82.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.292 0.849 . . . . 10.0 113.292 -178.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.26 -59.74 12.84 Favored Pre-proline 0 CA--C 1.533 0.308 0 N-CA-C 112.34 0.496 . . . . 10.0 112.34 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -65.38 -29.99 53.69 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 121.835 1.69 . . . . 10.0 111.264 178.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 12.5 mt -67.44 -40.75 85.46 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . 0.553 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 67.3 ttt180 -63.48 -34.78 78.53 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 109.222 -0.658 . . . . 10.0 109.222 178.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -68.49 -47.29 67.42 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.22 -45.17 94.53 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.857 -0.611 . . . . 10.0 109.589 178.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 62.9 mt -67.39 -33.08 74.46 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.633 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . 0.553 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 5.7 tt0 -66.25 -47.12 74.79 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 178.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . 0.444 ' O ' ' HG3' ' C' ' 487' ' ' GLN . 42.1 mm-40 -66.67 -41.91 87.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.615 178.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.22 -39.24 97.67 Favored Glycine 0 N--CA 1.447 -0.586 0 N-CA-C 110.842 -0.903 . . . . 10.0 110.842 178.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.04 -36.74 78.04 Favored 'General case' 0 C--O 1.219 -0.507 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 178.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 64.3 mtt180 -64.52 -39.67 94.21 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.34 -0.615 . . . . 10.0 109.34 178.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' C' ' 483' ' ' GLU . 45.7 mt-30 -67.67 -43.85 79.25 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' C' ' 491' ' ' GLU . 78.9 tttt -65.64 -31.87 73.13 Favored 'General case' 0 C--O 1.226 -0.149 0 CA-C-N 115.725 -0.67 . . . . 10.0 109.599 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 21.1 mt -66.66 -41.32 88.39 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 108.626 -0.879 . . . . 10.0 108.626 177.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . 0.522 ' HA ' ' OE1' ' C' ' 493' ' ' GLN . 17.1 m-70 -64.12 -39.48 94.12 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 108.298 -1.001 . . . . 10.0 108.298 178.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . 0.558 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 39.9 mt-10 -60.9 -53.6 55.32 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.248 -1.019 . . . . 10.0 108.248 177.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 82.3 mt -57.81 -38.4 75.47 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 115.358 -0.837 . . . . 10.0 111.466 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . 0.522 ' OE1' ' HA ' ' C' ' 490' ' ' HIS . 69.2 mt-30 -61.07 -37.53 83.01 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.886 0.374 . . . . 10.0 110.298 179.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -81.56 -17.06 49.68 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.603 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.611 ' HG2' HD22 ' A' ' 279' ' ' LEU . 10.5 mtmm -103.64 6.37 37.06 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.685 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 32.6 mt -124.93 -44.08 1.95 Allowed 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 112.093 0.405 . . . . 10.0 112.093 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . 0.803 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 10.3 m -66.93 -62.32 3.92 Favored Pre-proline 0 CA--C 1.539 0.534 0 N-CA-C 112.215 0.45 . . . . 10.0 112.215 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . 0.803 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 21.8 Cg_exo -67.18 -21.36 48.57 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 122.158 1.905 . . . . 10.0 111.89 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' C' ' 499' ' ' LEU . 12.6 mt -87.1 -41.75 13.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.939 179.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.49 -45.09 94.15 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 111.446 -0.662 . . . . 10.0 111.446 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -64.48 -32.56 74.24 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 121.239 0.543 . . . . 10.0 109.846 178.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . 0.458 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 38.6 tt0 -73.02 -40.24 65.34 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.443 178.253 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . 0.59 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 87.2 mmm -60.46 -34.69 74.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 10.0 109.652 178.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -70.76 -34.3 71.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.1 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -71.38 -36.81 71.55 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.025 -1.102 . . . . 10.0 108.025 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.702 HH22 ' HD2' ' A' ' 272' ' ' TYR . 54.8 mtt180 -62.53 -38.38 89.75 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 107.836 -1.172 . . . . 10.0 107.836 177.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -64.05 -35.48 80.88 Favored 'General case' 0 C--O 1.226 -0.138 0 CA-C-N 115.65 -0.704 . . . . 10.0 109.994 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . 0.513 ' O ' ' HB3' ' C' ' 512' ' ' ASP . 75.2 mtt180 -64.16 -32.8 74.51 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.715 -0.846 . . . . 10.0 108.715 178.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . 0.453 ' HB1' ' CE ' ' A' ' 264' ' ' LYS . . . -96.57 13.12 29.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.118 -0.946 . . . . 10.0 110.909 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -128.74 -67.56 0.79 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.29 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 47.7 t -69.01 -49.76 59.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.626 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.582 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 12.0 t70 -66.75 -34.18 77.26 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.919 0.39 . . . . 10.0 110.36 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -68.31 -39.31 82.04 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.116 -1.068 . . . . 10.0 108.116 177.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . 0.529 ' HG ' ' HZ ' ' A' ' 261' ' ' PHE . 11.3 mt -67.48 -24.69 65.62 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.452 -0.794 . . . . 10.0 110.366 178.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . 0.582 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 89.8 mtt180 -58.75 -51.59 69.3 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.05 -0.722 . . . . 10.0 109.05 178.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.3 9.87 4.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.417 0.627 . . . . 10.0 110.901 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . 0.497 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 49.7 m170 -113.89 -39.16 4.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.146 -0.479 . . . . 10.0 109.874 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 95.0 mt -89.39 -30.75 18.13 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.582 -0.736 . . . . 10.0 111.714 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . 0.427 ' N ' ' HD2' ' C' ' 520' ' ' PRO . . . -58.11 -54.63 53.68 Favored Pre-proline 0 CA--C 1.531 0.222 0 C-N-CA 121.235 -0.186 . . . . 10.0 110.739 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . 0.427 ' HD2' ' N ' ' C' ' 519' ' ' ALA . 33.3 Cg_endo -67.47 -32.03 32.75 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 121.31 1.34 . . . . 10.0 110.048 177.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -62.8 -46.08 89.63 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.933 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . 0.409 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 3.8 p -68.33 -33.52 74.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.015 0.436 . . . . 10.0 110.084 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -66.18 -45.5 80.63 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 178.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -65.84 -36.4 83.35 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 178.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 19.0 mt -60.81 -39.39 88.79 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.405 178.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' C' ' 522' ' ' SER . 54.7 mtt85 -63.54 -38.46 91.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.179 178.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -62.78 -46.7 86.81 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.449 -0.945 . . . . 10.0 108.449 178.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 48.2 mtt180 -63.16 -41.89 99.34 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 114.896 -1.047 . . . . 10.0 109.77 178.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 76.7 mt -65.24 -41.69 94.09 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.456 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -59.26 -49.63 77.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.227 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -61.7 -47.92 83.13 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.723 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . 0.492 HH21 ' HB3' ' A' ' 242' ' ' GLU . 1.5 mtt180 -64.6 -42.19 95.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.484 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 26.3 mt -64.36 -43.11 95.58 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 120.64 0.257 . . . . 10.0 110.34 179.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -63.42 -40.32 96.87 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.949 -0.389 . . . . 10.0 109.949 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.17 -41.21 99.19 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.955 -0.757 . . . . 10.0 108.955 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 96.1 mt -69.97 -19.63 63.35 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.681 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -87.46 -41.0 13.85 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 178.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.99 -51.64 52.52 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.722 -0.844 . . . . 10.0 108.722 178.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -70.66 -34.06 71.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.393 -0.821 . . . . 10.0 108.822 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.18 -45.66 85.22 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.956 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.02 -41.11 99.65 Favored Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 110.237 -1.145 . . . . 10.0 110.237 178.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.45 92.58 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 109.327 -0.62 . . . . 10.0 109.327 178.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 74.4 mtt180 -64.72 -38.52 91.27 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.952 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 85.9 mt -61.12 -41.7 97.18 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.555 -0.535 . . . . 10.0 109.555 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -68.34 -43.36 77.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.419 178.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -61.0 -47.53 86.04 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.052 179.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 15.7 m-30 -61.28 -43.56 98.67 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.399 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -59.67 -46.82 87.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.508 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -63.01 -54.86 31.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.564 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -58.63 -39.62 81.01 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.973 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.18 -41.4 90.34 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 116.491 -0.322 . . . . 10.0 110.466 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 47.2 m -62.39 -45.29 93.82 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -64.21 -29.7 70.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.317 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -79.48 -46.68 16.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.33 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 56.2 mt -60.04 -40.7 90.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.52 -0.309 . . . . 10.0 111.144 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 4.8 p -65.6 -47.79 74.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.867 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 12.3 p -68.83 -32.21 71.74 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.881 -0.328 . . . . 10.0 110.808 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 25.4 mt -63.84 -44.87 91.88 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.576 -0.527 . . . . 10.0 109.576 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . 0.475 ' O ' ' HG3' ' C' ' 563' ' ' LYS . 2.4 p -71.84 -34.82 69.6 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.777 -0.453 . . . . 10.0 109.777 178.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 74.4 mt-10 -63.74 -24.16 67.66 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.686 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 48.1 mttp -97.91 -31.39 12.21 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.141 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -63.84 -39.01 93.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.696 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . 0.475 ' HG3' ' O ' ' C' ' 559' ' ' SER . 91.8 mttt -56.03 -61.86 5.72 Favored Pre-proline 0 CA--C 1.534 0.327 0 CA-C-N 116.42 -0.354 . . . . 10.0 111.44 179.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . 0.467 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 30.7 Cg_endo -65.65 -35.48 37.28 Favored 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 121.822 1.681 . . . . 10.0 111.736 179.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.8 82.69 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 121.145 -0.222 . . . . 10.0 110.814 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 57.3 mt -64.82 -41.61 95.63 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.204 -0.295 . . . . 10.0 110.204 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . 0.958 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 88.1 mt-10 -64.17 -44.14 92.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.662 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -67.88 -41.1 83.34 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.374 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 33.5 mt -58.79 -49.46 77.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.238 -0.437 . . . . 10.0 109.826 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . 0.427 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 59.2 mtt180 -65.85 -38.89 90.06 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.731 -0.47 . . . . 10.0 109.731 178.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . 0.958 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.5 mt-30 -61.51 -40.21 93.8 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.665 -0.698 . . . . 20.0 111.974 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -78.44 -37.31 27.89 Favored Glycine 0 CA--C 1.521 0.445 0 N-CA-C 109.927 -1.269 . . . . 10.0 109.927 179.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 18.8 mt -54.87 -37.21 65.99 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 112.021 0.378 . . . . 10.0 112.021 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . 0.551 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 53.4 mt -56.27 -66.02 1.32 Allowed Pre-proline 0 CA--C 1.538 0.484 0 N-CA-C 112.419 0.526 . . . . 10.0 112.419 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . 0.551 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 43.1 Cg_endo -68.72 -32.82 22.75 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 121.578 1.519 . . . . 10.0 112.11 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 15.4 t -65.27 -49.18 80.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.751 -0.204 . . . . 10.0 111.034 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 46.1 mt -65.2 -36.87 85.53 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 110.14 -0.319 . . . . 10.0 110.14 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . 0.523 ' O ' HG23 ' C' ' 582' ' ' VAL . 55.0 mm-40 -66.24 -46.37 77.38 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 110.091 -0.337 . . . . 10.0 110.091 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 44.0 m -62.15 -43.12 99.54 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.968 0.414 . . . . 10.0 109.986 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . 0.42 ' HD1' ' HA ' ' C' ' 580' ' ' PHE . 5.3 m-30 -65.51 -37.37 86.58 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.903 -0.59 . . . . 10.0 109.564 178.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -60.82 -41.21 95.26 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . 0.523 HG23 ' O ' ' C' ' 578' ' ' GLU . 95.2 t -61.65 -39.9 84.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.115 -0.698 . . . . 10.0 109.115 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 13.4 m -68.92 -36.94 78.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.238 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -70.32 -43.2 70.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.733 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 98.6 mt -61.55 -45.94 92.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.12 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 2.9 p -65.63 -40.94 93.09 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.69 -0.485 . . . . 10.0 109.69 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -60.46 -53.11 61.49 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 115.76 -0.655 . . . . 10.0 110.632 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.3 mt -56.09 -45.13 79.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.868 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -68.91 -39.63 79.57 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.665 0.617 . . . . 10.0 112.665 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -70.93 -41.1 71.61 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.993 0.425 . . . . 10.0 110.814 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . 0.438 ' HE1' ' HB3' ' A' ' 392' ' ' GLU . 22.3 m-30 -64.52 -39.66 94.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.759 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.38 -25.9 67.77 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.947 0.351 . . . . 10.0 111.947 -179.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -72.95 -39.21 66.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.12 0.486 . . . . 10.0 110.191 179.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -77.03 -26.48 53.74 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.872 -0.604 . . . . 10.0 110.634 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 83.4 mt -95.82 46.8 1.09 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.05 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.428 -0.796 . . . . 10.0 109.665 -179.968 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 7.1 t . . . . . 0 C--O 1.236 0.372 0 CA-C-O 121.716 0.769 . . . . 10.0 110.295 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -108.87 137.53 46.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.341 -0.845 . . . . 10.0 109.639 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -125.84 157.33 37.87 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.809 0.338 . . . . 10.0 111.386 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 mmtm -114.77 112.57 23.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.707 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.635 HD22 HD23 ' B' ' 159' ' ' LEU . 25.8 mt -108.65 117.28 33.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.971 0.415 . . . . 10.0 110.841 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 39.8 t -107.42 119.34 56.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.131 0.491 . . . . 10.0 110.724 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 21.6 t -90.63 121.1 40.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.545 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 18.3 m -114.91 165.27 10.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.917 0.389 . . . . 10.0 110.952 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 144.92 163.82 10.28 Favored Glycine 0 N--CA 1.445 -0.7 0 N-CA-C 110.8 -0.92 . . . . 10.0 110.8 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.53 176.1 7.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.293 0.568 . . . . 10.0 111.893 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.64 123.61 6.16 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.915 -0.659 . . . . 10.0 111.963 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 121.23 -20.06 8.54 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.627 -0.797 . . . . 10.0 112.12 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 34.2 m -65.2 -36.43 77.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.795 0.331 . . . . 10.0 111.58 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 104.7 39.26 2.39 Favored Glycine 0 CA--C 1.518 0.257 0 C-N-CA 120.598 -0.811 . . . . 10.0 113.596 179.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -59.73 -51.98 67.45 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.943 0.401 . . . . 10.0 111.267 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -60.04 -36.3 76.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.895 -0.593 . . . . 10.0 111.895 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.92 -50.99 68.65 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.691 0.282 . . . . 10.0 110.745 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 72.0 mt -59.72 -36.83 77.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.456 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . 0.495 HG23 HG21 ' B' ' 55' ' ' ILE . 29.2 m -68.79 -51.05 45.13 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.291 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 97.6 mt -63.11 -32.0 54.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-O 120.816 0.341 . . . . 10.0 110.977 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.454 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 38.0 tp60 -64.45 -30.34 71.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.533 179.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 23.8 tp -85.35 -30.71 23.46 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.114 0.483 . . . . 10.0 110.474 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 43.2 mm -73.13 -59.36 3.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.954 -0.567 . . . . 10.0 112.086 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -125.1 4.92 7.9 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 113.179 0.807 . . . . 10.0 113.179 -178.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.454 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 54.6 t30 58.27 51.43 8.45 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.293 0.568 . . . . 10.0 111.198 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 40.6 t60 -129.39 120.9 26.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.839 -0.618 . . . . 10.0 110.089 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -84.29 118.26 24.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.414 -0.357 . . . . 10.0 110.64 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 10.1 m -77.39 141.57 15.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.541 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -105.74 -24.02 12.6 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.258 0.551 . . . . 10.0 109.948 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 3.4 pm0 -86.43 140.36 30.06 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.28 -0.873 . . . . 10.0 111.054 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -85.49 68.73 10.54 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.395 0.617 . . . . 10.0 109.814 178.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . 0.517 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 0.7 OUTLIER -71.3 138.02 84.12 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.724 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . 0.517 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 13.4 Cg_exo -72.25 -178.37 3.22 Favored 'Trans proline' 0 N--CA 1.463 -0.303 0 C-N-CA 123.158 2.572 . . . . 10.0 111.706 179.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.2 m -166.71 137.39 3.26 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.443 -0.344 . . . . 10.0 110.711 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 76.8 mt -123.01 -52.91 2.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 107.817 -1.179 . . . . 10.0 107.817 177.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -148.1 115.06 6.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.079 -0.964 . . . . 10.0 109.001 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . 0.716 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 23.9 m-20 -132.66 133.61 43.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.093 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 2.0 p -120.96 122.27 39.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.987 0.423 . . . . 10.0 111.796 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . 0.405 ' CE2' ' HB3' ' B' ' 38' ' ' ASP . 71.3 m-85 -122.49 155.52 36.02 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . 0.454 ' HB2' ' NE2' ' D' ' 818' ' ' GLN . 2.5 ttt180 -153.97 141.05 19.39 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.814 0.34 . . . . 10.0 111.21 -178.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -158.48 155.98 29.47 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.726 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -105.24 131.28 52.91 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.529 -0.545 . . . . 10.0 109.529 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 15.7 m -139.02 158.22 29.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.685 0.279 . . . . 10.0 111.104 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 54.6 t -92.43 100.62 11.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.047 -0.723 . . . . 10.0 109.047 178.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 39.1 mt -88.86 104.67 15.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.683 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 58.67 12.77 2.32 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.95 1.093 . . . . 10.0 113.95 178.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 132.45 -33.13 2.71 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.414 -0.898 . . . . 10.0 113.087 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -101.38 134.87 43.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.639 0.257 . . . . 10.0 110.703 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 5.6 t -81.61 140.86 34.19 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 71.3 m -147.09 158.59 43.99 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.833 0.349 . . . . 10.0 111.328 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.04 122.46 40.06 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 82.9 mt -111.87 120.98 43.78 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.541 0.571 . . . . 10.0 112.541 -178.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.88 113.19 24.79 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 107.697 -1.224 . . . . 10.0 107.697 177.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.495 HG21 HG23 ' B' ' 20' ' ' THR . 12.4 mt -101.5 127.05 55.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 120.811 0.338 . . . . 10.0 110.934 -178.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.6 tp -109.04 113.87 27.12 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.861 -0.609 . . . . 10.0 111.737 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.716 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 10.0 t70 -90.85 101.56 14.32 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.89 -0.781 . . . . 10.0 108.89 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 38.0 p -80.95 165.05 22.11 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 112.912 0.708 . . . . 10.0 112.912 -178.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.36 156.83 33.42 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.473 -0.785 . . . . 10.0 111.392 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -79.83 -55.82 3.48 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.786 -0.721 . . . . 10.0 111.969 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -120.32 127.82 52.7 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.762 -0.458 . . . . 20.0 109.762 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.565 ' OE1' ' HD2' ' B' ' 68' ' ' ARG . 27.7 tt0 -163.02 168.33 21.18 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.697 -0.483 . . . . 10.0 109.697 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . 0.537 ' HB3' ' H ' ' B' ' 64' ' ' TYR . 3.6 mm-40 -105.37 -136.96 0.36 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.586 -0.279 . . . . 10.0 110.943 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . 0.537 ' H ' ' HB3' ' B' ' 63' ' ' GLU . 48.1 t80 -103.47 90.11 3.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.1 0.476 . . . . 10.0 110.97 -179.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 3.1 m -101.4 139.39 37.13 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.702 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.11 -37.78 88.55 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.006 0.431 . . . . 10.0 111.183 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 39.4 ttp -64.76 -35.77 82.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.036 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.61 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 22.6 ttt85 -66.5 -51.53 55.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.545 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.33 -38.99 72.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.876 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 3.0 tp60 -58.53 -56.09 26.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.64 -0.709 . . . . 10.0 112.255 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . 0.61 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 1.7 p90 -67.28 -15.74 63.87 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 113.594 0.961 . . . . 10.0 113.594 -178.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . 0.559 ' HB3' HG21 ' B' ' 103' ' ' VAL . 86.2 mtp -80.16 -18.31 50.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.773 0.321 . . . . 10.0 111.197 179.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 4.1 mtt-85 -75.15 -29.75 60.57 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.864 0.364 . . . . 10.0 110.715 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.59 -0.39 37.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.853 -0.612 . . . . 10.0 112.468 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -84.92 127.56 8.24 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.331 -0.937 . . . . 10.0 112.44 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -86.93 -42.28 13.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.218 0.532 . . . . 10.0 109.823 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -130.32 144.45 15.75 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 110.538 -1.025 . . . . 10.0 110.538 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -122.64 129.26 51.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.046 0.451 . . . . 10.0 111.861 -178.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.855 ' HG ' HD22 ' B' ' 159' ' ' LEU . 78.7 mt -96.88 108.82 21.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.549 -0.751 . . . . 10.0 109.886 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 19.3 m -85.47 91.08 8.12 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.027 -0.36 . . . . 10.0 110.027 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 47.4 t -89.6 121.61 39.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.542 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.639 ' HB3' HD11 ' B' ' 93' ' ' ILE . 20.1 p90 -130.51 152.1 50.26 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.661 -0.7 . . . . 10.0 109.882 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -91.67 125.97 36.59 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.976 -0.379 . . . . 10.0 109.976 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . 0.848 HD11 ' HA ' ' B' ' 118' ' ' CYS . 43.8 pt -70.44 -8.06 10.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.2 0.524 . . . . 10.0 111.16 -179.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . 0.499 HD21 ' HB3' ' B' ' 117' ' ' LYS . 0.0 OUTLIER -101.43 5.56 42.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.104 179.572 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -132.07 106.81 8.24 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.402 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . 0.484 ' O ' ' HG3' ' B' ' 91' ' ' GLU . 0.2 OUTLIER -59.2 -39.52 82.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.906 -0.588 . . . . 10.0 112.479 -179.085 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -59.1 -36.06 74.5 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.778 0.288 . . . . 10.0 111.778 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 21.1 m -64.71 -36.53 84.59 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.001 0.429 . . . . 10.0 110.6 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -70.94 -34.43 71.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.682 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' B' ' 87' ' ' THR . 30.5 mt-10 -79.31 -25.78 42.34 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.97 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . 0.472 ' O ' ' HB3' ' B' ' 95' ' ' HIS . 0.3 OUTLIER -80.75 -2.64 47.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.495 -179.22 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . 0.639 HD11 ' HB3' ' B' ' 82' ' ' PHE . 29.5 mm -58.58 -42.36 84.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.728 0.299 . . . . 10.0 111.104 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 17.2 t60 -68.4 -26.62 65.64 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.986 0.422 . . . . 10.0 110.366 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . 0.472 ' HB3' ' O ' ' B' ' 92' ' ' ASP . 9.9 t-160 -66.08 -40.8 91.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.685 -0.689 . . . . 10.0 109.803 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -71.7 -44.27 64.48 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.408 -0.96 . . . . 10.0 108.408 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -51.84 -53.47 39.95 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.967 -1.015 . . . . 10.0 111.691 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -64.76 -37.18 86.72 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.126 0.417 . . . . 10.0 112.126 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . 0.411 ' O ' HG13 ' B' ' 103' ' ' VAL . 35.2 tt0 -61.97 -49.72 74.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.019 -0.363 . . . . 10.0 110.019 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . 0.555 ' HA ' HG22 ' B' ' 103' ' ' VAL . 42.1 mt -62.81 -42.15 95.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 10.0 111.018 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . 0.714 ' HE2' ' HG3' ' B' ' 107' ' ' GLU . 9.1 mtpm? -60.29 -32.86 71.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.545 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 49.2 ttp85 -80.69 -40.14 25.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.938 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.559 HG21 ' HB3' ' B' ' 72' ' ' MET . 18.8 m -69.16 -26.34 31.73 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 112.469 0.544 . . . . 10.0 112.469 -179.186 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -98.86 -14.09 19.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.761 0.315 . . . . 10.0 110.868 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 11.4 t70 59.47 39.48 21.8 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.146 -178.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 19.6 m -155.16 139.37 16.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.458 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . 0.714 ' HG3' ' HE2' ' B' ' 101' ' ' LYS . 7.2 mp0 -85.74 -13.07 49.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.651 0.739 . . . . 10.0 109.46 178.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -102.06 86.03 2.79 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.934 -1.03 . . . . 10.0 110.177 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 55.9 t -130.82 131.84 23.53 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.014 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -64.24 112.13 1.81 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.866 2.378 . . . . 10.0 111.824 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . 0.432 ' HB2' HG21 ' B' ' 139' ' ' ILE . 57.5 mtt -130.54 149.61 52.13 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.126 -0.488 . . . . 10.0 109.746 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . 0.526 ' HB ' HD23 ' B' ' 79' ' ' LEU . 99.4 t -130.97 128.03 61.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.772 -0.455 . . . . 10.0 109.772 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 17.1 tp -82.91 119.56 24.57 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.557 -0.535 . . . . 10.0 109.557 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 51.2 t -117.26 117.03 53.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 120.963 0.411 . . . . 10.0 111.48 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -98.79 115.14 5.22 Favored Glycine 0 N--CA 1.45 -0.388 0 N-CA-C 110.304 -1.118 . . . . 10.0 110.304 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -103.04 164.18 11.77 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 117.204 0.502 . . . . 10.0 112.147 -178.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . 0.499 ' HB3' HD21 ' B' ' 85' ' ' ASN . 13.6 mtmt 69.44 41.68 1.26 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.108 -0.951 . . . . 10.0 113.112 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . 0.848 ' HA ' HD11 ' B' ' 84' ' ' ILE . 15.4 p -81.04 -12.49 59.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.21 0.529 . . . . 10.0 110.266 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -76.47 -12.19 60.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.388 -0.824 . . . . 10.0 110.945 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 31.6 mt -95.17 136.86 22.35 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.143 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -72.84 3.54 4.33 Favored 'Trans proline' 0 CA--C 1.53 0.295 0 C-N-CA 122.623 2.216 . . . . 10.0 112.904 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.26 32.56 0.69 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.858 0.361 . . . . 10.0 111.147 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . 0.643 ' HG3' HD12 ' B' ' 84' ' ' ILE . 24.6 ttm-85 -64.4 105.1 0.87 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.899 0.381 . . . . 10.0 111.557 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.5 m -94.12 -40.86 9.83 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.297 0.57 . . . . 10.0 109.661 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 45.7 t -86.7 122.84 39.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.566 -0.743 . . . . 10.0 109.577 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.9 150.14 42.85 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.986 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.38 -35.99 77.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.444 -179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -69.47 -33.99 73.71 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.62 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -62.43 -47.53 83.65 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.046 0.45 . . . . 10.0 110.151 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.33 94.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.741 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -63.2 -44.49 95.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.439 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -62.96 -42.22 99.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.987 0.422 . . . . 10.0 111.221 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 37.1 tp -66.2 -43.88 85.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.046 0.451 . . . . 10.0 110.276 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.22 -43.54 97.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.618 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -61.34 -35.53 77.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.683 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.0 m -67.27 -33.95 76.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.875 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -83.41 -19.84 35.25 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.231 0.539 . . . . 10.0 110.194 178.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.21 30.46 25.25 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 111.03 -0.828 . . . . 10.0 111.03 -179.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . 0.432 HG21 ' HB2' ' B' ' 111' ' ' MET . 48.7 pt -123.37 151.63 63.09 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.763 -0.218 . . . . 10.0 110.74 -179.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.36 156.96 33.07 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.384 2.056 . . . . 10.0 112.059 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -122.73 129.84 52.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.512 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 33.2 mm -125.97 125.59 68.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.142 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -87.32 124.41 33.33 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.208 -1.034 . . . . 10.0 108.208 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . 0.599 ' HA ' ' O ' ' B' ' 150' ' ' GLN . 40.2 p -126.82 172.94 9.95 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.577 0.955 . . . . 10.0 113.577 -177.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 26.5 t -159.79 125.16 4.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.245 -1.343 . . . . 10.0 107.615 178.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.47 -27.2 65.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.946 0.403 . . . . 10.0 111.828 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -73.79 -55.74 5.85 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.603 0.594 . . . . 10.0 112.603 -179.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 44.4 p -83.22 -14.81 52.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.641 -0.254 . . . . 10.0 111.591 -178.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 27.0 ttt180 68.32 22.88 7.86 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.622 0.725 . . . . 10.0 109.834 -178.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . 0.599 ' O ' ' HA ' ' B' ' 144' ' ' THR . 10.1 tt0 -62.05 111.45 1.94 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.907 -1.042 . . . . 10.0 111.833 -179.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 67.89 9.38 56.32 Favored Glycine 0 C--O 1.227 -0.303 0 N-CA-C 114.658 0.623 . . . . 10.0 114.658 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.68 -53.34 48.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 117.511 0.655 . . . . 10.0 111.17 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -62.01 -45.1 95.07 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.118 0.485 . . . . 10.0 110.373 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -63.48 -36.13 82.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.852 -0.613 . . . . 10.0 112.53 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.0 -47.85 81.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.908 0.385 . . . . 10.0 110.196 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -66.91 -42.02 86.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.686 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -62.99 -42.34 99.82 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.18 -0.463 . . . . 10.0 110.598 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.551 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 66.1 m -60.09 -41.4 92.4 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.807 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.855 HD22 ' HG ' ' B' ' 79' ' ' LEU . 41.0 tp -57.8 -43.65 85.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.495 -0.321 . . . . 10.0 110.222 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 46.4 t -64.78 -36.72 78.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.117 -0.492 . . . . 10.0 109.929 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . 0.551 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 67.3 mtt180 -63.25 -44.63 94.62 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.126 179.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' B' ' 158' ' ' THR . 17.0 mm-40 -64.39 -38.07 89.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.095 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . 0.509 ' O ' ' HG2' ' B' ' 167' ' ' LYS . 96.1 mt -65.02 -43.64 96.05 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.201 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -63.16 -40.33 97.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.534 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -65.5 -31.62 72.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.241 0.543 . . . . 10.0 109.653 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 20.8 t-80 -67.23 -35.65 80.03 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.913 178.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' B' ' 163' ' ' ILE . 55.1 mmtt -63.26 -48.93 76.09 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.789 -0.641 . . . . 10.0 109.623 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -61.37 -42.81 99.31 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.243 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -58.47 -46.39 86.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.943 -0.572 . . . . 10.0 110.474 179.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 16.8 ttm -67.01 -24.39 66.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.625 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 C--N 1.327 -0.376 0 CA-C-O 121.018 0.437 . . . . 10.0 110.977 179.551 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 N-CA-C 111.946 -0.462 . . . . 10.0 111.946 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 1.6 p -126.15 130.11 50.38 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.618 0.247 . . . . 10.0 110.944 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 45.7 t -117.81 128.7 74.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.154 -0.476 . . . . 10.0 109.804 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 13.3 pttp -93.34 119.35 32.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.163 0.506 . . . . 10.0 111.395 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 812' ' ' VAL . . . . . 0.572 HG11 HD11 ' D' ' 834' ' ' LEU . 35.0 t -96.62 129.11 47.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.868 -0.605 . . . . 10.0 109.465 179.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -90.71 139.25 30.9 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.062 0.458 . . . . 10.0 111.194 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 814' ' ' LEU . . . . . 0.463 HD13 ' HG3' ' D' ' 841' ' ' ARG . 68.4 mt -112.4 154.94 44.37 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.507 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.91 55.13 1.71 Allowed 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.038 2.492 . . . . 10.0 112.649 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -151.3 19.65 0.75 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.164 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 67.0 mttm 62.12 31.97 17.59 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.715 -0.675 . . . . 10.0 111.22 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 818' ' ' GLN . . . . . 0.454 ' NE2' ' HB2' ' B' ' 41' ' ' ARG . 95.2 mt-30 -141.91 173.47 11.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.254 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.48 171.02 18.73 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.793 0.33 . . . . 10.0 111.708 -179.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 9.7 t -138.12 141.49 40.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.725 -0.671 . . . . 10.0 109.357 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 47.2 t -92.33 110.84 23.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.973 0.416 . . . . 10.0 111.333 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 17.3 t -102.07 141.5 18.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.247 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.99 135.77 35.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.46 -0.337 . . . . 10.0 110.095 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 824' ' ' VAL . . . . . 0.701 HG11 ' HB2' ' D' ' 871' ' ' ASP . 57.3 t -75.14 116.3 17.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 110.231 -0.285 . . . . 10.0 110.231 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 23.6 mtp180 -129.26 109.5 11.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.995 0.426 . . . . 10.0 111.196 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -70.21 114.54 8.46 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.477 0.656 . . . . 10.0 110.186 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 147.71 -34.75 1.23 Allowed Glycine 0 N--CA 1.446 -0.65 0 N-CA-C 110.118 -1.193 . . . . 10.0 110.118 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 828' ' ' MET . . . . . 0.433 ' HB2' ' HB2' ' D' ' 832' ' ' ASP . 10.7 ptm -98.0 150.29 21.53 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.447 -0.377 . . . . 10.0 110.132 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 829' ' ' SER . . . . . 0.67 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.3 OUTLIER -94.36 176.73 6.19 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.301 -179.065 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 92.3 t -59.05 -37.29 67.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 831' ' ' TYR . . . . . 0.498 ' HA ' ' HE3' ' D' ' 863' ' ' TRP . 52.9 t80 -58.09 -49.7 76.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.497 -0.774 . . . . 10.0 110.912 179.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 832' ' ' ASP . . . . . 0.433 ' HB2' ' HB2' ' D' ' 828' ' ' MET . 3.3 m-20 -68.42 -38.36 81.15 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.08 -0.509 . . . . 10.0 112.05 -179.064 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 5.4 m -73.02 -43.45 62.06 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.814 0.672 . . . . 10.0 112.814 -178.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 834' ' ' LEU . . . . . 0.572 HD11 HG11 ' D' ' 812' ' ' VAL . 0.6 OUTLIER -79.22 -15.02 58.67 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.454 0.539 . . . . 10.0 112.454 -178.896 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -56.3 -52.44 64.52 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.056 0.391 . . . . 10.0 112.056 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 5.2 mmmm -59.55 -36.39 76.07 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.062 0.393 . . . . 10.0 112.062 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -71.34 -38.3 71.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.915 0.388 . . . . 10.0 111.294 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 838' ' ' LEU . . . . . 0.421 HD21 HG11 ' D' ' 877' ' ' VAL . 90.4 mt -75.03 -45.22 43.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.275 -0.42 . . . . 10.0 111.184 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -58.91 -37.97 77.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.019 -0.537 . . . . 10.0 112.224 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 3.2 p -71.12 -12.75 16.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 121.073 0.463 . . . . 10.0 111.407 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 841' ' ' ARG . . . . . 0.463 ' HG3' HD13 ' D' ' 814' ' ' LEU . 11.8 mmt180 -110.65 -2.0 16.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.838 0.351 . . . . 10.0 111.061 179.696 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 77.65 24.4 65.13 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.999 -0.62 . . . . 10.0 112.443 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 843' ' ' LEU . . . . . 0.478 ' HB3' ' SG ' ' D' ' 848' ' ' CYS . 93.3 mt -106.52 143.93 33.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.545 0.212 . . . . 10.0 110.481 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -109.32 159.34 17.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.259 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -78.15 62.57 2.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.791 0.329 . . . . 10.0 110.995 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -134.32 -67.16 0.59 Allowed 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.123 -0.489 . . . . 10.0 112.046 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 1.7 p -87.78 -17.05 32.47 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.229 0.537 . . . . 10.0 110.707 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 848' ' ' CYS . . . . . 0.478 ' SG ' ' HB3' ' D' ' 843' ' ' LEU . 4.6 m -83.43 128.59 34.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.982 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 5.0 p -121.35 137.94 53.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.3 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 850' ' ' VAL . . . . . 0.438 HG22 HG22 ' D' ' 877' ' ' VAL . 20.7 t -98.62 127.31 51.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.779 -179.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -108.04 135.92 48.59 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.19 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 852' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' D' ' 858' ' ' LYS . 71.6 mtp180 -87.2 169.88 11.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.002 -0.544 . . . . 10.0 109.564 178.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 853' ' ' LEU . . . . . 0.418 HD22 ' HA ' ' D' ' 853' ' ' LEU . 0.6 OUTLIER -121.42 78.65 1.45 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.461 0.648 . . . . 10.0 111.049 -179.697 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 65.8 mt -91.66 94.24 4.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.227 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 855' ' ' LYS . . . . . 0.496 ' HA ' ' HD3' ' D' ' 855' ' ' LYS . 31.5 mmtt 58.58 28.39 17.02 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.51 -0.768 . . . . 10.0 112.157 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 102.25 -19.85 47.13 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 121.042 -0.599 . . . . 10.0 112.13 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.48 111.61 19.21 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.925 0.393 . . . . 10.0 111.3 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 858' ' ' LYS . . . . . 0.652 ' HE2' HD13 ' D' ' 876' ' ' ILE . 86.6 mttt -69.95 112.9 6.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.892 178.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -110.35 134.49 52.24 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.792 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 46.1 t -68.81 123.68 22.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.661 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 861' ' ' THR . . . . . 0.463 ' HB ' ' HG3' ' D' ' 852' ' ' ARG . 1.8 t -105.22 172.8 6.6 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.184 -0.302 . . . . 10.0 110.184 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -114.34 163.59 15.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.985 0.421 . . . . 10.0 110.817 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 863' ' ' TRP . . . . . 0.498 ' HE3' ' HA ' ' D' ' 831' ' ' TYR . 78.7 m95 -82.6 -21.44 35.17 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.539 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.91 -16.58 58.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.668 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 2.9 m -69.49 138.81 53.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.647 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 866' ' ' ALA . . . . . 0.67 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -76.43 151.55 36.48 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.671 -0.492 . . . . 10.0 109.671 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 867' ' ' ILE . . . . . 0.464 ' HA ' HD23 ' D' ' 870' ' ' LEU . 7.3 tp -82.93 0.59 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 121.104 0.478 . . . . 10.0 112.155 -179.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -61.29 -56.05 37.67 Favored Pre-proline 0 CA--C 1.543 0.707 0 N-CA-C 113.67 0.989 . . . . 10.0 113.67 -179.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.44 3.77 5.03 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 121.984 1.789 . . . . 10.0 113.001 -179.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 870' ' ' LEU . . . . . 0.464 HD23 ' HA ' ' D' ' 867' ' ' ILE . 2.9 mm? -85.76 -11.99 52.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.007 0.432 . . . . 10.0 111.402 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 871' ' ' ASP . . . . . 0.701 ' HB2' HG11 ' D' ' 824' ' ' VAL . 2.9 t70 -64.09 114.97 4.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.362 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 133.77 -30.18 3.01 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.76 -0.733 . . . . 10.0 112.508 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -119.78 -167.62 1.46 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.59 0.233 . . . . 10.0 110.937 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -131.7 153.71 49.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.114 -0.493 . . . . 10.0 110.286 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 70.6 mt -114.51 144.82 42.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.716 0.294 . . . . 10.0 111.622 -178.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 876' ' ' ILE . . . . . 0.652 HD13 ' HE2' ' D' ' 858' ' ' LYS . 3.2 mp -123.7 123.7 67.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 877' ' ' VAL . . . . . 0.438 HG22 HG22 ' D' ' 850' ' ' VAL . 17.3 t -103.44 135.77 39.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 120.649 0.261 . . . . 10.0 111.009 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.79 164.89 28.43 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 45.0 t -106.21 127.06 61.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 120.67 0.271 . . . . 10.0 110.57 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 94.7 mt . . . . . 0 C--O 1.252 1.207 0 CA-C-O 118.392 -0.813 . . . . 10.0 111.088 -179.998 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 82.8 mt . . . . . 0 N--CA 1.456 -0.157 0 CA-C-O 120.873 0.368 . . . . 10.0 110.585 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . 0.716 ' HE2' HG21 ' C' ' 576' ' ' VAL . 6.1 mtpm? -64.64 -46.35 82.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.706 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . 0.401 ' HG ' ' CD1' ' A' ' 207' ' ' TRP . 1.3 tt -61.23 -36.94 81.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.92 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 75.8 mt -61.4 -44.48 97.07 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.44 -179.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.37 -39.85 38.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.284 -0.416 . . . . 10.0 111.551 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -62.48 -45.14 94.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.839 0.352 . . . . 10.0 110.532 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . 0.401 ' CD1' ' HG ' ' A' ' 203' ' ' LEU . 8.0 m95 -68.55 -26.27 65.33 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.827 179.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -65.12 -39.95 93.8 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 3.1 m -65.64 -31.72 72.9 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 109.15 -0.685 . . . . 10.0 109.15 177.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 65.6 t -66.1 -49.02 79.43 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 115.866 -0.607 . . . . 10.0 109.575 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.17 -29.21 69.46 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.905 -0.405 . . . . 10.0 109.905 178.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 50.7 m -76.95 -2.15 32.27 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.413 0.625 . . . . 10.0 110.217 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . 0.405 ' O ' ' HG ' ' A' ' 217' ' ' LEU . 81.9 m -108.19 -41.17 4.98 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 177.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -59.89 -37.74 80.26 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.234 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.3 -49.66 73.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.439 178.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 53.0 mmtt -61.36 -38.0 85.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.675 -0.693 . . . . 10.0 109.918 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 213' ' ' THR . 59.2 mt -64.81 -40.39 95.12 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.822 178.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -68.19 -36.91 80.31 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.697 -0.483 . . . . 10.0 109.697 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -70.74 -21.72 62.5 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.239 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -88.01 -48.62 7.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.537 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . 0.451 ' HA ' ' HB ' ' A' ' 224' ' ' VAL . 76.3 mt -58.1 -30.29 66.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.867 -0.606 . . . . 10.0 112.091 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -53.48 -71.32 0.71 Allowed Glycine 0 C--N 1.333 0.364 0 C-N-CA 121.053 -0.594 . . . . 10.0 111.71 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -62.21 -32.84 82.56 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.236 1.958 . . . . 10.0 111.227 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . 0.515 ' O ' ' HB2' ' A' ' 228' ' ' PHE . 4.8 t -58.35 -48.9 83.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 N-CA-C 111.732 0.271 . . . . 10.0 111.732 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 2.9 p -63.43 -35.31 80.0 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.902 -0.319 . . . . 10.0 110.589 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -69.85 -50.12 45.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.401 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -61.79 -39.88 93.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 10.0 109.919 179.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . 0.515 ' HB2' ' O ' ' A' ' 224' ' ' VAL . 0.3 OUTLIER -63.95 -45.82 87.46 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.617 178.474 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . 0.466 ' HA ' ' HB2' ' A' ' 232' ' ' LEU . 8.4 m95 -65.75 -38.91 90.39 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.262 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -58.35 -49.56 76.75 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 178.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . 0.663 ' HA ' ' HE3' ' A' ' 234' ' ' LYS . 70.9 m-20 -66.95 -37.98 85.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.41 -0.814 . . . . 10.0 109.767 179.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . 0.466 ' HB2' ' HA ' ' A' ' 229' ' ' TRP . 12.9 mt -63.84 -39.74 94.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.478 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 237' ' ' GLU . 61.2 mm-40 -62.25 -47.48 84.2 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 109.55 -0.537 . . . . 10.0 109.55 178.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . 0.663 ' HE3' ' HA ' ' A' ' 231' ' ' ASN . 25.1 mtmt -56.49 -44.99 81.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.055 0.455 . . . . 10.0 109.879 179.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -66.19 -52.36 48.83 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.713 -0.676 . . . . 10.0 111.105 179.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 24.4 p -62.88 -35.93 81.63 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.645 0.609 . . . . 10.0 112.645 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . 0.449 ' OE1' ' HA ' ' A' ' 237' ' ' GLU . 9.8 mm-40 -64.85 -44.41 89.86 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.235 -1.024 . . . . 10.0 108.235 178.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -64.57 -41.01 98.04 Favored Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 109.847 -1.301 . . . . 10.0 109.847 178.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . 0.661 HD22 H462 ' A' ' 20' ' ' PCW . 76.7 mt -62.85 -36.94 84.89 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 110.031 -0.359 . . . . 10.0 110.031 178.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -66.27 -50.33 64.06 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -58.29 -45.3 88.21 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.444 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . 0.585 ' HB3' ' NH2' ' C' ' 532' ' ' ARG . 31.2 mm-40 -63.87 -44.84 91.88 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.978 -1.01 . . . . 10.0 110.479 179.054 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . 0.458 ' HG3' ' HG ' ' A' ' 247' ' ' LEU . 0.1 OUTLIER -65.15 -27.48 68.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.908 179.336 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 24.8 m -63.03 -49.16 75.72 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 108.411 -0.959 . . . . 10.0 108.411 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -70.55 -42.42 71.17 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.142 -0.688 . . . . 10.0 109.142 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . 0.449 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.6 OUTLIER -53.29 -65.02 0.64 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.277 -0.874 . . . . 10.0 110.934 179.911 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.458 ' HG ' ' HG3' ' A' ' 243' ' ' MET . 45.2 mt -58.5 -45.97 87.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.817 -0.629 . . . . 10.0 111.972 -179.114 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -61.03 -48.25 82.62 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.947 0.351 . . . . 10.0 111.947 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -65.19 -40.83 94.75 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.116 -0.328 . . . . 10.0 110.116 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . 0.627 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 24.8 t -63.51 -42.85 97.63 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.441 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.547 179.054 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.454 ' O ' HG12 ' A' ' 254' ' ' VAL . 89.6 mttt -72.38 -43.43 63.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.829 0.347 . . . . 10.0 111.398 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.94 -34.73 78.1 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.321 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 45.4 mtpt -88.57 -25.49 22.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.398 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.627 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.5 OUTLIER -65.84 -26.22 38.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.739 0.304 . . . . 10.0 110.548 179.51 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -60.93 9.04 Favored Pre-proline 0 CA--C 1.535 0.388 0 CA-C-N 116.188 -0.46 . . . . 10.0 109.809 178.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . 0.421 ' HA ' ' HB3' ' A' ' 259' ' ' ASP . 20.1 Cg_endo -65.39 -24.41 57.34 Favored 'Trans proline' 0 C--N 1.36 1.176 0 C-N-CA 121.725 1.617 . . . . 10.0 111.059 177.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . 0.517 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 6.7 m-30 -65.53 -52.97 48.6 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 177.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 83.8 mt -66.44 -41.21 89.48 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.556 -0.747 . . . . 10.0 110.007 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . 0.447 ' O ' ' HB2' ' A' ' 263' ' ' LYS . 5.6 t70 -60.18 -43.91 95.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.065 0.459 . . . . 10.0 110.391 178.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -65.55 -47.24 76.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.278 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -65.92 -45.94 80.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.782 -0.644 . . . . 10.0 111.646 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 23.1 tt0 -64.9 -34.71 79.05 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-O 120.497 0.189 . . . . 10.0 110.537 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 259' ' ' ASP . 2.8 ttmp? -60.83 -49.57 76.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.507 0.67 . . . . 10.0 109.283 178.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.437 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 41.7 mttt -70.64 -35.11 72.74 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.342 -0.844 . . . . 10.0 110.199 179.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 9.2 t90 -62.44 -35.73 80.19 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.746 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -62.02 -46.05 90.88 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 108.827 -0.805 . . . . 10.0 108.827 178.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -62.74 -43.55 98.51 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 46.3 mt-10 -56.81 -48.9 76.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.68 179.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 81.3 mmm -71.64 -43.17 66.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.754 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -61.51 -49.94 74.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.902 -0.135 . . . . 10.0 111.113 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 86.8 mt -64.58 -36.27 83.68 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.867 -0.42 . . . . 10.0 109.867 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . 0.474 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 40.6 t80 -61.67 -50.03 74.14 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.479 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' A' ' 273' ' ' ARG . 50.3 mtt85 -67.05 -36.03 81.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.706 0.288 . . . . 10.0 110.588 179.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -61.2 -45.34 94.99 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.797 -0.638 . . . . 10.0 109.923 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.793 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 63.1 mttt -80.52 -31.65 37.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.428 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 1.4 t -53.95 -37.64 34.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 O-C-N 123.123 0.264 . . . . 10.0 111.42 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -58.96 -63.37 4.23 Favored Pre-proline 0 CA--C 1.533 0.296 0 N-CA-C 112.332 0.493 . . . . 10.0 112.332 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . 0.472 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 15.5 Cg_endo -60.68 -35.69 88.3 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 122.11 1.873 . . . . 10.0 111.601 178.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.979 HD22 ' HG2' ' C' ' 495' ' ' LYS . 16.6 mt -65.19 -41.61 94.38 Favored 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 109.931 -0.396 . . . . 10.0 109.931 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 20.4 ttm180 -67.55 -35.07 78.34 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -65.82 -44.17 86.43 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.261 178.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 83.8 mt-10 -60.46 -45.08 95.01 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 108.953 -0.758 . . . . 10.0 108.953 178.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . 0.583 ' HB3' H241 ' A' ' 3' ' ' PCW . 84.3 mt -62.71 -47.14 84.89 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.459 -0.791 . . . . 10.0 109.884 179.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -62.98 -56.71 14.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.91 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -61.92 -43.97 97.74 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.884 0.374 . . . . 10.0 110.576 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -61.98 -47.2 91.6 Favored Glycine 0 N--CA 1.444 -0.819 0 N-CA-C 110.857 -0.897 . . . . 10.0 110.857 178.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.61 -34.5 78.41 Favored 'General case' 0 C--O 1.218 -0.595 0 N-CA-C 110.187 -0.301 . . . . 10.0 110.187 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . 0.417 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 88.4 mtt180 -57.81 -44.92 86.7 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -68.83 -53.2 22.83 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.655 -0.498 . . . . 10.0 109.655 178.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 53.6 mttt -52.82 -49.74 65.07 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.668 -0.696 . . . . 10.0 111.515 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 84.1 mt -68.11 -45.48 73.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.487 -0.324 . . . . 10.0 111.355 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . 0.464 ' O ' ' HG3' ' A' ' 296' ' ' GLU . 43.8 t60 -59.84 -47.72 84.61 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.686 -0.234 . . . . 10.0 110.683 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 297' ' ' LYS . 44.3 mt-10 -63.03 -35.27 79.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.689 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 36.6 mt -70.94 -38.6 72.87 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.066 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -63.57 -35.39 80.34 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 108.65 -0.87 . . . . 10.0 108.65 177.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 292' ' ' HIS . 56.7 mt-10 -73.2 -7.44 51.45 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.081 -0.963 . . . . 10.0 110.349 178.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 293' ' ' GLU . 2.6 mmpp? -100.87 -44.28 5.82 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.757 -0.831 . . . . 10.0 108.757 178.059 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 90.7 mt -60.82 -22.85 64.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.598 -0.728 . . . . 10.0 111.267 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . 0.518 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 18.5 m -73.77 -67.09 0.45 Allowed Pre-proline 0 CA--C 1.542 0.642 0 C-N-CA 120.841 -0.344 . . . . 10.0 111.41 178.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . 0.518 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 37.3 Cg_endo -65.84 -44.59 7.61 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.04 1.827 . . . . 10.0 112.25 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.542 HD13 ' HG2' ' C' ' 473' ' ' LYS . 85.0 mt -69.89 -22.01 63.27 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.024 0.44 . . . . 10.0 110.007 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -77.99 -45.22 10.62 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 109.169 -1.573 . . . . 10.0 109.169 177.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -61.57 -41.95 98.13 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.6 -0.889 . . . . 10.0 108.6 177.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.07 -36.88 85.07 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.272 -0.876 . . . . 10.0 109.448 178.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 11.2 tpt -64.81 -46.13 83.31 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.511 -0.551 . . . . 10.0 109.511 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 27.8 mtt180 -63.52 -43.55 96.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.419 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . 0.918 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 5.1 t0 -64.19 -40.04 95.26 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.253 -0.431 . . . . 10.0 110.348 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . 1.57 ' CD ' HD11 ' C' ' 469' ' ' LEU . 5.1 mmp_? -69.55 -36.72 76.62 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.912 -0.774 . . . . 10.0 108.912 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . 0.529 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -65.39 -35.07 79.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.739 -0.664 . . . . 10.0 109.783 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . 0.918 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 86.2 mtt180 -58.37 -55.22 37.86 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 109.026 -0.731 . . . . 10.0 109.026 178.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -62.28 -39.89 94.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.613 178.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . 0.592 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 0.2 OUTLIER -56.29 -54.45 45.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.738 179.246 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . 0.449 ' O ' ' HG3' ' A' ' 317' ' ' ARG . 57.7 t -73.75 -41.77 54.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.813 -0.63 . . . . 10.0 112.24 -178.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.1 -39.15 93.84 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.998 -0.281 . . . . 10.0 111.309 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -68.21 -28.73 67.5 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 108.569 -0.9 . . . . 10.0 108.569 177.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 16.5 mt -73.86 -37.17 64.84 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-N 115.428 -0.806 . . . . 10.0 108.889 178.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.449 ' HG3' ' O ' ' A' ' 313' ' ' VAL . 74.9 mtt180 -61.58 -49.37 76.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.933 0.397 . . . . 10.0 110.163 179.23 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -69.18 -10.35 57.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.818 -0.628 . . . . 10.0 112.063 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 17.5 m80 -106.31 -50.49 3.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.652 -0.249 . . . . 10.0 111.372 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 82.8 mt -63.12 -38.57 91.71 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.539 0.57 . . . . 10.0 112.539 -179.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.19 -60.24 9.54 Favored Pre-proline 0 CA--C 1.534 0.345 0 C-N-CA 121.206 -0.198 . . . . 10.0 111.292 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -66.43 -32.73 39.72 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 121.444 1.429 . . . . 10.0 111.239 178.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . 0.418 ' O ' ' HB2' ' A' ' 327' ' ' LEU . 5.2 m-30 -60.6 -48.66 80.78 Favored 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 110.333 -0.247 . . . . 10.0 110.333 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . 0.49 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 25.4 p -69.97 -35.05 74.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.859 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . 0.643 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 37.0 t70 -67.04 -46.83 73.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.935 0.398 . . . . 10.0 110.161 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -67.77 -30.21 69.61 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.066 -0.716 . . . . 10.0 109.066 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 323' ' ' TYR . 1.0 OUTLIER -67.66 -29.61 68.95 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 108.952 -0.759 . . . . 10.0 108.952 178.01 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . 0.643 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 75.8 mtt180 -64.96 -38.45 91.02 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 108.611 -0.885 . . . . 10.0 108.611 178.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -69.12 -40.76 78.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.111 178.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . 0.53 ' NH2' ' HB3' ' C' ' 447' ' ' GLU . 13.5 ttm180 -65.17 -44.99 86.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.652 -0.704 . . . . 10.0 109.391 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 48.5 mt -65.12 -34.32 78.12 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.826 -0.624 . . . . 10.0 109.572 178.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -63.93 -43.07 96.99 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -64.2 -42.73 96.52 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.076 -0.713 . . . . 10.0 109.076 178.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . 0.558 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 6.7 mmt180 -61.28 -52.35 65.1 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.593 -0.73 . . . . 10.0 109.285 178.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 43.7 mt -61.51 -37.74 84.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.543 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -61.17 -48.86 79.61 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.42 -43.12 95.34 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.929 -0.578 . . . . 10.0 109.916 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 334' ' ' ARG . 69.5 mt -63.09 -32.61 74.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 10.0 111.274 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -76.46 -46.39 27.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.662 0.268 . . . . 10.0 110.507 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -65.48 -48.99 70.71 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.128 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . 0.427 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 3.8 m-20 -65.68 -38.04 88.16 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . 0.576 ' HA2' ' HD2' ' A' ' 345' ' ' ARG . . . -60.34 -42.98 99.06 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.472 -0.785 . . . . 10.0 111.544 179.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.75 -37.88 93.08 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 110.731 -0.948 . . . . 10.0 110.731 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -73.16 -44.82 59.41 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.446 -0.576 . . . . 10.0 109.446 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . 0.576 ' HD2' ' HA2' ' A' ' 342' ' ' GLY . 98.0 mtt180 -53.92 -49.33 68.9 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.969 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 95.3 mt -63.67 -40.56 97.14 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.325 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -64.29 -47.32 79.94 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.157 0.503 . . . . 10.0 109.839 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . 0.472 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 22.0 mt-10 -66.67 -41.38 88.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.788 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . 0.429 ' HD1' ' HA ' ' A' ' 349' ' ' TYR . 1.8 m-30 -61.22 -39.33 89.86 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.937 -0.394 . . . . 10.0 109.937 178.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -65.64 -39.92 91.96 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.395 -0.594 . . . . 10.0 109.395 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -65.7 -50.82 63.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.676 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 16.4 mttm -60.72 -37.57 82.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.575 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -64.89 -44.59 89.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.023 178.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 32.4 m -61.04 -41.79 97.25 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.832 -0.433 . . . . 10.0 109.832 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -63.19 -40.02 96.31 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . 0.554 ' HA ' ' OE1' ' C' ' 418' ' ' GLN . 17.7 m80 -65.79 -45.18 83.37 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.484 -0.78 . . . . 10.0 109.852 179.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.406 HD23 HD12 ' A' ' 360' ' ' LEU . 96.5 mt -59.49 -34.98 73.26 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.649 179.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . 0.5 ' O ' ' HG3' ' A' ' 362' ' ' GLU . 29.7 m -63.26 -49.19 75.06 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.057 -0.519 . . . . 10.0 110.258 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 21.0 p -72.63 -28.22 62.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.084 0.468 . . . . 10.0 109.942 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 356' ' ' HIS . 28.9 mt -64.45 -47.65 78.24 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.164 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 1.4 p -64.69 -34.87 79.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.817 0.341 . . . . 10.0 110.591 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 358' ' ' SER . 25.5 mt-10 -68.48 -9.02 46.19 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.426 179.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.578 ' HD3' HG23 ' C' ' 411' ' ' THR . 7.5 mtmp? -116.88 -29.81 5.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.604 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -73.5 -14.69 61.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.281 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.72 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 95.4 mttt -117.09 -68.86 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 112.401 0.519 . . . . 10.0 112.401 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.72 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 50.2 Cg_exo -57.42 -56.07 2.06 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.141 1.894 . . . . 10.0 112.445 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -64.07 -42.62 96.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.207 -0.452 . . . . 10.0 111.367 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 368' ' ' LEU . 9.2 mt -65.68 -37.57 86.86 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 120.908 -0.317 . . . . 10.0 111.248 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . 0.837 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 9.6 mt-10 -68.77 -32.75 72.72 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.998 -0.371 . . . . 10.0 109.998 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.22 -45.0 78.13 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.413 -0.958 . . . . 10.0 108.413 177.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.51 -47.95 79.61 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.171 -0.922 . . . . 10.0 109.908 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -65.13 -39.9 93.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.933 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.837 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.8 mt-30 -64.32 -34.58 78.47 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.15 -0.477 . . . . 20.0 110.704 178.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -77.43 -34.65 39.61 Favored Glycine 0 C--N 1.332 0.336 0 N-CA-C 109.698 -1.361 . . . . 10.0 109.698 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 18.0 mt -61.26 -28.39 69.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.758 -0.221 . . . . 10.0 111.186 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . 0.491 ' HB2' ' HD3' ' A' ' 377' ' ' PRO . 56.3 mt -59.47 -65.07 2.27 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 121.083 -0.247 . . . . 10.0 111.089 179.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.491 ' HD3' ' HB2' ' A' ' 376' ' ' LEU . 30.6 Cg_endo -65.09 -34.07 47.92 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 121.819 1.68 . . . . 10.0 111.212 178.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 16.0 t -62.3 -53.36 48.48 Favored 'Isoleucine or valine' 0 C--O 1.231 0.095 0 CA-C-N 116.702 -0.226 . . . . 10.0 110.433 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . 0.4 ' O ' ' HG3' ' A' ' 383' ' ' LYS . 40.4 mt -62.09 -41.47 98.23 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 109.957 -0.386 . . . . 10.0 109.957 179.327 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . 0.485 ' O ' HG23 ' A' ' 384' ' ' VAL . 73.8 mt-10 -61.78 -46.65 88.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.765 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 30.0 p -64.45 -34.11 77.43 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.867 0.365 . . . . 10.0 110.346 178.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . 0.434 ' HD1' ' HA ' ' A' ' 382' ' ' PHE . 3.3 m-30 -68.55 -41.4 79.88 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.06 -0.718 . . . . 10.0 109.06 178.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 379' ' ' LEU . 83.0 mttt -63.22 -40.28 97.01 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 178.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 380' ' ' GLU . 54.5 t -59.98 -45.86 94.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-N 116.057 -0.52 . . . . 10.0 109.927 178.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.26 -43.06 71.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.522 -0.308 . . . . 10.0 111.491 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -63.68 -48.31 77.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.767 0.318 . . . . 10.0 111.38 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 99.2 mt -63.07 -39.76 95.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.432 -0.349 . . . . 10.0 111.363 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . 0.414 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 31.4 p -72.52 -39.31 67.66 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.856 -0.338 . . . . 10.0 110.896 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -66.01 -31.07 71.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.261 0.553 . . . . 10.0 110.318 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 27.6 mt -61.4 -22.0 64.6 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.752 -0.658 . . . . 10.0 111.113 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -64.02 -50.36 68.81 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.902 -0.777 . . . . 10.0 108.902 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . 0.643 ' HA ' ' HG2' ' A' ' 395' ' ' LYS . 20.5 mp0 -61.56 -44.05 97.75 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.32 -0.855 . . . . 10.0 111.658 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -54.04 -42.52 69.27 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 123.683 0.614 . . . . 10.0 112.169 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 30.2 m -82.88 -38.88 22.3 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.396 0.517 . . . . 10.0 112.396 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . 0.643 ' HG2' ' HA ' ' A' ' 392' ' ' GLU . 2.1 ptpt -77.37 -2.74 36.63 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.808 0.67 . . . . 10.0 112.808 -178.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . 0.76 ' HD3' ' HB2' ' C' ' 587' ' ' ALA . 0.0 OUTLIER -110.29 -22.53 11.68 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 120.132 -0.627 . . . . 10.0 111.297 -179.927 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -108.26 2.18 22.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.795 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 . . . . . 0 C--O 1.237 0.428 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 -179.832 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' C' ' 399' ' ' LEU . 2.9 mm? . . . . . 0 CA--C 1.521 -0.156 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 23.0 mtpt -81.21 2.12 29.19 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.336 -0.847 . . . . 10.0 110.173 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 1.7 mt -62.76 -24.39 67.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.471 -0.786 . . . . 10.0 111.003 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 56.9 mt -64.6 -38.06 89.71 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.156 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.84 -43.55 75.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.617 0.722 . . . . 10.0 109.484 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -66.91 -44.73 80.03 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.391 -0.822 . . . . 10.0 110.667 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . 0.515 ' HE1' ' H39' ' A' ' 55' ' ' PCW . 0.0 OUTLIER -65.49 -29.19 69.81 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.224 -0.444 . . . . 10.0 111.176 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.23 -37.16 79.49 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 109.406 -0.59 . . . . 10.0 109.406 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 69.6 m -69.8 -28.63 65.89 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.408 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . 0.439 ' O ' ' HB ' ' C' ' 411' ' ' THR . 57.6 t -69.93 -38.16 74.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.479 -0.782 . . . . 10.0 108.89 178.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 1.6 m -62.54 -41.82 99.13 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.5 -0.926 . . . . 10.0 108.5 177.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 3.8 m -63.82 -33.18 75.09 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.044 -0.725 . . . . 10.0 109.044 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . 0.578 HG23 ' HD3' ' A' ' 363' ' ' LYS . 95.7 m -65.93 -41.83 90.88 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 108.847 -0.797 . . . . 10.0 108.847 178.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -61.87 -42.3 98.89 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.291 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' C' ' 417' ' ' GLU . 8.5 m -61.17 -44.73 96.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.012 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . 0.413 ' HA ' ' HD3' ' C' ' 414' ' ' LYS . 35.0 mmtt -61.71 -37.58 84.7 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.127 0.489 . . . . 10.0 110.007 178.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' C' ' 411' ' ' THR . 83.9 mt -68.83 -38.24 79.7 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.663 178.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -65.0 -31.74 73.13 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.431 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' C' ' 413' ' ' SER . 13.7 mt-10 -65.25 -35.54 81.34 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . 0.744 ' O ' ' HB ' ' C' ' 422' ' ' VAL . 26.0 mt-30 -80.56 -33.49 36.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.723 -0.672 . . . . 10.0 109.972 178.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 53.2 mt -63.94 -15.88 60.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.636 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -89.0 -95.76 1.05 Allowed Glycine 0 N--CA 1.444 -0.803 0 C-N-CA 120.801 -0.714 . . . . 10.0 111.969 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . 0.466 ' O ' ' HB2' ' C' ' 425' ' ' GLU . 12.3 Cg_endo -54.05 -39.96 83.34 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.553 2.835 . . . . 10.0 114.345 -178.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . 0.744 ' HB ' ' O ' ' C' ' 418' ' ' GLN . 76.0 t -63.61 -48.18 87.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 117.953 0.342 . . . . 10.0 111.062 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 4.9 m -68.59 -39.16 81.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.817 0.342 . . . . 10.0 110.096 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -61.97 -42.28 98.95 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.276 -0.639 . . . . 10.0 109.276 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' C' ' 421' ' ' PRO . 14.6 tt0 -64.8 -39.74 94.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.205 -0.907 . . . . 10.0 108.676 178.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.37 -38.86 88.52 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.048 -0.723 . . . . 10.0 109.048 178.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -66.98 -38.16 85.55 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.602 178.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -64.7 -36.92 85.83 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . 0.472 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 7.2 t30 -68.2 -39.94 82.3 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 177.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 43.2 mt -61.21 -34.12 74.59 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.518 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -63.76 -35.61 81.16 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -72.89 -36.83 67.41 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.567 -0.901 . . . . 10.0 108.567 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -63.59 -48.62 76.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.039 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.75 -42.85 97.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.91 -0.587 . . . . 10.0 110.227 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -63.03 -40.92 99.19 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.92 -44.94 96.66 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 110.405 -1.078 . . . . 10.0 110.405 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 98.1 mt -63.39 -31.32 72.44 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' C' ' 438' ' ' ARG . 50.1 mtt180 -77.07 -3.45 39.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.089 0.471 . . . . 10.0 110.453 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -111.41 -23.68 10.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.684 -0.858 . . . . 10.0 108.684 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . 0.558 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 42.1 mt-10 -91.93 -61.0 1.72 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.927 -1.033 . . . . 10.0 110.494 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 97.4 mmm -62.66 -30.83 71.67 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.952 -0.567 . . . . 10.0 112.459 -178.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.5 p -60.17 -46.04 91.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.127 0.489 . . . . 10.0 109.725 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . 0.445 ' O ' ' HB2' ' C' ' 447' ' ' GLU . 88.2 mttt -78.83 -40.79 31.78 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.432 -0.804 . . . . 10.0 109.653 179.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . 0.493 ' CG ' ' HD3' ' A' ' 330' ' ' ARG . 1.0 OUTLIER -58.15 -52.91 63.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.739 -179.398 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 62.2 mt -58.85 -44.16 90.92 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -68.15 -38.17 81.83 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.7 -0.481 . . . . 10.0 109.7 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . 0.53 ' HB3' ' NH2' ' A' ' 330' ' ' ARG . 2.4 mm-40 -61.99 -38.68 89.53 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 178.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 32.2 t -66.4 -51.2 60.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-N 115.24 -0.891 . . . . 10.0 109.354 178.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -58.09 -48.53 79.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.767 0.318 . . . . 10.0 111.413 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -67.27 -11.78 58.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.184 -0.462 . . . . 10.0 112.031 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . 0.488 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 43.3 mttp -108.19 -33.1 7.24 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.025 0.38 . . . . 10.0 112.025 179.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 18.9 t -66.21 -37.93 80.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 O-C-N 123.158 0.286 . . . . 10.0 110.653 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -57.38 -60.57 9.33 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 121.011 -0.275 . . . . 10.0 110.742 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . 0.4 ' HA ' ' HB3' ' C' ' 457' ' ' ASP . 29.4 Cg_endo -67.06 -24.37 45.13 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 121.679 1.586 . . . . 10.0 111.674 178.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . 0.553 ' O ' ' HB2' ' C' ' 459' ' ' PHE . 46.3 t80 -69.02 -48.08 63.85 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 109.35 -0.611 . . . . 10.0 109.35 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 24.6 mt -69.41 -27.18 65.06 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.755 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . 0.4 ' HB3' ' HA ' ' C' ' 454' ' ' PRO . 6.2 t70 -71.78 -48.89 43.57 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . 0.596 ' HA ' ' HD2' ' C' ' 461' ' ' LYS . 12.2 t70 -65.5 -37.42 86.74 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . 0.553 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 0.3 OUTLIER -67.19 -36.56 82.0 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.371 -0.831 . . . . 10.0 109.348 178.256 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . 0.402 HE21 ' HB3' ' C' ' 460' ' ' GLN . 2.1 mt-30 -64.8 -39.42 93.56 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.031 -0.729 . . . . 10.0 109.031 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . 0.596 ' HD2' ' HA ' ' C' ' 458' ' ' ASP . 40.6 mttp -60.88 -48.39 82.01 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.699 -0.852 . . . . 10.0 108.699 178.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 16.1 mtmm -64.95 -39.24 93.2 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.512 -0.767 . . . . 10.0 110.665 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . 0.452 ' HA ' ' CE3' ' C' ' 463' ' ' TRP . 1.3 m95 -62.8 -41.02 99.11 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.102 -0.703 . . . . 10.0 109.102 178.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -49.89 73.55 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.061 -0.718 . . . . 10.0 109.061 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 0.932 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 42.4 mt-10 -55.96 -44.89 78.9 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.356 179.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -66.11 -52.78 45.46 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.88 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 88.3 mmm -59.63 -48.07 83.13 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.049 0.388 . . . . 10.0 112.049 -179.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -63.96 -46.14 86.0 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.554 -0.536 . . . . 10.0 109.554 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 1.57 HD11 ' CD ' ' A' ' 308' ' ' ARG . 96.4 mt -59.89 -43.23 94.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.623 -0.717 . . . . 20.0 110.659 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 13.0 m-30 -68.49 -36.75 79.38 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.049 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 -63.83 -39.37 94.06 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.329 -0.619 . . . . 10.0 109.329 178.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -81.47 10.44 5.8 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.629 -0.714 . . . . 10.0 111.244 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . 0.542 ' HG2' HD13 ' A' ' 301' ' ' LEU . 76.8 mttt -124.58 -54.2 1.66 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.281 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . 0.437 ' O ' ' HB2' ' C' ' 478' ' ' ARG . 79.2 t -58.15 -43.24 85.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.524 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . 0.46 ' HB2' ' CD ' ' C' ' 476' ' ' PRO . 83.1 mt-10 -60.7 -62.18 6.47 Favored Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 120.966 -0.294 . . . . 10.0 111.75 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . 0.46 ' CD ' ' HB2' ' C' ' 475' ' ' GLU . 18.2 Cg_endo -60.11 -40.1 63.61 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 121.985 1.79 . . . . 10.0 112.057 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' C' ' 477' ' ' LEU . 26.0 mt -65.31 -43.91 89.53 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.45 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . 0.437 ' HB2' ' O ' ' C' ' 474' ' ' VAL . 38.6 mtt180 -62.38 -39.84 94.5 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 109.665 -0.495 . . . . 10.0 109.665 179.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -63.92 -48.54 76.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.039 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -66.53 -39.83 88.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.489 179.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 23.1 mt -67.47 -32.03 72.59 Favored 'General case' 0 C--O 1.219 -0.552 0 N-CA-C 109.585 -0.524 . . . . 10.0 109.585 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 0.7 OUTLIER -67.72 -46.95 70.72 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.55 -0.537 . . . . 10.0 109.55 178.711 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -65.32 -40.51 93.81 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -66.64 -35.58 90.08 Favored Glycine 0 N--CA 1.445 -0.714 0 N-CA-C 110.646 -0.982 . . . . 10.0 110.646 178.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . 0.427 ' O ' ' HG ' ' C' ' 489' ' ' LEU . . . -71.77 -36.78 70.47 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 109.071 -0.715 . . . . 10.0 109.071 178.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -66.35 -37.4 85.23 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . 0.411 HE21 ' HB3' ' C' ' 487' ' ' GLN . 11.9 mt-30 -66.06 -42.65 89.17 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 107.91 -1.144 . . . . 10.0 107.91 176.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . 0.471 ' HE2' HD11 ' C' ' 492' ' ' LEU . 76.5 tttt -65.11 -39.43 93.11 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.596 178.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' C' ' 485' ' ' ALA . 58.5 mt -63.38 -46.63 85.59 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.164 -0.68 . . . . 10.0 109.164 178.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -60.92 -41.39 96.09 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 108.968 -0.753 . . . . 10.0 108.968 178.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . 0.694 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 30.8 mt-10 -59.65 -53.2 60.8 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 177.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . 0.471 HD11 ' HE2' ' C' ' 488' ' ' LYS . 84.2 mt -56.27 -43.63 78.97 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.908 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -61.96 -51.47 67.96 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.95 -0.389 . . . . 10.0 109.95 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -70.66 -8.64 53.4 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.949 0.722 . . . . 10.0 112.949 -178.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.979 ' HG2' HD22 ' A' ' 279' ' ' LEU . 13.2 mttm -102.13 -49.97 3.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.96 0.409 . . . . 10.0 110.047 178.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 85.3 mt -71.3 -19.75 62.29 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.972 0.73 . . . . 10.0 112.972 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 68.4 m -71.73 -60.9 2.25 Favored Pre-proline 0 C--N 1.329 -0.29 0 C-N-CA 120.563 -0.455 . . . . 10.0 111.113 178.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -63.38 -37.54 48.85 Favored 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 121.835 1.69 . . . . 10.0 110.851 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 40.8 mt -72.04 -29.73 64.45 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 116.345 -0.389 . . . . 10.0 109.994 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -69.71 -46.82 52.17 Favored Glycine 0 N--CA 1.449 -0.47 0 N-CA-C 110.212 -1.155 . . . . 10.0 110.212 178.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -61.45 -42.2 98.4 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.312 -0.996 . . . . 10.0 108.312 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.64 -44.91 92.47 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 114.955 -1.021 . . . . 10.0 109.882 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . 0.438 ' SD ' ' HD2' ' C' ' 506' ' ' ARG . 47.4 mmm -61.79 -34.31 75.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.706 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -68.97 -38.33 79.32 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.693 -0.484 . . . . 10.0 109.693 178.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.0 -30.14 61.07 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.932 -0.766 . . . . 10.0 108.932 178.027 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.438 ' HD2' ' SD ' ' C' ' 503' ' ' MET . 38.8 mtt180 -64.64 -46.02 84.35 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 107.056 -1.461 . . . . 10.0 107.056 176.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -62.18 -39.07 91.46 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 114.812 -1.085 . . . . 10.0 108.989 178.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' C' ' 512' ' ' ASP . 43.0 mtt180 -61.78 -54.16 46.18 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.849 -0.797 . . . . 10.0 108.849 178.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . 0.403 ' HB1' ' CD ' ' A' ' 264' ' ' LYS . . . -61.81 -22.42 65.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.349 -0.841 . . . . 10.0 112.766 -179.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -95.24 -52.12 4.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.58 0.229 . . . . 10.0 111.389 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 96.6 t -67.18 -44.26 87.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.46 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.521 ' HB2' ' O ' ' C' ' 508' ' ' ARG . 7.3 m-20 -64.87 -33.59 76.37 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.18 -47.29 77.47 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 107.136 -1.431 . . . . 10.0 107.136 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . 0.523 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 75.8 mt -61.15 -36.62 80.29 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.177 178.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -62.12 -23.35 66.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.963 0.411 . . . . 10.0 109.965 178.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 1.6 m -113.24 8.31 18.1 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.454 0.645 . . . . 10.0 110.236 179.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . 0.532 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 44.3 m170 -118.15 -47.2 2.58 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.207 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 76.2 mt -82.45 -29.43 30.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.886 -0.597 . . . . 10.0 111.247 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -60.1 -57.86 23.61 Favored Pre-proline 0 C--N 1.331 -0.216 0 C-N-CA 121.094 -0.243 . . . . 10.0 111.009 179.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -66.83 -27.7 43.69 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 121.242 1.294 . . . . 10.0 110.367 178.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . 0.532 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 34.7 t80 -65.51 -45.25 84.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.226 179.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 4.4 p -70.25 -34.54 72.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.859 0.361 . . . . 10.0 110.06 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . 0.421 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 0.4 OUTLIER -67.33 -45.53 76.14 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 178.752 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -61.41 -45.54 93.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.442 -0.947 . . . . 10.0 108.442 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 16.2 mt -61.58 -32.81 72.93 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.506 -0.77 . . . . 10.0 110.726 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . 0.421 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 37.7 mtt180 -64.1 -43.06 96.52 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 110.135 -0.32 . . . . 10.0 110.135 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -67.74 -44.35 77.75 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.994 -0.743 . . . . 10.0 108.994 178.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . 0.645 ' HB3' ' NH2' ' C' ' 532' ' ' ARG . 77.9 mtt180 -61.61 -43.17 99.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.924 -1.034 . . . . 10.0 110.739 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 57.2 mt -69.03 -35.48 76.67 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 116.176 -0.466 . . . . 10.0 110.203 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . 0.466 ' O ' ' HG3' ' C' ' 534' ' ' GLU . . . -63.13 -47.88 80.88 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.591 -0.522 . . . . 10.0 109.591 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -61.92 -40.23 94.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.717 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . 0.645 ' NH2' ' HB3' ' C' ' 528' ' ' ARG . 1.3 mtm180 -66.73 -40.49 88.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.497 -0.774 . . . . 10.0 110.168 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 17.2 mt -62.46 -40.8 97.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.129 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' C' ' 530' ' ' ALA . 40.1 mt-10 -63.77 -39.44 94.26 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.845 -0.428 . . . . 10.0 109.845 178.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -66.13 -40.61 90.78 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 97.3 mt -68.67 -33.43 73.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.262 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -77.06 -37.01 55.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.431 -0.349 . . . . 10.0 111.205 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -64.16 -53.35 50.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.114 0.483 . . . . 10.0 109.706 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -72.75 -32.75 65.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.474 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.43 -45.33 86.49 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.863 -0.684 . . . . 10.0 111.426 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -63.31 -35.64 92.33 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 110.72 -0.952 . . . . 10.0 110.72 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -70.49 -46.02 64.52 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.754 -0.832 . . . . 10.0 108.754 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 48.2 mtt85 -59.81 -36.66 77.21 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.73 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 74.1 mt -60.77 -41.82 96.24 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.605 -0.517 . . . . 10.0 109.605 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.98 -46.49 71.19 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . 0.646 ' O ' ' HD2' ' C' ' 550' ' ' LYS . 0.2 OUTLIER -58.22 -47.82 82.3 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.503 -0.771 . . . . 10.0 110.151 178.56 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -61.45 -40.91 96.22 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 116.345 -0.388 . . . . 10.0 110.494 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -63.32 -39.48 94.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.909 0.385 . . . . 10.0 110.177 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . 0.514 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -66.99 -46.47 74.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.374 178.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . 0.646 ' HD2' ' O ' ' C' ' 546' ' ' GLU . 0.0 OUTLIER -63.42 -36.71 84.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.144 178.716 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.93 -38.22 90.27 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.588 -0.893 . . . . 10.0 108.588 178.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 91.3 m -65.41 -44.55 87.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.474 -0.785 . . . . 10.0 108.895 178.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . 0.514 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 29.4 mt-10 -63.43 -41.11 98.68 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.332 -0.618 . . . . 10.0 109.332 178.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -63.85 -42.64 97.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.778 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 49.3 mt -65.61 -38.24 88.88 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 18.1 m -67.57 -38.45 84.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.388 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 2.9 p -78.29 -9.56 59.29 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.153 0.502 . . . . 10.0 110.162 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 19.4 mt -90.77 -25.33 20.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.785 -0.643 . . . . 10.0 109.434 178.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.9 m -60.89 -37.89 83.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.047 -0.524 . . . . 10.0 109.948 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . 0.42 ' O ' ' HG2' ' C' ' 564' ' ' PRO . 0.5 OUTLIER -74.79 0.52 15.13 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.583 179.638 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . 0.491 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 12.5 mptt -117.2 -45.83 2.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.015 0.436 . . . . 10.0 110.521 179.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -75.47 -8.76 57.56 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.101 -0.5 . . . . 10.0 112.151 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . 0.561 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 61.4 mttm -113.62 -75.73 0.01 OUTLIER Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 113.043 0.757 . . . . 10.0 113.043 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 30.4 Cg_endo -65.86 -45.16 6.64 Favored 'Trans proline' 0 C--N 1.357 0.989 0 C-N-CA 121.404 1.403 . . . . 10.0 112.355 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -64.79 -40.98 96.13 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.487 0.184 . . . . 10.0 111.275 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -40.76 96.78 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.863 -0.421 . . . . 10.0 109.863 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . 0.584 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 31.7 mm-40 -67.84 -35.52 78.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.998 178.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -66.46 -43.94 84.12 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.749 -0.834 . . . . 10.0 108.749 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.44 -42.97 97.22 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.647 178.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . 0.414 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 65.0 mtt180 -63.88 -42.52 97.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.052 178.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . 0.584 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.5 mt-30 -64.93 -21.96 66.91 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.571 -0.741 . . . . 20.0 111.794 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -89.39 -42.15 5.59 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 109.556 -1.418 . . . . 10.0 109.556 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 54.1 mt -59.25 -41.17 88.15 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.068 0.396 . . . . 10.0 112.068 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . 0.433 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 87.9 mt -51.61 -64.38 1.47 Allowed Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 112.716 0.635 . . . . 10.0 112.716 -179.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . 0.433 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 36.2 Cg_endo -65.46 -32.15 50.11 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.773 1.649 . . . . 10.0 111.964 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . 0.716 HG21 ' HE2' ' A' ' 202' ' ' LYS . 12.1 t -64.41 -48.02 86.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.649 -0.25 . . . . 10.0 110.527 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 49.1 mt -62.24 -37.45 85.48 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.461 -0.57 . . . . 10.0 109.461 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . 0.447 ' O ' HG23 ' C' ' 582' ' ' VAL . 2.9 mm-40 -62.75 -49.1 76.34 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.758 -0.656 . . . . 10.0 109.919 178.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 37.3 m -64.34 -37.39 87.33 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.396 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -66.52 -40.16 89.02 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.223 -0.658 . . . . 10.0 109.223 178.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 78.1 mttt -61.11 -43.88 98.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.157 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . 0.447 HG23 ' O ' ' C' ' 578' ' ' GLU . 97.4 t -59.86 -45.1 95.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 121.197 0.522 . . . . 10.0 109.926 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 9.5 m -68.25 -35.61 78.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.417 -0.81 . . . . 10.0 111.109 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . 0.464 ' O ' ' HG ' ' C' ' 588' ' ' LEU . 4.6 m-85 -72.24 -47.0 53.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.234 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 52.0 mt -58.94 -45.38 90.55 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.828 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . 0.562 ' O ' ' HG3' ' C' ' 590' ' ' GLU . 9.4 p -63.24 -46.73 85.57 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.568 -0.53 . . . . 10.0 109.568 178.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . 0.76 ' HB2' ' HD3' ' A' ' 396' ' ' LYS . . . -56.18 -45.74 79.64 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.89 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' C' ' 584' ' ' PHE . 97.2 mt -55.67 -54.14 47.91 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.277 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -62.34 -46.83 86.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 10.0 111.7 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . 0.562 ' HG3' ' O ' ' C' ' 586' ' ' SER . 45.7 mt-10 -59.0 -47.95 83.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.463 -179.353 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -66.32 -43.13 87.03 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.296 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 35.9 m -61.47 -35.91 78.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.743 0.306 . . . . 10.0 111.014 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . 0.506 ' HE3' ' HA ' ' C' ' 590' ' ' GLU . 42.8 mtmt -64.99 -34.62 78.87 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.952 0.352 . . . . 10.0 111.952 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . 0.414 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 89.0 mttt -92.95 -14.17 27.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.966 0.412 . . . . 10.0 111.776 -179.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 94.0 mt -106.91 34.93 3.2 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.295 0.569 . . . . 10.0 110.16 179.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 60.8 t30 . . . . . 0 C--O 1.246 0.886 0 CA-C-O 118.49 -0.767 . . . . 10.0 110.502 -179.649 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.507 ' HG3' ' H32' ' A' ' 19' ' ' PCW . 73.9 mmm . . . . . 0 C--O 1.231 0.118 0 CA-C-O 121.223 0.535 . . . . 10.0 110.856 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 2.9 m -82.23 117.68 22.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.421 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.495 ' OE1' ' H71' ' A' ' 19' ' ' PCW . 28.7 tt0 -108.18 132.9 53.15 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.748 -179.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -117.29 142.89 46.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.658 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.417 ' HD3' ' HB3' ' B' ' 54' ' ' ASP . 50.8 mmtt -101.92 113.43 26.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.518 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.565 HD22 HD23 ' B' ' 159' ' ' LEU . 33.4 mt -112.13 125.97 54.69 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.522 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 59.2 t -110.13 122.81 65.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 120.941 -0.303 . . . . 10.0 110.504 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.594 HG12 ' HD2' ' B' ' 16' ' ' LYS . 59.5 t -102.18 108.86 24.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.357 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 9.6 m -109.57 153.53 11.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.543 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 168.76 168.72 31.23 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 111.227 -0.749 . . . . 10.0 111.227 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.418 ' O ' HG22 ' B' ' 14' ' ' VAL . . . -74.2 155.92 37.83 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.253 0.549 . . . . 10.0 111.545 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -66.13 119.3 12.81 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.672 -0.694 . . . . 10.0 111.788 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 124.43 -20.4 6.98 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.706 -0.759 . . . . 10.0 112.605 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.418 HG22 ' O ' ' B' ' 11' ' ' ALA . 35.6 m -65.28 -24.64 35.47 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -179.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.34 45.83 3.96 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.569 -0.824 . . . . 10.0 113.568 178.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.594 ' HD2' HG12 ' B' ' 8' ' ' VAL . 4.3 mtmp? -65.12 -44.0 90.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.668 0.27 . . . . 10.0 110.79 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.84 -46.91 84.07 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.084 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.83 -47.75 83.75 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.779 -0.646 . . . . 10.0 111.346 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 25.1 mt -57.68 -46.73 83.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.432 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . 0.487 ' O ' HG12 ' B' ' 24' ' ' ILE . 1.4 m -68.64 -47.75 65.8 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.083 -0.508 . . . . 10.0 112.198 -179.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 88.6 mt -62.24 -31.77 52.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-O 120.806 0.336 . . . . 10.0 111.077 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.483 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 9.2 tp-100 -66.3 -28.11 68.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.112 0.482 . . . . 10.0 110.581 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 29.4 tp -86.64 -33.86 19.98 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.934 0.397 . . . . 10.0 110.658 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . 0.487 HG12 ' O ' ' B' ' 20' ' ' THR . 46.3 mm -73.0 -78.36 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 112.421 0.526 . . . . 10.0 112.421 -179.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -98.42 -1.05 42.36 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.058 0.392 . . . . 10.0 112.058 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.483 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 4.0 t30 60.55 55.29 3.45 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.214 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -135.72 123.72 22.8 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.761 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -80.88 133.95 35.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.301 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 23.7 m -85.94 166.98 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.54 -0.3 . . . . 10.0 110.482 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -133.58 -17.19 2.28 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.364 0.602 . . . . 10.0 110.898 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 17.0 pm0 -97.68 165.52 11.93 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.464 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.512 ' HA ' H5'1 ' B' ' 201' ' ' GNP . 91.2 t80 -83.23 96.77 8.56 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 178.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -69.54 112.86 13.41 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.78 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -78.88 54.41 5.12 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.894 2.396 . . . . 10.0 111.919 -179.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -56.75 133.38 54.09 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.057 -0.974 . . . . 10.0 112.098 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.839 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 79.6 mt -126.34 -53.98 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 178.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.411 ' HB3' HG23 ' D' ' 821' ' ' VAL . 1.7 tm-20 -154.61 95.01 1.74 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.126 -0.943 . . . . 10.0 108.745 178.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -140.21 124.22 17.54 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.693 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.92 150.05 23.91 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.723 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . 0.409 ' HB3' HG13 ' B' ' 24' ' ' ILE . 97.9 m-85 -131.42 121.74 25.1 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . 0.759 HH11 HD21 ' B' ' 52' ' ' LEU . 28.8 ttp85 -118.14 126.5 52.34 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.727 0.298 . . . . 10.0 111.585 -178.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 52.7 tttt -140.92 161.95 36.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.5 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -120.77 127.09 51.64 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 110.11 -0.33 . . . . 10.0 110.11 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 7.3 m -138.83 169.22 18.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.966 0.412 . . . . 10.0 111.021 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 42.2 t -102.66 111.22 31.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 179.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . 0.407 HD11 HD11 ' B' ' 53' ' ' LEU . 32.7 mt -111.14 110.73 33.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.919 -178.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 61.65 38.96 14.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.698 -0.683 . . . . 10.0 111.941 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.6 -15.07 56.5 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.832 -0.622 . . . . 10.0 113.816 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -104.36 130.45 52.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 117.118 0.459 . . . . 10.0 111.331 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 1.2 t -75.53 127.68 33.63 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 73.8 m -137.0 139.71 41.62 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-O 121.14 0.495 . . . . 10.0 111.726 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.759 HD21 HH11 ' B' ' 41' ' ' ARG . 46.0 tp -95.27 121.04 36.51 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 107.609 -1.256 . . . . 10.0 107.609 178.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.407 HD11 HD11 ' B' ' 46' ' ' ILE . 88.0 mt -108.31 119.83 40.62 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 112.331 0.493 . . . . 10.0 112.331 -178.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.417 ' HB3' ' HD3' ' B' ' 5' ' ' LYS . 30.6 t70 -108.49 98.74 8.22 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.117 -1.068 . . . . 10.0 108.117 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 10.1 mt -90.57 127.12 43.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.477 -0.783 . . . . 10.0 111.369 -178.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.4 ' HG ' HG23 ' B' ' 58' ' ' THR . 61.1 tp -102.43 111.74 24.17 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.303 179.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -104.5 103.07 12.7 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.861 -0.608 . . . . 10.0 109.507 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . 0.484 HG21 ' CE1' ' B' ' 71' ' ' TYR . 11.4 p -105.36 171.58 7.25 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.04 -0.527 . . . . 10.0 112.383 -178.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.839 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -61.96 145.75 52.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 10.0 112.06 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -108.74 25.54 18.83 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.62 -0.718 . . . . 10.0 111.4 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -136.0 34.88 2.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.055 0.455 . . . . 20.0 111.756 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.414 ' OE1' ' HD2' ' B' ' 68' ' ' ARG . 21.0 mt-10 -96.99 143.39 27.89 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.289 179.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -84.78 -74.18 0.4 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.387 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -158.38 87.32 0.9 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.167 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -105.55 141.19 37.45 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.866 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.34 -35.36 79.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.031 0.443 . . . . 10.0 110.28 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 50.3 ttp -62.76 -39.44 94.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.846 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.599 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 46.5 ttt85 -65.89 -46.6 77.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.132 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.533 ' O ' ' HG3' ' B' ' 73' ' ' ARG . 13.6 t70 -55.59 -44.46 76.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.717 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -64.34 -48.65 74.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.781 -0.645 . . . . 10.0 112.377 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . 0.599 ' CE2' ' HA ' ' B' ' 68' ' ' ARG 0.256 0.5 OUTLIER -70.78 -19.6 62.69 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.527 0.936 . . . . 10.0 113.527 -178.795 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . 0.417 ' HB3' HG21 ' B' ' 103' ' ' VAL . 40.7 mmm -74.45 -24.24 59.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.181 0.515 . . . . 10.0 110.081 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . 0.533 ' HG3' ' O ' ' B' ' 69' ' ' ASP . 89.8 mtt180 -73.47 -30.75 63.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.5 -179.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.3 -5.2 43.45 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.979 0.733 . . . . 10.0 112.979 -179.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -87.87 130.78 10.26 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.383 -0.913 . . . . 10.0 111.799 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -80.94 -65.02 1.07 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.743 0.306 . . . . 10.0 110.275 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -103.18 147.75 16.96 Favored Glycine 0 N--CA 1.446 -0.7 0 N-CA-C 111.046 -0.822 . . . . 10.0 111.046 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -123.79 136.22 54.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.268 0.556 . . . . 10.0 111.909 -179.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.806 ' HG ' HD22 ' B' ' 159' ' ' LEU . 79.8 mt -107.61 120.45 42.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.316 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 18.2 m -92.69 88.7 6.37 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 27.3 t -88.1 116.03 29.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.987 -0.551 . . . . 10.0 112.048 -178.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.679 ' HB3' HD11 ' B' ' 93' ' ' ILE . 15.6 p90 -129.11 159.68 35.22 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.558 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -96.97 132.37 42.83 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 110.129 -0.323 . . . . 10.0 110.129 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.549 ' CD1' ' HA ' ' B' ' 118' ' ' CYS . 2.5 pt -68.3 -10.94 13.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.91 0.386 . . . . 10.0 111.442 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . 0.409 ' HB3' ' HB2' ' B' ' 122' ' ' SER . 0.0 OUTLIER -104.25 5.47 34.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.434 179.946 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -124.3 104.44 8.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.172 0.511 . . . . 10.0 110.306 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.46 -34.57 78.06 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.579 -0.737 . . . . 10.0 111.875 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -60.55 -41.54 94.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.863 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . 0.422 ' O ' HG12 ' B' ' 93' ' ' ILE . 11.2 m -63.42 -37.95 89.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.43 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . 0.498 ' HE1' ' HA ' ' B' ' 130' ' ' ALA . 65.5 t80 -64.98 -35.43 81.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.022 0.439 . . . . 10.0 110.766 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -80.37 -32.72 37.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.063 0.459 . . . . 10.0 110.574 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -73.91 -7.47 52.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.772 -0.649 . . . . 10.0 112.034 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . 0.679 HD11 ' HB3' ' B' ' 82' ' ' PHE . 23.8 mm -58.91 -37.9 69.9 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 CA-C-O 121.148 0.499 . . . . 10.0 109.985 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 16.0 t-80 -64.0 -33.46 75.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.196 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -62.77 -42.65 99.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.802 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . 0.416 ' CD2' ' HA ' ' B' ' 93' ' ' ILE . 19.0 m-85 -64.38 -44.79 90.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.084 -0.507 . . . . 10.0 109.695 179.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . 0.481 ' HD2' ' SD ' ' B' ' 111' ' ' MET . 10.8 tpt180 -56.67 -48.41 77.68 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.309 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -66.39 -41.55 89.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.447 -0.342 . . . . 10.0 111.614 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -60.67 -45.86 92.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.942 0.401 . . . . 10.0 110.691 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . 0.465 ' HA ' HG22 ' B' ' 103' ' ' VAL . 54.3 mt -65.79 -40.89 88.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.802 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . 0.641 ' HG2' ' HA ' ' B' ' 107' ' ' GLU . 39.3 mtpt -58.15 -37.18 74.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.004 -0.543 . . . . 10.0 111.259 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 59.8 ttp85 -76.98 -47.65 20.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.018 -0.537 . . . . 10.0 112.407 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.465 HG22 ' HA ' ' B' ' 100' ' ' ILE . 32.7 m -66.85 -30.1 48.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 N-CA-C 112.654 0.612 . . . . 10.0 112.654 -178.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.427 ' HA ' ' HD2' ' B' ' 104' ' ' LYS . 10.7 mmmm -91.72 -12.51 33.78 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 121.112 -0.235 . . . . 10.0 111.382 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 28.0 t0 60.0 34.8 21.5 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.696 0.76 . . . . 10.0 110.971 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 42.9 m -156.43 147.16 21.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.736 -0.665 . . . . 10.0 109.858 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . 0.641 ' HA ' ' HG2' ' B' ' 101' ' ' LYS . 20.7 mp0 -93.88 -26.67 16.8 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.972 0.415 . . . . 10.0 110.503 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -94.0 77.18 4.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.69 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 57.8 t -120.06 133.38 23.93 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.749 -0.659 . . . . 10.0 110.081 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . 0.488 ' HB3' ' HB3' ' B' ' 162' ' ' GLU . 32.4 Cg_exo -59.55 114.97 2.28 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.843 2.362 . . . . 10.0 112.324 179.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . 0.481 ' SD ' ' HD2' ' B' ' 97' ' ' ARG . 41.1 mtt -136.71 156.5 48.45 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.386 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.531 ' HB ' HD23 ' B' ' 79' ' ' LEU . 87.0 t -135.38 132.38 52.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 110.049 -0.352 . . . . 10.0 110.049 179.134 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 19.9 tp -84.53 121.89 28.23 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.381 -0.6 . . . . 10.0 109.381 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 47.7 t -117.11 115.13 47.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.031 0.443 . . . . 10.0 111.769 -178.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.69 97.25 1.76 Allowed Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 110.49 -1.044 . . . . 10.0 110.49 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -87.28 161.41 18.0 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.853 0.359 . . . . 10.0 111.925 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 91.4 mttt 69.54 35.18 2.56 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.336 -0.847 . . . . 10.0 112.148 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . 0.549 ' HA ' ' CD1' ' B' ' 84' ' ' ILE . 29.1 p -74.33 -12.97 60.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.479 -0.328 . . . . 10.0 111.797 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -81.39 -20.64 40.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.398 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 73.7 mt -67.92 142.42 95.44 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.013 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -61.66 -32.36 86.92 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.914 2.409 . . . . 10.0 111.947 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . 0.409 ' HB2' ' HB3' ' B' ' 85' ' ' ASN . 0.1 OUTLIER -73.87 118.7 17.14 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.33 179.596 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 18.0 ttt180 -141.93 115.47 9.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.806 0.336 . . . . 10.0 111.094 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.56 -24.78 11.64 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.571 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 38.5 t -104.34 114.29 43.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.56 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . 0.526 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 13.8 t70 -75.61 152.42 37.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.676 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.2 m -56.75 -42.29 79.04 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.838 -0.619 . . . . 10.0 112.094 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -64.91 -44.7 88.68 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 121.256 -0.178 . . . . 10.0 111.294 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . 0.526 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 38.0 mt-30 -58.16 -45.97 86.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.851 0.357 . . . . 10.0 110.805 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . 0.498 ' HA ' ' HE1' ' B' ' 90' ' ' PHE . . . -67.6 -44.94 76.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.307 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -62.7 -39.79 95.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.847 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -61.7 -41.29 97.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.342 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 37.8 tp -64.78 -44.19 90.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.009 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.22 -43.98 97.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.184 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -60.35 -36.5 78.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.803 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 20.6 m -66.65 -30.42 70.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.688 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -85.82 -18.18 33.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.582 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.64 28.94 28.12 Favored Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 111.259 -0.736 . . . . 10.0 111.259 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . 0.415 ' HB ' ' HD2' ' B' ' 140' ' ' PRO . 50.4 pt -128.19 159.07 69.04 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.723 -0.238 . . . . 10.0 110.444 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . 0.415 ' HD2' ' HB ' ' B' ' 139' ' ' ILE . 90.2 Cg_endo -82.83 158.36 15.98 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 122.569 2.179 . . . . 10.0 112.42 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -119.07 124.38 46.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.398 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 23.0 mm -119.13 121.42 66.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.947 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . 0.404 ' HG2' ' CB ' ' B' ' 118' ' ' CYS . 6.7 tt0 -85.24 123.6 30.92 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.676 -1.231 . . . . 10.0 107.676 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 70.1 p -130.09 170.45 14.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.783 0.801 . . . . 10.0 113.073 -176.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 8.7 t -155.44 108.16 2.71 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.672 -1.149 . . . . 10.0 108.495 178.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -66.15 -24.94 66.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.739 0.304 . . . . 10.0 111.611 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 23.1 ttpp -74.85 -35.28 62.38 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.123 0.416 . . . . 10.0 112.123 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 69.6 p -100.68 -7.46 23.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.942 0.401 . . . . 10.0 111.156 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . 0.421 HH12 ' CG ' ' B' ' 153' ' ' ASP . 1.8 ttt-85 67.07 23.3 9.71 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 115.588 -0.733 . . . . 10.0 111.781 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -90.08 127.42 36.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.395 -0.366 . . . . 10.0 111.541 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 75.11 -4.85 37.02 Favored Glycine 0 CA--C 1.52 0.362 0 N-CA-C 114.635 0.614 . . . . 10.0 114.635 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 65.6 t -55.61 -60.91 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 117.1 0.45 . . . . 10.0 111.88 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . 0.421 ' CG ' HH12 ' B' ' 149' ' ' ARG . 0.1 OUTLIER -66.88 -34.01 76.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.974 0.416 . . . . 10.0 110.597 -179.51 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -59.76 -43.35 94.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.696 -0.684 . . . . 10.0 111.383 -179.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -59.64 -45.4 92.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.671 179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . 0.4 ' O ' HG23 ' B' ' 160' ' ' VAL . 55.8 m-85 -64.52 -43.99 92.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.806 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -59.88 -40.66 89.46 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.915 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 18.4 m -62.99 -43.07 99.81 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.789 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.806 HD22 ' HG ' ' B' ' 79' ' ' LEU . 39.6 tp -60.66 -44.11 96.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.42 . . . . 10.0 111.128 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . 0.4 HG23 ' O ' ' B' ' 156' ' ' PHE . 58.1 t -61.9 -38.53 80.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.181 0.515 . . . . 10.0 110.332 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -67.09 -33.66 75.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.177 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . 0.488 ' HB3' ' HB3' ' B' ' 110' ' ' PRO . 42.2 mm-40 -68.07 -40.61 82.68 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 109.763 -0.458 . . . . 10.0 109.763 178.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 81.2 mt -62.62 -45.5 98.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.341 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 76.0 mtt180 -61.03 -46.75 89.47 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.671 -0.695 . . . . 10.0 109.709 178.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -54.4 -47.53 72.62 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.674 -0.693 . . . . 10.0 111.42 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -64.65 -45.84 85.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.205 0.446 . . . . 10.0 112.205 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -66.96 -40.31 87.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.264 -0.425 . . . . 10.0 112.098 -179.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -65.6 -43.66 88.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.957 0.408 . . . . 10.0 110.351 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.7 tttm -60.23 -44.58 95.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.024 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 77.0 mtp -66.17 -31.92 73.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.416 -0.356 . . . . 10.0 111.783 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 22.0 m -76.06 -30.78 58.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.679 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -110.73 20.51 17.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.025 0.44 . . . . 10.0 111.108 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -74.0 -67.35 0.61 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.386 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 175.08 73.74 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.213 -0.994 . . . . 10.0 113.278 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . 0.668 ' HB3' ' H39' ' A' ' 20' ' ' PCW . 95.6 mttt -73.21 -48.39 35.49 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.108 0.48 . . . . 10.0 109.766 179.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . 0.91 ' HE2' ' H40' ' A' ' 20' ' ' PCW . 0.0 OUTLIER -84.59 -0.44 53.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.457 0.646 . . . . 10.0 109.926 179.281 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -86.43 -13.67 45.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.304 -0.862 . . . . 10.0 109.663 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 18.7 mtpt 65.97 62.5 0.61 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.817 -0.628 . . . . 10.0 110.985 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 26.9 tttm -110.56 91.31 3.61 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.523 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 42.7 tttm 62.07 95.15 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.831 0.678 . . . . 10.0 112.831 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -121.29 -57.91 1.82 Allowed 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.468 179.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp 62.15 -160.3 0.31 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.681 -0.691 . . . . 10.0 112.044 -179.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 3.4 m -140.21 -41.23 0.42 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.283 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . 0.504 ' HE2' ' H20' ' A' ' 16' ' ' PCW . 14.7 ptpt -99.26 99.78 10.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.936 0.398 . . . . 10.0 111.125 179.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 78.5 m . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.604 -179.611 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 111.779 -0.528 . . . . 10.0 111.779 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 9.3 p -123.79 133.68 53.78 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.598 -0.301 . . . . 10.0 110.561 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 8.8 t -123.45 135.44 63.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.282 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 811' ' ' LYS . . . . . 0.818 ' HB3' HG22 ' D' ' 821' ' ' VAL . 13.9 pttp -99.99 116.5 32.17 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.073 0.463 . . . . 10.0 111.112 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 812' ' ' VAL . . . . . 0.767 HG11 HD11 ' D' ' 834' ' ' LEU . 32.2 t -96.11 133.36 37.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.571 -179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.06 134.22 35.33 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.795 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 47.1 mt -99.71 150.28 36.67 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.132 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -67.75 0.64 4.02 Favored 'Trans proline' 0 CA--C 1.534 0.485 0 C-N-CA 122.999 2.466 . . . . 10.0 113.069 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -98.03 17.18 18.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.017 0.437 . . . . 10.0 110.076 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 28.1 tttp 66.89 48.35 1.32 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 115.369 -0.832 . . . . 10.0 110.565 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -150.05 -179.32 7.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.497 -0.774 . . . . 10.0 109.508 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.7 160.76 41.81 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.463 -0.199 . . . . 10.0 110.463 178.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 6.6 t -142.61 132.89 24.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.387 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 821' ' ' VAL . . . . . 0.818 HG22 ' HB3' ' D' ' 811' ' ' LYS . 57.1 t -91.82 117.68 35.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.076 0.465 . . . . 10.0 111.593 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 27.4 m -115.06 164.16 11.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.072 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.26 135.5 34.42 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.78 0.324 . . . . 10.0 110.948 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 824' ' ' VAL . . . . . 0.613 HG11 ' HB2' ' D' ' 871' ' ' ASP . 21.3 t -83.04 125.36 40.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 7.6 mtp180 -121.9 151.45 40.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.867 0.365 . . . . 10.0 110.823 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -91.7 37.38 0.96 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.497 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . -143.78 -66.79 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.449 -0.882 . . . . 10.0 113.047 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 828' ' ' MET . . . . . 0.415 ' HB2' ' HB2' ' D' ' 832' ' ' ASP . 11.5 ptm -58.44 155.62 11.7 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 113.072 0.767 . . . . 10.0 113.072 -179.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 829' ' ' SER . . . . . 0.857 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.3 OUTLIER -97.06 178.21 5.34 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.59 -0.732 . . . . 10.0 111.136 -179.222 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 79.3 t -60.12 -43.36 92.75 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 109.765 -0.457 . . . . 10.0 109.765 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 831' ' ' TYR . . . . . 0.642 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 34.1 t80 -55.36 -45.2 76.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.278 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 832' ' ' ASP . . . . . 0.415 ' HB2' ' HB2' ' D' ' 828' ' ' MET . 13.1 m-20 -69.16 -48.13 63.11 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.976 -0.557 . . . . 10.0 111.601 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 4.3 m -63.78 -40.32 96.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.88 -179.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 834' ' ' LEU . . . . . 0.767 HD11 HG11 ' D' ' 812' ' ' VAL . 3.2 mm? -82.89 -9.52 59.27 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 111.902 0.334 . . . . 10.0 111.902 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -62.61 -51.89 65.52 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 120.622 0.249 . . . . 10.0 110.552 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 13.3 mmmt -60.45 -29.99 69.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.947 -0.569 . . . . 10.0 111.22 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 837' ' ' ALA . . . . . 0.515 ' O ' HG12 ' D' ' 840' ' ' VAL . . . -75.66 -42.62 50.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.167 -0.469 . . . . 10.0 111.085 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 838' ' ' LEU . . . . . 0.742 HD12 ' HG3' ' D' ' 845' ' ' GLN . 30.8 mt -76.14 -41.08 51.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.724 0.297 . . . . 10.0 111.74 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -63.36 -26.27 68.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.431 -0.35 . . . . 10.0 111.259 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 840' ' ' VAL . . . . . 0.515 HG12 ' O ' ' D' ' 837' ' ' ALA . 0.9 OUTLIER -80.52 -17.66 12.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.114 0.483 . . . . 10.0 111.147 -179.545 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' D' D ' 841' ' ' ARG . . . . . 0.426 ' HD3' ' HA ' ' D' ' 841' ' ' ARG . 4.8 mmt180 -106.54 -0.62 23.77 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.37 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 77.5 32.89 45.23 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.762 -0.733 . . . . 10.0 112.105 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 62.5 mt -115.17 161.11 18.87 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.711 0.291 . . . . 10.0 110.745 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -122.38 152.0 40.63 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.112 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 845' ' ' GLN . . . . . 0.742 ' HG3' HD12 ' D' ' 838' ' ' LEU . 19.0 mp0 -78.42 21.5 0.37 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.906 0.706 . . . . 10.0 112.906 -178.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 37.4 p-10 -95.4 -40.68 9.38 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.422 0.527 . . . . 10.0 112.422 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 62.1 m -109.04 6.66 25.25 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.901 0.334 . . . . 10.0 111.901 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 36.2 m -106.61 144.75 32.82 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.91 0.386 . . . . 10.0 111.006 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 7.3 p -132.82 137.99 52.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.922 -0.581 . . . . 10.0 109.733 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 850' ' ' VAL . . . . . 0.407 ' O ' HG22 ' D' ' 861' ' ' THR . 18.1 t -99.83 139.49 21.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 120.768 0.318 . . . . 10.0 110.636 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 851' ' ' TYR . . . . . 0.857 ' HB3' ' HB3' ' D' ' 858' ' ' LYS . 65.7 m-85 -119.23 132.62 55.95 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.987 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 852' ' ' ARG . . . . . 0.594 ' HD3' HD11 ' D' ' 870' ' ' LEU . 8.4 mtm180 -79.21 171.37 15.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.351 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 853' ' ' LEU . . . . . 0.615 HD11 ' H61' ' A' ' 30' ' ' PCW . 0.2 OUTLIER -116.73 96.23 5.39 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.439 179.775 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' D' D ' 854' ' ' ILE . . . . . 0.719 ' HB ' ' H62' ' A' ' 12' ' ' PCW . 33.6 mt -133.36 115.76 23.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.537 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 855' ' ' LYS . . . . . 0.752 ' HB2' ' H41' ' A' ' 12' ' ' PCW . 3.4 mmpt? 63.78 42.38 6.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.663 -0.699 . . . . 10.0 111.681 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 856' ' ' GLY . . . . . 0.459 ' O ' ' H63' ' A' ' 30' ' ' PCW . . . 76.66 -31.32 1.46 Allowed Glycine 0 N--CA 1.452 -0.239 0 CA-C-N 115.796 -0.638 . . . . 10.0 113.742 179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 857' ' ' ARG . . . . . 0.91 HH21 ' HN1' ' A' ' 37' ' ' 17F . 20.5 mtp180 -91.53 158.4 16.48 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.281 0.562 . . . . 10.0 112.0 -179.166 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 858' ' ' LYS . . . . . 0.857 ' HB3' ' HB3' ' D' ' 851' ' ' TYR . 44.0 mtpt -87.68 148.95 24.55 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.455 -0.793 . . . . 10.0 111.223 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 1.3 m -127.99 137.21 52.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.453 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 860' ' ' VAL . . . . . 0.631 HG22 ' HE1' ' D' ' 851' ' ' TYR . 8.6 t -66.07 130.35 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.688 0.28 . . . . 10.0 111.421 -179.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 861' ' ' THR . . . . . 0.407 HG22 ' O ' ' D' ' 850' ' ' VAL . 2.1 t -127.68 160.79 30.58 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.955 -0.387 . . . . 10.0 109.955 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -103.57 159.45 15.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.865 0.364 . . . . 10.0 111.591 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 863' ' ' TRP . . . . . 0.642 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 96.2 m95 -79.0 -30.8 44.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.038 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.61 -29.76 70.97 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.508 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 2.2 m -64.36 145.51 55.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.417 -179.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 866' ' ' ALA . . . . . 0.857 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -73.5 161.83 29.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.118 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 867' ' ' ILE . . . . . 0.549 ' HA ' HD23 ' D' ' 870' ' ' LEU . 6.2 tp -93.98 -1.84 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.088 0.471 . . . . 10.0 111.097 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 868' ' ' ALA . . . . . 0.501 ' HB3' ' HD3' ' D' ' 869' ' ' PRO . . . -54.29 -51.8 74.65 Favored Pre-proline 0 CA--C 1.539 0.546 0 N-CA-C 113.582 0.956 . . . . 10.0 113.582 -179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 869' ' ' PRO . . . . . 0.501 ' HD3' ' HB3' ' D' ' 868' ' ' ALA . 6.0 Cg_exo -79.83 19.34 1.01 Allowed 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 122.466 2.111 . . . . 10.0 113.04 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 870' ' ' LEU . . . . . 0.594 HD11 ' HD3' ' D' ' 852' ' ' ARG . 2.6 mm? -107.64 22.22 16.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.258 0.551 . . . . 10.0 110.741 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 871' ' ' ASP . . . . . 0.613 ' HB2' HG11 ' D' ' 824' ' ' VAL . 10.3 t70 -87.38 108.12 18.84 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.564 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 127.93 -55.25 0.76 Allowed Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.665 -0.779 . . . . 10.0 112.767 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -85.41 172.06 11.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.833 0.349 . . . . 10.0 111.33 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 874' ' ' GLU . . . . . 0.475 ' O ' ' HB2' ' D' ' 853' ' ' LEU . 29.0 mt-10 -118.37 159.2 23.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.253 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 875' ' ' LEU . . . . . 0.419 ' HB2' HG13 ' D' ' 812' ' ' VAL . 24.8 mt -122.9 154.32 38.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.019 0.438 . . . . 10.0 111.875 -178.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 876' ' ' ILE . . . . . 0.641 ' HB ' ' HE3' ' D' ' 858' ' ' LYS . 61.1 mt -126.17 122.29 61.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.222 -0.659 . . . . 10.0 109.222 178.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 877' ' ' VAL . . . . . . . . . . . . . 40.3 t -93.18 131.99 38.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.762 0.315 . . . . 10.0 111.146 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 878' ' ' GLU . . . . . 0.448 ' OE2' ' H61' ' A' ' 27' ' ' PCW . 0.0 OUTLIER -121.89 162.78 20.38 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.717 179.301 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' D' D ' 879' ' ' VAL . . . . . 0.468 ' O ' ' H71' ' A' ' 18' ' ' PCW . 50.6 t -114.84 133.16 61.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 120.91 0.386 . . . . 10.0 110.652 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 99.2 mt . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.343 -0.837 . . . . 10.0 110.075 179.626 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PCW . . . . . 0.733 H342 H351 ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PCW . . . . . 0.422 H142 H241 ' A' ' 21' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PCW . . . . . 0.651 ' H39' H161 ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PCW . . . . . 0.61 H151 H382 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PCW . . . . . 0.7 H121 H371 ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PCW . . . . . 0.627 ' O11' ' H73' ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PCW . . . . . 0.544 H332 H122 ' A' ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PCW . . . . . 0.598 H271 H422 ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PCW . . . . . 0.535 ' H71' ' O2 ' ' A' ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PCW . . . . . 0.652 H372 H281 ' A' ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PCW . . . . . 0.752 ' H41' ' HB2' ' D' ' 855' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PCW . . . . . 0.678 ' H42' ' H2 ' ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PCW . . . . . 0.594 H252 H442 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PCW . . . . . 0.41 H341 H251 ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PCW . . . . . 0.727 H362 H10A ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PCW . . . . . 0.652 H261 ' H61' ' A' ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PCW . . . . . 0.694 H171 ' H12' ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PCW . . . . . 0.507 ' H32' ' HG3' ' B' ' 1' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PCW . . . . . 0.91 ' H40' ' HE2' ' B' ' 176' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PCW . . . . . 0.585 H161 H171 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PCW . . . . . 0.692 H262 H182 ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PCW . . . . . 0.852 ' H73' HN1A ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PCW . . . . . 0.621 H281 H262 ' A' ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PCW . . . . . 0.722 H421 H141 ' A' ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PCW . . . . . 0.733 H351 H342 ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PCW . . . . . 0.568 ' H52' ' H4A' ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PCW . . . . . 0.613 ' H81' H331 ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PCW . . . . . 0.722 H141 H421 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PCW . . . . . 0.615 ' H61' HD11 ' D' ' 853' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PCW . . . . . 0.642 ' H73' H331 ' A' ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PCW . . . . . 0.648 H321 H20A ' A' ' 33' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' 17F . . . . . 0.668 ' H54' H461 ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' 17F . . . . . 0.852 HN1A ' H73' ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' 17F . . . . . 0.645 H11A ' H8A' ' A' ' 33' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' 17F . . . . . 0.752 H18A ' H36' ' A' ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' 17F . . . . . 0.91 ' HN1' HH21 ' D' ' 857' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' 17F . . . . . 1.04 ' H4 ' ' H1 ' ' A' ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' 17F . . . . . 0.727 H10A H362 ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' 17F . . . . . 0.752 ' H36' H18A ' A' ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PCW . . . . . 0.672 H412 H421 ' A' ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PCW . . . . . 0.669 H272 H361 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PCW . . . . . 0.856 ' H62' ' H11' ' A' ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PCW . . . . . 0.671 H481 H212 ' A' ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PCW . . . . . 0.552 H262 H252 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PCW . . . . . 0.513 ' H83' ' O2 ' ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PCW . . . . . 0.652 H472 H12A ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PCW . . . . . 0.647 H442 H172 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PCW . . . . . 0.724 H122 H352 ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PCW . . . . . 0.558 H482 H221 ' A' ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PCW . . . . . 0.713 H442 H442 ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PCW . . . . . 0.682 H152 H331 ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PCW . . . . . 0.442 H352 H371 ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PCW . . . . . 0.647 H172 H442 ' A' ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PCW . . . . . 0.671 H212 H481 ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PCW . . . . . 0.625 ' H51' ' H31' ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PCW . . . . . 0.724 H352 H122 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PCW . . . . . 0.492 ' O2P' ' H81' ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PCW . . . . . 0.672 H421 H412 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PCW . . . . . 0.682 H331 H152 ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PCW . . . . . 0.583 H351 H141 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PCW . . . . . 0.599 H122 H151 ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PCW . . . . . 0.652 H281 H372 ' A' ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PCW . . . . . 0.565 H472 H462 ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PCW . . . . . 0.472 ' H82' ' O31' ' A' ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PCW . . . . . 0.507 H261 H381 ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PCW . . . . . 0.553 ' H20' H171 ' A' ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PCW . . . . . 0.58 ' H42' ' O1P' ' A' ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PCW . . . . . 0.856 ' H11' ' H62' ' A' ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PCW . . . . . 0.73 ' H51' ' H2 ' ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PCW . . . . . 0.824 ' H71' ' H19' ' A' ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PCW . . . . . 0.599 H151 H122 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' 17F . . . . . 0.652 H12A H472 ' A' ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' 17F . . . . . 0.508 ' H64' ' H11' ' A' ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' 17F . . . . . 0.804 ' HN1' ' H4 ' ' A' ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' 17F . . . . . 0.566 ' H38' ' H74' ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' 17F . . . . . 0.527 ' H10' H382 ' A' ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' 17F . . . . . 0.446 ' H48' H422 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' 17F . . . . . 0.622 ' H4 ' ' H1 ' ' A' ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' 17F . . . . . 0.553 ' H10' H162 ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 201' ' ' GNP . . . . . 0.512 H5'1 ' HA ' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 87.0 mt . . . . . 0 CA--C 1.519 -0.235 0 CA-C-O 121.163 0.506 . . . . 10.0 109.759 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 25.7 mttp -64.48 -27.95 69.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.391 -0.822 . . . . 10.0 110.342 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 39.3 mt -71.06 -32.56 69.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.131 179.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.91 -38.01 85.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.485 . . . . 10.0 109.858 179.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -65.77 -38.59 89.48 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 115.798 -0.637 . . . . 10.0 109.649 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . 0.456 ' O ' HG23 ' A' ' 210' ' ' VAL . 11.0 m-80 -72.53 -52.94 13.5 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.217 -0.901 . . . . 10.0 111.147 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 38.4 m0 -57.83 -39.43 77.63 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.56 0.578 . . . . 10.0 112.56 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -59.46 -40.17 86.02 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.033 0.444 . . . . 10.0 110.481 179.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 49.8 m -74.17 -35.66 64.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.183 178.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 206' ' ' ASN . 77.8 t -63.39 -45.59 97.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.64 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 8.6 p -64.69 -46.78 80.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.072 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 2.5 p -62.1 -38.53 89.25 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.887 0.375 . . . . 10.0 110.192 179.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 92.3 m -64.48 -42.81 95.67 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -62.49 -43.08 99.68 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.816 -0.438 . . . . 10.0 109.816 178.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 57.7 m -60.56 -45.9 92.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.125 -0.489 . . . . 10.0 109.918 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . 0.512 ' HA ' ' HD3' ' A' ' 216' ' ' LYS . 11.2 mmtp -66.12 -34.69 78.62 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.229 -0.442 . . . . 10.0 110.446 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 48.1 mt -64.3 -41.95 96.6 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.086 -0.709 . . . . 10.0 109.086 178.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -66.38 -36.05 81.87 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.398 -0.593 . . . . 10.0 109.398 178.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -68.41 -18.72 64.51 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.444 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -93.31 -46.74 7.23 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.529 -0.915 . . . . 10.0 108.529 178.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 89.1 mt -59.35 -35.2 73.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.553 -0.749 . . . . 10.0 111.782 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -53.57 -70.33 0.96 Allowed Glycine 0 C--N 1.332 0.31 0 N-CA-C 111.783 -0.527 . . . . 10.0 111.783 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.6 -33.05 87.68 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.077 1.851 . . . . 10.0 111.266 178.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 2.3 t -59.55 -47.22 91.72 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-N 116.48 -0.327 . . . . 10.0 111.168 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 3.0 p -65.29 -36.61 84.61 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 120.636 -0.426 . . . . 10.0 109.943 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -63.61 -47.16 82.55 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -64.47 -37.96 89.34 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.687 -0.688 . . . . 10.0 109.54 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . 0.44 ' HD1' ' HA ' ' A' ' 228' ' ' PHE . 3.3 m-30 -66.86 -43.89 82.42 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.289 178.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . 0.589 ' O ' ' HG2' ' A' ' 233' ' ' GLU . 3.3 m95 -60.1 -47.21 86.83 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.662 -0.496 . . . . 10.0 109.662 178.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.01 -42.59 98.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.458 178.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -62.64 -46.08 89.88 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.274 -0.639 . . . . 10.0 109.274 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 84.4 mt -65.84 -30.13 70.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.222 -0.899 . . . . 10.0 110.598 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' ' 229' ' ' TRP . 68.3 mm-40 -60.89 -49.42 77.55 Favored 'General case' 0 C--O 1.223 -0.314 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 178.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 14.5 mtmm -62.34 -42.14 99.14 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.509 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -65.93 -44.15 85.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.003 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 26.9 p -70.46 -26.69 63.75 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.419 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -69.39 -46.25 67.34 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.369 -0.974 . . . . 10.0 108.369 177.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -63.11 -39.96 98.62 Favored Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 109.732 -1.347 . . . . 10.0 109.732 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 33.6 mt -68.24 -33.82 75.1 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.986 -0.376 . . . . 10.0 109.986 178.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 21.6 mtm180 -65.79 -43.1 89.73 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.13 -0.692 . . . . 10.0 109.13 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -64.98 -41.1 95.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.608 -0.724 . . . . 10.0 109.172 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -65.73 -45.78 81.38 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.298 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . 0.49 ' O ' ' HB2' ' A' ' 247' ' ' LEU . 48.1 mmm -60.4 -48.25 82.58 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.964 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.9 p -59.53 -37.82 79.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.054 0.454 . . . . 10.0 111.236 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 93.5 mttt -78.61 -59.44 2.78 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.17 179.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -56.23 -50.13 72.18 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.983 0.735 . . . . 10.0 112.983 -178.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 243' ' ' MET . 21.4 mt -56.5 -51.59 67.92 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.582 0.23 . . . . 10.0 111.437 -179.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -67.65 -33.01 74.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.531 -0.304 . . . . 10.0 111.355 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . 0.449 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 0.2 OUTLIER -68.64 -43.5 76.14 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.604 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 48.4 t -67.91 -41.91 85.2 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.409 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.867 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 44.0 mttm -64.28 -42.96 96.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.712 0.291 . . . . 10.0 110.826 179.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -64.43 -40.81 96.47 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.109 -0.496 . . . . 10.0 109.945 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 7.7 mtpt -77.93 -21.81 50.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.811 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.46 ' HA ' ' HB2' ' A' ' 257' ' ' TYR . 0.5 OUTLIER -66.55 -26.26 37.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.413 -0.358 . . . . 10.0 110.057 179.349 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . 0.505 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 19.5 mt-30 -62.45 -61.79 6.94 Favored Pre-proline 0 N--CA 1.451 -0.408 0 CA-C-N 115.922 -0.581 . . . . 10.0 109.599 178.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . 0.505 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 19.7 Cg_endo -62.61 -27.06 76.01 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 121.741 1.627 . . . . 10.0 110.818 177.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . 0.494 ' HE1' ' CG ' ' C' ' 517' ' ' HIS . 3.9 m-30 -62.13 -60.61 3.35 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.838 -0.801 . . . . 10.0 108.838 178.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 86.5 mt -64.3 -35.01 79.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.915 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -64.55 -55.08 22.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.543 -0.299 . . . . 10.0 110.548 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -64.3 -42.05 96.55 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.325 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . 0.481 ' O ' ' HB2' ' A' ' 265' ' ' TRP . 4.7 m-30 -62.04 -38.69 89.68 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.422 -0.354 . . . . 10.0 110.122 178.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -67.81 -43.2 80.19 Favored 'General case' 0 C--O 1.22 -0.471 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -58.99 -49.34 78.26 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.767 ' HE3' ' HB1' ' C' ' 509' ' ' ALA . 14.6 mptt -63.94 -55.28 23.68 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.734 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . 0.481 ' HB2' ' O ' ' A' ' 261' ' ' PHE . 0.0 OUTLIER -58.22 -39.97 80.45 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.049 0.388 . . . . 10.0 112.049 -179.324 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . 0.46 ' O ' ' HG3' ' A' ' 270' ' ' GLU . 43.0 tt0 -63.47 -47.45 81.72 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -64.44 -44.66 90.44 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.724 -0.473 . . . . 10.0 109.724 178.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . 0.506 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 48.3 mt-10 -61.11 -38.05 84.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.653 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 14.9 ttt -70.56 -46.27 63.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.061 179.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 266' ' ' GLN . 40.8 mt-10 -63.84 -45.91 87.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.472 179.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 74.3 mt -63.47 -29.99 71.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.004 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . 0.506 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 0.1 OUTLIER -73.77 -45.98 48.45 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.103 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -61.62 -37.66 84.76 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.343 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -62.92 -20.4 65.15 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.216 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.584 ' O ' ' HB2' ' A' ' 279' ' ' LEU . 51.5 mttp -99.85 -30.86 11.8 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.952 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 272' ' ' TYR . 42.6 t -62.04 -42.56 95.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.879 179.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . 0.417 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 17.5 mt-10 -55.77 -59.25 12.02 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 111.695 0.257 . . . . 10.0 111.695 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . 0.417 ' HD3' ' HB2' ' A' ' 277' ' ' GLU . 29.1 Cg_endo -66.67 -36.97 23.01 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 121.639 1.559 . . . . 10.0 111.397 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.584 ' HB2' ' O ' ' A' ' 275' ' ' LYS . 3.0 mt -60.16 -44.76 94.74 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 120.666 0.269 . . . . 10.0 110.722 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 23.2 ttm180 -58.62 -42.14 87.52 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.174 -0.676 . . . . 10.0 109.174 179.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -69.73 -47.87 61.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.842 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -58.25 -47.29 84.03 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.016 0.436 . . . . 10.0 110.399 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 61.1 mt -66.93 -41.6 86.73 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.933 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -62.78 -56.4 17.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.495 0.188 . . . . 10.0 111.335 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -66.33 -41.57 89.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.892 0.377 . . . . 10.0 110.695 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -62.03 -49.43 75.29 Favored Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 111.621 -0.592 . . . . 10.0 111.621 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -67.17 -35.57 79.94 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 109.93 -0.396 . . . . 10.0 109.93 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 39.2 ttm180 -60.42 -45.14 94.68 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 178.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -63.1 -54.18 41.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.061 178.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 73.3 mttt -58.14 -46.42 85.68 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.476 -0.784 . . . . 10.0 111.551 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 60.7 mt -68.53 -42.4 78.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.576 -0.284 . . . . 10.0 111.622 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -61.19 -46.91 88.54 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.35 -0.241 . . . . 10.0 110.35 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -65.75 -36.31 83.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.762 0.315 . . . . 10.0 111.006 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 36.9 mt -69.86 -41.86 74.3 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 178.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -67.66 -37.46 82.42 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.021 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.3 -30.86 70.83 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.913 -0.585 . . . . 10.0 109.602 178.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . 0.543 ' HE2' ' HB2' ' C' ' 476' ' ' PRO . 18.6 tttp -82.25 -26.24 33.39 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.381 178.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 18.9 mt -67.01 -24.72 66.05 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.719 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . 0.438 ' HB2' ' CD ' ' A' ' 300' ' ' PRO . 31.4 m -65.85 -63.54 3.19 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.837 178.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . 0.438 ' CD ' ' HB2' ' A' ' 299' ' ' SER . 17.7 Cg_endo -61.64 -47.08 12.1 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 121.632 1.555 . . . . 10.0 111.732 178.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.535 HD22 ' HG2' ' C' ' 473' ' ' LYS . 80.2 mt -65.24 -28.62 69.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.726 0.298 . . . . 10.0 111.38 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -81.46 -45.58 7.32 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 110.802 -0.919 . . . . 10.0 110.802 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -62.22 -43.41 98.88 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.852 -0.425 . . . . 10.0 109.852 178.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -66.86 -31.72 72.51 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 109.535 -0.543 . . . . 10.0 109.535 178.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . 0.486 ' HB2' ' O ' ' A' ' 301' ' ' LEU . 12.9 tpt -67.86 -45.45 74.54 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 306' ' ' ARG . 49.5 mtt85 -66.95 -36.21 81.71 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.896 178.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -64.46 -47.52 78.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.24 178.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . 0.892 ' HG3' HD21 ' C' ' 469' ' ' LEU . 13.0 mmt180 -70.76 -33.32 70.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.168 178.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -63.62 -36.78 84.94 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 35.2 ttm105 -60.3 -50.89 71.85 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.17 -1.048 . . . . 10.0 108.17 177.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.16 88.45 Favored 'General case' 0 C--N 1.331 -0.203 0 O-C-N 123.702 0.626 . . . . 10.0 110.222 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . 0.685 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 5.2 m-70 -56.98 -57.61 11.78 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.958 -0.564 . . . . 10.0 109.886 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . 0.418 ' O ' ' HG3' ' A' ' 317' ' ' ARG . 47.8 t -68.56 -39.17 80.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.446 -0.797 . . . . 10.0 112.308 -178.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . 0.432 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 7.3 t0 -62.71 -45.69 91.6 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.579 0.228 . . . . 10.0 111.369 -179.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -65.46 -32.05 73.46 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.984 -0.747 . . . . 10.0 108.984 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 36.1 mt -71.88 -34.3 69.08 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 115.223 -0.899 . . . . 10.0 109.809 178.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.432 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 64.2 mtt180 -62.58 -49.89 73.47 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.636 -0.505 . . . . 10.0 109.636 178.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 2.9 m -66.57 -13.38 60.95 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.482 -0.781 . . . . 10.0 111.23 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -100.99 -43.0 6.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.4 -0.364 . . . . 10.0 110.754 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . 0.489 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 64.2 mt -67.65 -30.87 70.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.444 -0.344 . . . . 10.0 111.398 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . 0.403 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -57.32 -60.86 8.43 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 121.268 -0.173 . . . . 10.0 110.698 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.403 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 27.8 Cg_endo -66.16 -38.02 23.01 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.246 1.297 . . . . 10.0 110.385 177.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . 0.489 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 4.2 m-30 -55.57 -52.68 62.92 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 111.83 0.307 . . . . 10.0 111.83 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 22.0 p -63.96 -43.68 95.08 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 123.088 0.243 . . . . 10.0 111.603 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . 0.466 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 2.6 t70 -65.88 -41.78 91.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.996 0.427 . . . . 10.0 110.819 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . 0.46 ' O ' ' HG3' ' A' ' 330' ' ' ARG . 73.0 mt-10 -70.81 -30.11 66.47 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . 0.668 HD23 ' HD3' ' A' ' 330' ' ' ARG . 13.4 mt -66.34 -35.65 80.89 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 108.231 -1.025 . . . . 10.0 108.231 177.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . 0.466 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 59.8 mtt180 -64.99 -35.56 81.57 Favored 'General case' 0 C--O 1.223 -0.294 0 N-CA-C 108.676 -0.861 . . . . 10.0 108.676 177.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -67.48 -41.55 84.42 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.103 -0.703 . . . . 10.0 109.103 178.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . 0.668 ' HD3' HD23 ' A' ' 327' ' ' LEU . 4.6 mtp-105 -65.31 -45.54 83.93 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 108.984 -0.747 . . . . 10.0 108.984 178.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 44.2 mt -64.34 -38.24 90.32 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.89 179.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . 0.458 ' O ' ' HG2' ' A' ' 336' ' ' GLU . . . -63.55 -45.06 92.23 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.92 -44.76 94.12 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.304 -0.628 . . . . 10.0 109.304 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . 0.495 HH21 ' CG ' ' C' ' 444' ' ' ASP . 81.6 mtt180 -63.72 -43.27 97.04 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.989 178.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 55.4 mt -65.18 -44.99 86.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.668 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 332' ' ' ALA . 34.8 mm-40 -59.21 -42.48 91.05 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.572 -0.529 . . . . 10.0 109.572 178.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 341' ' ' ASN . . . -69.83 -39.8 76.26 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.246 -0.65 . . . . 10.0 109.246 178.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 7.0 tp -62.37 -28.66 69.92 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.402 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -70.43 -44.53 67.68 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.844 -0.428 . . . . 10.0 109.844 178.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -71.52 -49.8 37.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.444 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . 0.41 ' HB2' ' O ' ' A' ' 337' ' ' ALA . 1.2 m-20 -61.3 -46.57 89.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.363 -0.835 . . . . 10.0 109.938 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -64.95 -44.25 94.79 Favored Glycine 0 N--CA 1.449 -0.5 0 N-CA-C 111.687 -0.565 . . . . 10.0 111.687 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.87 -43.59 97.87 Favored Glycine 0 C--N 1.332 0.309 0 N-CA-C 110.756 -0.938 . . . . 10.0 110.756 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -66.08 -45.01 82.8 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.281 -0.637 . . . . 10.0 109.281 178.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . 0.408 ' HE ' ' CD ' ' C' ' 433' ' ' GLU . 59.8 mtt180 -56.48 -48.46 77.1 Favored 'General case' 0 C--O 1.224 -0.257 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 81.9 mt -61.18 -39.73 91.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.979 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -66.63 -48.81 68.25 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.563 -0.532 . . . . 10.0 109.563 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -59.39 -46.83 87.58 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.898 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -62.42 -42.09 99.18 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.092 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 6.4 m80 -62.43 -43.93 97.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.747 0.308 . . . . 10.0 110.377 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.99 -45.16 94.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.932 0.396 . . . . 10.0 109.947 178.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . 0.888 ' HG2' HG13 ' C' ' 422' ' ' VAL . 11.0 mttp -67.75 -35.89 79.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.877 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.64 -35.88 81.23 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 52.2 m -61.34 -50.86 71.23 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.771 -0.825 . . . . 10.0 108.771 178.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -65.75 -28.14 68.82 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.669 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . 0.476 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 2.2 m80 -64.84 -40.2 94.79 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.249 -1.019 . . . . 10.0 108.249 177.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 83.0 mt -72.82 -41.43 64.91 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.413 -0.812 . . . . 10.0 109.573 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 4.9 m -56.01 -53.87 51.69 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.062 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . 0.505 ' HA ' ' OE1' ' A' ' 362' ' ' GLU . 61.3 p -70.9 -19.65 62.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.004 -0.543 . . . . 10.0 110.789 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 356' ' ' HIS . 34.8 tp -68.43 -42.85 78.3 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.393 -0.595 . . . . 10.0 109.393 178.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.44 -30.32 70.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.271 0.558 . . . . 10.0 109.893 178.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . 0.505 ' OE1' ' HA ' ' A' ' 359' ' ' THR . 35.4 mt-10 -78.19 5.8 9.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.441 -0.799 . . . . 10.0 111.311 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.692 ' HD3' HG23 ' C' ' 411' ' ' THR . 27.0 mttp -131.1 -46.38 1.01 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.025 -0.534 . . . . 10.0 109.65 178.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.17 -11.69 61.07 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.964 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.503 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 90.7 mttt -108.79 -72.77 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.43 0 CA-C-O 119.336 -0.364 . . . . 10.0 111.97 178.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.503 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 31.5 Cg_endo -64.16 -51.32 2.2 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 121.553 1.502 . . . . 10.0 112.862 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . 0.512 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -61.98 -42.32 99.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 10.0 111.384 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 368' ' ' LEU . 9.3 mt -67.39 -36.82 82.08 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.99 -0.284 . . . . 10.0 110.874 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . 0.752 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 68.9 mt-10 -66.66 -35.34 79.93 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.905 -0.776 . . . . 10.0 108.905 177.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -63.94 -47.01 82.17 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.636 -0.876 . . . . 10.0 108.636 178.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 1.5 mt -59.76 -44.48 93.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.309 179.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.458 HH11 ' HD2' ' A' ' 372' ' ' ARG . 58.8 mtt180 -66.79 -42.34 86.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.045 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.752 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.6 mt-30 -60.96 -34.79 75.3 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.686 -0.688 . . . . 20.0 111.413 178.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -79.19 -35.32 30.5 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 109.583 -1.407 . . . . 10.0 109.583 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 18.8 mt -57.64 -35.49 70.56 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.667 0.247 . . . . 10.0 111.667 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . 0.566 ' HB2' ' HD3' ' A' ' 377' ' ' PRO . 22.0 mt -56.59 -65.83 1.46 Allowed Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 111.737 0.273 . . . . 10.0 111.737 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.566 ' HD3' ' HB2' ' A' ' 376' ' ' LEU . 30.1 Cg_endo -65.22 -33.95 47.23 Favored 'Trans proline' 0 C--N 1.357 1.012 0 C-N-CA 121.72 1.614 . . . . 10.0 111.828 179.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 19.2 t -62.68 -50.86 78.05 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 N-CA-C 110.429 -0.211 . . . . 10.0 110.429 179.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 56.0 mt -61.84 -35.99 79.87 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . 0.455 ' O ' HG23 ' A' ' 384' ' ' VAL . 45.2 mt-10 -62.99 -52.65 62.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.309 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.8 p -61.54 -36.71 81.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.736 0.303 . . . . 10.0 110.482 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -65.92 -43.52 87.87 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 178.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 79.7 mttt -67.04 -39.14 86.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.697 179.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 380' ' ' GLU . 54.1 t -60.72 -45.74 97.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 109.67 -0.493 . . . . 10.0 109.67 178.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.0 p -69.34 -41.98 75.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.446 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . 0.441 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 5.6 m-30 -63.03 -49.48 74.46 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.597 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 82.8 mt -58.82 -38.39 78.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.968 0.413 . . . . 10.0 111.017 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 14.7 m -72.73 -37.36 67.78 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.12 178.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -70.07 -34.5 73.27 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.931 0.396 . . . . 10.0 110.661 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 70.0 mt -58.87 -47.07 86.2 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.277 179.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 77.0 mt-10 -68.62 -29.67 68.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.195 0.522 . . . . 10.0 110.039 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.42 -36.92 83.88 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.699 179.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -68.26 -46.57 70.06 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.149 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.2 -30.27 70.97 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.288 -0.415 . . . . 10.0 111.96 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -72.47 -15.67 61.8 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.02 0.438 . . . . 10.0 110.946 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.98 -48.78 5.28 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.518 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 96.6 mt -86.85 59.74 5.82 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.675 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 . . . . . 0 N--CA 1.471 0.586 0 N-CA-C 112.632 0.604 . . . . 10.0 112.632 178.861 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 78.4 mt . . . . . 0 CA--C 1.518 -0.277 0 N-CA-C 109.876 -0.416 . . . . 10.0 109.876 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . 0.427 ' HG3' ' H ' ' C' ' 400' ' ' LYS . 1.6 mtmm -60.41 -38.08 82.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.886 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' C' ' 405' ' ' TRP . 57.4 mt -64.85 -40.75 95.65 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.379 -0.828 . . . . 10.0 111.152 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 98.4 mt -71.8 -40.4 69.21 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 120.862 0.363 . . . . 10.0 111.238 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.09 -46.62 77.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.448 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . 0.508 ' O ' HG23 ' C' ' 408' ' ' VAL . 1.0 OUTLIER -65.19 -38.29 90.03 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 179.262 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . 0.501 ' HB2' ' O ' ' C' ' 401' ' ' LEU . 1.7 t90 -61.1 -34.88 75.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.437 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -64.81 -45.53 85.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.132 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 1.6 m -61.71 -36.33 80.63 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.092 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . 0.508 HG23 ' O ' ' C' ' 404' ' ' ASN . 96.9 t -67.01 -37.75 79.99 Favored 'Isoleucine or valine' 0 C--O 1.231 0.107 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 178.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 38.6 m -62.93 -42.6 99.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.737 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 14.5 m -62.44 -30.64 71.38 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . 0.692 HG23 ' HD3' ' A' ' 363' ' ' LYS . 47.1 m -66.81 -33.57 75.91 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.745 178.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -70.52 -38.47 74.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.13 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 2.0 m -63.15 -40.94 99.03 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . 0.721 ' HA ' ' HG3' ' C' ' 417' ' ' GLU . 36.9 mmtt -69.25 -31.85 70.67 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.033 179.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 46.1 tp -71.06 -37.92 72.51 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . 0.578 ' HA ' ' HB2' ' C' ' 419' ' ' LEU . 54.6 mtt180 -66.7 -23.32 66.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.631 -0.713 . . . . 10.0 111.03 179.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . 0.721 ' HG3' ' HA ' ' C' ' 414' ' ' LYS . 2.3 mt-10 -64.56 -36.08 83.07 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 108.243 -1.021 . . . . 10.0 108.243 177.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . 0.779 ' O ' ' HB ' ' C' ' 422' ' ' VAL . 18.4 mt-30 -81.66 -30.03 32.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.033 -0.985 . . . . 10.0 109.277 178.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . 0.578 ' HB2' ' HA ' ' C' ' 416' ' ' ARG . 71.6 mt -69.27 -11.62 60.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.318 179.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -97.89 -99.75 2.07 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.159 -0.543 . . . . 10.0 112.038 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -49.44 -43.67 37.6 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.789 2.993 . . . . 10.0 113.769 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . 0.888 HG13 ' HG2' ' A' ' 352' ' ' LYS . 55.1 t -59.66 -46.95 92.78 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-O 120.531 0.205 . . . . 10.0 111.085 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 5.0 m -65.97 -39.65 90.56 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.952 -0.388 . . . . 10.0 109.952 178.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -60.54 -45.72 92.82 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -64.3 -30.88 71.91 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.715 -0.675 . . . . 10.0 109.551 178.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -67.6 -38.17 83.6 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.885 -0.783 . . . . 10.0 108.885 178.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . 0.456 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 44.4 m95 -67.05 -41.66 86.13 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 108.178 -1.045 . . . . 10.0 108.178 177.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -60.56 -40.52 91.93 Favored 'General case' 0 C--N 1.333 -0.11 0 N-CA-C 108.349 -0.982 . . . . 10.0 108.349 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -63.95 -46.53 84.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.447 178.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 50.0 mt -61.69 -28.82 69.67 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.106 179.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 67.6 mm-40 -64.96 -46.43 81.55 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.612 -0.885 . . . . 10.0 108.612 177.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -62.64 -40.91 98.5 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 108.405 -0.961 . . . . 10.0 108.405 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . 0.408 ' CD ' ' HE ' ' A' ' 345' ' ' ARG . 10.3 mt-10 -60.08 -55.43 34.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.115 -0.948 . . . . 10.0 110.914 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 3.1 p -59.14 -38.3 79.36 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.967 0.358 . . . . 10.0 111.967 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -63.55 -50.6 68.88 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 110.03 -0.359 . . . . 10.0 110.03 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.8 -48.03 76.57 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.677 -0.773 . . . . 10.0 111.358 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 74.5 mt -57.74 -40.04 78.73 Favored 'General case' 0 C--O 1.22 -0.455 0 O-C-N 123.556 0.21 . . . . 10.0 110.986 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -66.47 -33.56 75.97 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.706 -0.398 . . . . 10.0 110.914 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -67.52 -41.38 84.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.839 -0.8 . . . . 10.0 108.839 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . 0.464 ' O ' ' HB2' ' C' ' 444' ' ' ASP . 28.0 mt-10 -69.84 -53.48 17.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.328 -0.851 . . . . 10.0 109.77 178.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 80.7 mmm -57.92 -41.04 81.84 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.977 0.732 . . . . 10.0 112.977 -178.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . 0.482 ' O ' ' HG3' ' C' ' 446' ' ' GLU . 33.4 p -60.91 -49.91 75.56 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.643 -0.423 . . . . 10.0 110.003 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 8.1 tttt -67.71 -37.92 82.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.741 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . 0.495 ' CG ' HH21 ' A' ' 334' ' ' ARG . 0.4 OUTLIER -58.32 -51.52 69.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.285 178.951 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 85.2 mt -65.98 -37.33 85.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.917 -0.583 . . . . 10.0 111.119 179.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' C' ' 442' ' ' SER . 38.1 mt-10 -63.3 -47.13 83.58 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.108 -0.701 . . . . 10.0 109.108 178.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . 0.531 ' HB3' ' HE ' ' A' ' 330' ' ' ARG . 10.9 mm-40 -65.84 -36.0 82.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.594 -0.73 . . . . 10.0 109.308 178.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.38 -47.12 93.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.871 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 69.7 mttt -66.28 -30.44 70.86 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.962 0.411 . . . . 10.0 110.87 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -86.3 5.29 35.22 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.543 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 323' ' ' TYR . 37.8 mttp -124.93 -36.67 2.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.703 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.0 -44.52 99.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 110.29 -0.263 . . . . 10.0 110.29 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . 0.819 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 41.0 mt-30 -59.31 -58.84 16.49 Favored Pre-proline 0 CA--C 1.535 0.365 0 CA-C-N 116.541 -0.3 . . . . 10.0 111.014 179.147 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . 0.819 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 33.0 Cg_exo -60.65 -34.77 91.78 Favored 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 122.035 1.824 . . . . 10.0 112.013 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . 0.497 ' O ' ' HB2' ' C' ' 459' ' ' PHE . 16.9 t80 -67.17 -50.14 62.2 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.209 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 28.1 mt -64.8 -39.94 94.41 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 110.203 -0.295 . . . . 10.0 110.203 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.73 -47.03 88.11 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . 0.608 ' HA ' ' HD2' ' C' ' 461' ' ' LYS . 2.2 t70 -72.73 -34.15 66.89 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.445 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . 0.497 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 0.7 OUTLIER -70.64 -32.33 69.59 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 178.893 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -62.51 -34.47 76.96 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 178.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . 0.608 ' HD2' ' HA ' ' C' ' 458' ' ' ASP . 58.4 mttt -66.09 -43.39 87.47 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.542 -0.91 . . . . 10.0 108.542 177.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' C' ' 458' ' ' ASP . 37.7 mmtm -60.93 -45.46 94.59 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.448 -0.797 . . . . 10.0 108.975 178.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -60.68 -39.53 88.82 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.395 178.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . 0.403 HE21 ' HB3' ' C' ' 464' ' ' GLN . 6.9 mt-30 -66.97 -49.09 66.49 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 110.095 -0.335 . . . . 10.0 110.095 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 1.26 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 49.0 mt-10 -57.09 -37.5 71.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.816 0.341 . . . . 10.0 110.163 179.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.25 -52.56 10.58 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.903 -0.59 . . . . 10.0 111.078 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 74.3 mmm -60.79 -49.0 79.24 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.615 0.245 . . . . 10.0 111.47 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -67.27 -37.28 83.22 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.679 -0.489 . . . . 10.0 109.679 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 1.26 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 96.5 mt -61.96 -44.47 96.68 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 115.803 -0.635 . . . . 20.0 109.513 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . 0.496 ' HA ' ' HB2' ' C' ' 473' ' ' LYS . 22.2 m-30 -70.85 -22.95 62.25 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.497 179.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 26.9 mtt180 -67.76 -33.85 75.66 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 108.801 -0.814 . . . . 10.0 108.801 178.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -93.04 10.09 32.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.324 -0.853 . . . . 10.0 109.905 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . 0.535 ' HG2' HD22 ' A' ' 301' ' ' LEU . 75.9 mttt -121.46 -67.3 0.98 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.755 179.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 61.8 t -55.77 -42.2 69.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.01 -0.541 . . . . 10.0 112.229 -178.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -59.93 -62.61 5.55 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 112.293 0.479 . . . . 10.0 112.293 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . 0.543 ' HB2' ' HE2' ' A' ' 297' ' ' LYS . 28.8 Cg_endo -64.19 -32.97 62.22 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 121.69 1.594 . . . . 10.0 111.424 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' C' ' 477' ' ' LEU . 23.6 mt -65.9 -42.72 89.86 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 120.993 -0.283 . . . . 10.0 110.25 178.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . 0.439 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 58.4 mtt180 -62.88 -38.22 90.02 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -66.13 -50.73 62.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.892 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.27 -39.48 94.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.785 0.326 . . . . 10.0 110.198 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 17.9 mt -65.57 -33.71 76.54 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 178.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . 0.439 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 4.5 tt0 -71.93 -38.91 69.78 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 178.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -64.64 -43.1 94.76 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.352 -0.981 . . . . 10.0 108.352 177.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -69.25 -33.44 73.44 Favored Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 110.826 -0.91 . . . . 10.0 110.826 178.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.77 -45.58 70.99 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' C' ' 486' ' ' ARG . 57.0 mtt180 -61.73 -36.68 81.67 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.215 -0.661 . . . . 10.0 109.215 178.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -65.74 -49.32 68.83 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 177.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -63.43 -37.09 85.95 Favored 'General case' 0 C--O 1.226 -0.159 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.276 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . 0.609 ' O ' ' HB2' ' C' ' 493' ' ' GLN . 60.4 mt -64.95 -32.33 74.0 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 178.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 6.3 m80 -73.87 -43.14 59.5 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.26 -1.015 . . . . 10.0 108.26 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . 0.436 ' O ' ' HE2' ' C' ' 495' ' ' LYS . 22.5 mt-10 -58.77 -44.1 90.55 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.289 -0.869 . . . . 10.0 109.2 178.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 90.1 mt -74.95 -39.95 61.06 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 115.431 -0.804 . . . . 10.0 111.703 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . 0.609 ' HB2' ' O ' ' C' ' 489' ' ' LEU . 2.5 tt0 -62.57 -44.48 96.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.792 0.33 . . . . 10.0 110.607 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -75.27 4.65 6.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.412 0.625 . . . . 10.0 110.844 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.543 ' O ' ' HB2' ' C' ' 499' ' ' LEU . 0.6 OUTLIER -114.39 -46.33 2.98 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.18 178.484 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 74.1 mt -63.8 -35.82 81.87 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.992 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . 0.44 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 22.9 m -62.68 -59.8 11.67 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 120.67 -0.412 . . . . 10.0 111.253 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . 0.44 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 30.4 Cg_endo -65.85 -40.78 15.75 Favored 'Trans proline' 0 C--N 1.356 0.936 0 C-N-CA 121.629 1.552 . . . . 10.0 111.721 178.542 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 12.8 mt -66.81 -37.07 83.81 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 121.237 -0.185 . . . . 10.0 110.837 179.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.71 -45.56 92.42 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.06 -1.216 . . . . 10.0 110.06 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -62.69 -42.01 99.41 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.237 -0.653 . . . . 10.0 109.237 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . 0.512 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 19.6 tt0 -65.27 -47.67 75.88 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.293 -0.867 . . . . 10.0 109.74 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . 0.513 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 77.1 mmm -60.98 -36.83 80.47 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.999 -0.371 . . . . 10.0 109.999 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . 0.428 ' O ' ' HG3' ' C' ' 508' ' ' ARG . 90.8 mtt180 -62.54 -48.0 81.44 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -65.8 -38.29 88.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.02 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.513 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 56.3 mtt180 -60.93 -47.99 83.87 Favored 'General case' 0 CA--C 1.522 -0.125 0 N-CA-C 108.291 -1.003 . . . . 10.0 108.291 177.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.95 -42.89 95.05 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.43 -0.805 . . . . 10.0 109.878 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . 0.652 ' O ' ' HB2' ' C' ' 512' ' ' ASP . 57.1 mtt180 -59.65 -51.05 71.46 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 109.612 -0.514 . . . . 10.0 109.612 178.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . 0.767 ' HB1' ' HE3' ' A' ' 264' ' ' LYS . . . -59.57 -38.38 80.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.157 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . 0.404 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 11.2 m170 -71.27 -56.94 5.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.566 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . 0.417 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 75.9 t -61.46 -39.27 82.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.941 -179.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.652 ' HB2' ' O ' ' C' ' 508' ' ' ARG . 0.4 OUTLIER -61.75 -41.96 98.35 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.342 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.9 -36.46 82.31 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.968 -0.752 . . . . 10.0 108.968 178.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 93.1 mt -67.39 -37.78 83.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.258 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . 0.52 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 83.9 mtt180 -58.43 -56.01 27.63 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.16 0.505 . . . . 10.0 110.256 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.75 22.74 0.46 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.6 0.593 . . . . 10.0 112.6 -179.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . 0.494 ' CG ' ' HE1' ' A' ' 257' ' ' TYR . 14.7 m80 -138.95 -43.48 0.47 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 121.87 -0.518 . . . . 10.0 111.562 179.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 86.0 mt -73.79 -38.43 64.63 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . 0.402 ' N ' ' HD2' ' C' ' 520' ' ' PRO . . . -61.79 -56.39 32.89 Favored Pre-proline 0 CA--C 1.535 0.397 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.373 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . 0.402 ' HD2' ' N ' ' C' ' 519' ' ' ALA . 18.1 Cg_endo -62.0 -38.08 60.2 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 121.549 1.499 . . . . 10.0 111.607 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . 0.4 ' O ' ' HB2' ' C' ' 524' ' ' GLU . 8.7 t80 -68.24 -39.28 82.33 Favored 'General case' 0 C--N 1.334 -0.091 0 C-N-CA 120.677 -0.409 . . . . 10.0 111.69 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . 0.452 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 10.2 p -66.36 -34.28 77.62 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 109.119 -0.697 . . . . 10.0 109.119 178.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -68.73 -36.6 78.6 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 177.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' C' ' 521' ' ' TYR . 47.4 mt-10 -62.79 -44.78 95.29 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 107.64 -1.244 . . . . 10.0 107.64 176.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 93.5 mt -61.89 -43.8 98.1 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 114.962 -1.017 . . . . 10.0 109.69 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . 0.452 ' HG3' ' O ' ' C' ' 522' ' ' SER . 66.2 mtt180 -56.98 -45.66 82.76 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.991 -0.374 . . . . 10.0 109.991 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -62.72 -49.39 75.24 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.169 -0.469 . . . . 10.0 111.043 179.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' C' ' 528' ' ' ARG . 52.9 mtt85 -66.32 -42.4 88.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.162 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 67.2 mt -66.16 -33.48 75.87 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.416 -0.356 . . . . 10.0 110.25 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . 0.413 ' O ' ' HG3' ' C' ' 534' ' ' GLU . . . -64.84 -42.82 94.61 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.885 -0.784 . . . . 10.0 108.885 178.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . 0.404 ' O ' ' HB2' ' C' ' 534' ' ' GLU . . . -67.67 -40.69 84.43 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.621 178.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . 0.423 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 24.2 ttm180 -64.38 -42.32 96.22 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 34.8 mt -64.47 -36.95 85.84 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.959 -0.564 . . . . 10.0 109.566 178.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' C' ' 530' ' ' ALA . 25.1 mt-10 -58.41 -47.82 82.67 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.713 -0.847 . . . . 10.0 108.713 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.18 -37.99 89.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.557 -0.747 . . . . 10.0 109.769 178.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 76.7 mt -68.29 -27.03 65.96 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.627 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -81.65 -40.27 23.15 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -68.83 -53.45 21.4 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.517 -0.549 . . . . 10.0 109.517 178.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -66.94 -40.56 87.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.562 179.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . 0.433 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -63.46 -45.85 93.91 Favored Glycine 0 C--O 1.226 -0.348 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.989 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -61.33 -40.35 98.5 Favored Glycine 0 N--CA 1.449 -0.441 0 N-CA-C 110.754 -0.938 . . . . 10.0 110.754 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -66.19 -44.65 83.34 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 178.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 69.9 mtt180 -61.46 -39.5 91.07 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.747 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 62.6 mt -61.35 -41.8 97.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.717 0.294 . . . . 10.0 110.569 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -70.58 -38.78 74.09 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.4 -0.593 . . . . 10.0 109.4 178.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -63.22 -49.22 75.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.257 -0.883 . . . . 10.0 109.709 178.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -59.14 -42.52 90.85 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 115.694 -0.684 . . . . 10.0 109.913 178.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.3 m170 -60.83 -48.68 80.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.962 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -62.56 -47.82 82.19 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.864 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.65 -31.66 72.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.138 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . 0.503 ' O ' ' HG ' ' C' ' 555' ' ' LEU . . . -66.26 -49.98 65.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.251 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.23 -35.24 75.0 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.937 0.399 . . . . 10.0 110.507 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -69.09 -31.46 70.19 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.479 179.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 62.1 m170 -82.74 -26.02 32.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.518 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' C' ' 551' ' ' ALA . 82.2 mt -64.48 -35.38 80.74 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.88 -42.57 94.71 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.937 -0.764 . . . . 10.0 108.937 178.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.75 -38.39 88.97 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.647 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 51.8 mt -66.32 -34.64 78.45 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 178.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 70.9 m -66.23 -31.4 72.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.582 178.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . 0.424 ' O ' ' HD2' ' C' ' 564' ' ' PRO . 3.1 mm-40 -64.63 -25.21 67.86 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 121.515 0.674 . . . . 10.0 109.518 178.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . 0.747 ' HA ' ' HB3' ' C' ' 565' ' ' ALA . 0.0 OUTLIER -98.64 -27.36 14.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.532 179.324 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -79.47 -27.2 41.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 10.0 112.087 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . 0.953 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 89.1 mttt -105.88 -73.87 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . 0.953 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 32.4 Cg_exo -60.3 -52.49 3.99 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.279 1.986 . . . . 10.0 112.876 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . 0.747 ' HB3' ' HA ' ' C' ' 561' ' ' LYS . . . -63.15 -45.58 91.22 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.672 0.619 . . . . 10.0 112.672 -179.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . 0.508 HD23 HD12 ' C' ' 569' ' ' LEU . 12.0 mt -62.57 -36.6 83.19 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.85 -0.34 . . . . 10.0 111.061 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . 1.162 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 53.3 tt0 -67.9 -36.14 79.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.974 -0.75 . . . . 10.0 108.974 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -68.57 -44.4 74.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.487 -0.778 . . . . 10.0 109.323 178.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . 0.508 HD12 HD23 ' C' ' 566' ' ' LEU . 77.5 mt -61.42 -46.29 90.74 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.534 179.228 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . 0.559 ' HA ' ' HB2' ' C' ' 573' ' ' LEU . 45.5 mtt180 -71.09 -29.35 65.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.92 0.391 . . . . 10.0 110.391 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . 1.162 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 99.0 mt-30 -65.3 -29.69 70.48 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.667 -0.697 . . . . 20.0 109.98 178.107 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -90.15 -27.0 22.3 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 109.519 -1.432 . . . . 10.0 109.519 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . 0.559 ' HB2' ' HA ' ' C' ' 570' ' ' ARG . 14.5 mt -59.12 -43.08 91.92 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.56 0.207 . . . . 10.0 111.56 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 93.8 mt -55.57 -61.04 6.86 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 112.126 0.417 . . . . 10.0 112.126 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -58.85 -35.98 97.72 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 122.092 1.861 . . . . 10.0 111.737 178.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 18.0 t -65.41 -45.21 93.74 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 110.052 -0.351 . . . . 10.0 110.052 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 63.2 mt -63.13 -38.7 92.2 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . 0.412 ' O ' HG23 ' C' ' 582' ' ' VAL . 54.8 mt-10 -65.17 -49.32 70.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.887 178.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 2.8 p -62.5 -41.39 98.79 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.025 0.44 . . . . 10.0 110.175 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -64.71 -41.02 96.3 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.805 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -61.33 -47.16 87.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.12 178.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . 0.412 HG23 ' O ' ' C' ' 578' ' ' GLU . 84.1 t -60.43 -42.24 90.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.869 -0.419 . . . . 10.0 109.869 179.077 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 20.0 m -64.29 -44.27 92.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.319 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . 0.445 ' O ' ' HG ' ' C' ' 588' ' ' LEU . 8.2 m-85 -66.06 -46.64 77.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.842 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 29.5 mt -55.65 -48.48 74.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.803 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . 0.423 ' O ' ' HG3' ' C' ' 590' ' ' GLU . 5.1 m -66.56 -42.14 87.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.175 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -61.65 -42.51 99.01 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.287 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' C' ' 584' ' ' PHE . 84.7 mt -59.09 -40.82 86.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.06 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . 0.449 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 15.8 mt-10 -66.62 -38.4 86.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.961 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' C' ' 586' ' ' SER . 51.8 mt-10 -72.6 -40.46 66.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.084 0.469 . . . . 10.0 110.853 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 8.4 m-30 -66.25 -44.93 82.3 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.962 -0.563 . . . . 10.0 112.172 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 2.7 p -59.5 -33.48 71.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.81 0.338 . . . . 10.0 111.699 -179.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 86.8 mttt -69.0 -20.23 64.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.194 0.521 . . . . 10.0 111.349 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.13 -2.93 51.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.891 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 81.9 mt -119.79 16.59 12.7 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.12 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.616 -0.707 . . . . 10.0 109.664 179.811 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.6 ttt . . . . . 0 C--O 1.233 0.234 0 CA-C-O 121.064 0.459 . . . . 10.0 110.321 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.36 132.54 47.24 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.628 -0.715 . . . . 10.0 111.446 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.552 ' OE2' ' H42' ' A' ' 23' ' ' PCW . 0.7 OUTLIER -96.22 124.14 40.11 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.458 -0.571 . . . . 10.0 109.458 178.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -114.76 120.97 41.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.785 0.326 . . . . 10.0 110.452 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.557 ' HG2' ' H62' ' A' ' 23' ' ' PCW . 23.9 mtmm -91.01 111.05 22.34 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.248 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.462 HD22 HD23 ' B' ' 159' ' ' LEU . 15.0 mt -107.75 119.62 39.95 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.478 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 55.4 t -103.44 124.25 57.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 120.914 0.388 . . . . 10.0 110.632 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 22.9 t -98.8 112.53 31.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.564 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 22.9 m -109.41 161.6 7.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.789 0.328 . . . . 10.0 111.075 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 156.95 -179.67 32.57 Favored Glycine 0 N--CA 1.446 -0.661 0 N-CA-C 111.22 -0.752 . . . . 10.0 111.22 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -83.66 173.87 11.0 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.957 0.408 . . . . 10.0 111.11 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -84.6 118.07 4.64 Favored Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 120.597 -0.811 . . . . 10.0 112.016 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 110.96 -1.94 28.61 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.419 -0.896 . . . . 10.0 112.959 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 27.8 m -73.05 -38.69 56.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 111.996 0.369 . . . . 10.0 111.996 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 113.9 33.72 1.8 Allowed Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.383 -0.913 . . . . 10.0 113.264 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.403 ' HB2' ' HE3' ' B' ' 16' ' ' LYS . 38.5 mtmt -62.28 -58.79 6.41 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.835 0.35 . . . . 10.0 111.119 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . 0.409 ' O ' HG13 ' B' ' 21' ' ' ILE . 0.8 OUTLIER -57.89 -33.22 68.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.519 -0.764 . . . . 10.0 111.616 -179.537 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.54 -41.45 94.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.955 0.407 . . . . 10.0 110.273 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 91.5 mt -67.4 -39.23 85.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.012 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 2.1 m -64.42 -49.28 72.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.879 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . 0.409 HG13 ' O ' ' B' ' 17' ' ' SER . 68.8 mt -64.08 -31.11 52.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.107 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.606 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 9.2 tp-100 -68.92 -30.56 69.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.661 0.267 . . . . 10.0 110.906 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.2 tp -87.6 -35.36 18.12 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.182 0.515 . . . . 10.0 111.088 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 43.7 mm -80.83 -55.57 8.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 112.548 0.573 . . . . 10.0 112.548 -178.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.434 ' OE1' ' HA ' ' D' ' 840' ' ' VAL . 15.3 mt-30 -96.98 -15.58 21.03 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.735 0.642 . . . . 10.0 112.735 -178.161 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.606 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 86.2 m-20 65.58 29.73 10.88 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.71 0.767 . . . . 10.0 109.208 -178.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -128.76 138.09 51.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.858 -1.064 . . . . 10.0 109.479 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -94.61 139.17 31.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.301 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 m -103.39 114.16 42.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.057 -0.519 . . . . 10.0 110.752 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -91.55 6.82 44.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.343 0.592 . . . . 10.0 109.782 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -94.72 158.73 15.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.306 -0.861 . . . . 10.0 110.207 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.567 ' HA ' H5'1 ' B' ' 201' ' ' GNP . 2.2 t80 -105.43 79.96 1.52 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.0 0.428 . . . . 10.0 110.054 179.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . 0.483 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 1.6 t0 -98.64 130.81 27.08 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.383 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 17.4 Cg_exo -69.16 -172.84 0.55 Allowed 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.196 2.598 . . . . 10.0 112.286 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -169.94 143.48 2.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.389 -0.369 . . . . 10.0 111.121 -179.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.584 ' HB ' ' HB ' ' D' ' 821' ' ' VAL . 11.5 mt -115.99 -62.58 2.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 108.458 -0.942 . . . . 10.0 108.458 178.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.472 ' O ' HG23 ' D' ' 821' ' ' VAL . 2.5 tt0 -154.74 92.5 1.48 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.298 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . 0.624 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 61.1 m-20 -109.21 160.05 16.42 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.187 179.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.6 p -148.24 138.3 22.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 112.274 0.472 . . . . 10.0 112.274 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . 0.604 ' CE2' HG22 ' D' ' 840' ' ' VAL . 1.5 m-85 -128.55 151.5 49.38 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.847 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . 0.616 ' NH1' ' HB2' ' D' ' 817' ' ' LYS . 5.1 ttp180 -137.25 126.46 24.64 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.521 0.2 . . . . 10.0 110.634 -178.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 8.6 tttm -151.06 141.03 22.02 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.369 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -88.94 135.14 33.7 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.14 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 21.7 m -137.54 167.21 23.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.852 0.358 . . . . 10.0 111.227 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 58.9 t -115.48 114.41 46.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.669 -0.696 . . . . 10.0 109.744 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 46.1 mt -127.27 121.0 56.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.337 -179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 66.25 21.88 10.99 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.432 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.51 -20.39 50.88 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 121.033 -0.604 . . . . 10.0 112.45 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -88.46 150.43 23.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.997 0.427 . . . . 10.0 110.907 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 9.8 t -103.58 137.5 41.57 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 108.505 -0.924 . . . . 10.0 108.505 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 3.6 p -147.84 153.24 38.89 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.954 0.407 . . . . 10.0 111.529 -178.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 26.5 tp -100.93 117.03 34.18 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.619 -0.882 . . . . 10.0 108.619 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.553 ' O ' ' HA ' ' B' ' 41' ' ' ARG . 46.7 mt -92.43 120.52 33.0 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.464 0.542 . . . . 10.0 112.464 -178.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.54 ' OD2' ' H71' ' A' ' 23' ' ' PCW . 5.0 t70 -104.77 90.75 3.58 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 106.992 -1.484 . . . . 10.0 106.992 177.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 13.5 mt -84.9 134.56 26.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.729 -0.669 . . . . 10.0 112.055 -177.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.493 HD12 ' O ' ' B' ' 38' ' ' ASP . 63.7 tp -112.36 111.12 21.76 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.582 -0.735 . . . . 10.0 111.348 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.624 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 6.5 t70 -89.95 91.04 8.42 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.34 -0.985 . . . . 10.0 108.34 178.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 81.7 p -78.36 171.7 14.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.87 -178.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.04 158.71 27.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.692 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -82.86 -47.83 5.72 Favored Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 110.573 -1.011 . . . . 10.0 110.573 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -127.31 118.99 25.26 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.28 -0.637 . . . . 20.0 109.28 178.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.417 ' OE2' ' HB2' ' B' ' 68' ' ' ARG . 8.9 tt0 -137.71 166.95 22.7 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.502 -179.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -115.59 -160.49 0.75 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.053 -0.521 . . . . 10.0 109.969 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . 0.403 ' CZ ' ' H72' ' A' ' 8' ' ' PCW . 26.9 t80 -71.38 104.56 3.23 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.75 -0.463 . . . . 10.0 109.75 178.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 68.4 m -136.99 135.49 37.68 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.974 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . 0.44 ' HB2' ' H61' ' A' ' 8' ' ' PCW . . . -65.96 -33.55 76.08 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.543 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 63.6 mmm -61.65 -41.52 97.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 10.0 109.984 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.467 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 58.9 ttt85 -64.18 -45.77 86.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.604 -0.726 . . . . 10.0 110.797 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.448 ' OD1' HG12 ' B' ' 103' ' ' VAL . 2.6 t0 -62.05 -38.38 88.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.194 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.649 ' HB2' ' H73' ' A' ' 27' ' ' PCW . 18.7 tp60 -69.02 -47.4 65.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.626 -0.716 . . . . 10.0 112.099 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . 0.467 ' CE2' ' HA ' ' B' ' 68' ' ' ARG 0.292 0.2 OUTLIER -69.01 -23.18 64.06 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 114.14 1.163 . . . . 10.0 114.14 -178.722 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . 0.597 ' HB3' HG21 ' B' ' 103' ' ' VAL . 55.4 mtm -87.42 -25.67 23.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.198 0.523 . . . . 10.0 110.3 178.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . 0.637 HH21 ' HA ' ' B' ' 103' ' ' VAL . 15.4 ttm180 -67.34 -28.7 68.19 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.914 -0.584 . . . . 10.0 111.363 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -89.63 -1.45 58.02 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.346 0.499 . . . . 10.0 112.346 -179.092 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.27 149.66 34.27 Favored Glycine 0 C--O 1.237 0.305 0 C-N-CA 120.647 -0.787 . . . . 10.0 113.102 -179.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -102.99 -55.35 2.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.061 0.457 . . . . 10.0 109.873 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . 0.428 ' HA3' HD11 ' B' ' 163' ' ' ILE . . . -115.01 142.77 17.83 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 110.992 -0.843 . . . . 10.0 110.992 179.433 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 73.8 m-85 -122.35 126.34 47.83 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.121 0.486 . . . . 10.0 112.155 -178.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.889 ' HG ' HD22 ' B' ' 159' ' ' LEU . 56.5 mt -98.79 117.59 33.61 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.864 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 9.6 m -91.21 91.57 8.27 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 50.0 t -90.01 119.96 38.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.08 0.467 . . . . 10.0 112.167 -178.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.767 ' HB3' HD11 ' B' ' 93' ' ' ILE . 15.2 p90 -132.12 140.06 48.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.021 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -82.77 128.03 34.0 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.829 -0.434 . . . . 10.0 109.829 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.817 HD11 ' HA ' ' B' ' 118' ' ' CYS . 43.1 pt -72.25 -5.9 6.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 112.083 0.401 . . . . 10.0 112.083 -179.149 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . 0.404 ' OD1' ' HD2' ' B' ' 117' ' ' LYS . 2.0 p-10 -98.45 1.14 46.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.942 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -129.23 119.45 24.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.635 -0.712 . . . . 10.0 110.335 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.67 -38.11 76.94 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 -178.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 52.3 tttp -59.73 -39.12 83.67 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.906 0.384 . . . . 10.0 111.062 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 49.2 m -59.42 -38.18 79.99 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.701 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -68.62 -36.71 79.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.116 0.484 . . . . 10.0 111.115 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -79.82 -30.72 40.54 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.683 -179.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.36 -16.28 63.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.19 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . 0.767 HD11 ' HB3' ' B' ' 82' ' ' PHE . 38.7 mm -56.74 -42.29 76.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.677 179.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -66.6 -36.99 83.94 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.912 0.387 . . . . 10.0 110.223 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -62.82 -39.36 94.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.042 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -78.96 -34.09 44.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.385 -0.371 . . . . 10.0 111.061 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -57.68 -50.01 74.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.314 179.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . 0.51 ' HA ' ' HD3' ' B' ' 101' ' ' LYS . 33.9 mm-40 -68.2 -32.44 72.66 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.993 -0.548 . . . . 10.0 111.026 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -63.38 -47.43 82.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.002 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . 0.574 ' HA ' HG22 ' B' ' 103' ' ' VAL . 55.3 mt -63.13 -35.8 73.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.29 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' B' ' 98' ' ' GLU . 49.7 mtpt -62.62 -31.4 72.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.513 179.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.01 -20.06 33.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.85 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.637 ' HA ' HH21 ' B' ' 73' ' ' ARG . 15.0 m -87.99 -33.72 6.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.599 -0.441 . . . . 10.0 111.586 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -95.95 -15.84 22.1 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.473 179.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . 0.487 ' OD2' ' H72' ' A' ' 30' ' ' PCW . 5.0 m-20 63.12 48.11 3.89 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.454 -0.794 . . . . 10.0 112.054 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 9.2 t -166.68 164.88 16.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.659 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -101.58 -20.21 15.15 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -91.91 77.15 5.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.626 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.472 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 39.6 t -123.43 132.83 24.28 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.26 -179.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 21.5 Cg_exo -65.71 106.97 0.98 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.852 2.368 . . . . 10.0 111.881 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . 0.461 ' HB2' HG21 ' B' ' 139' ' ' ILE . 61.4 mtt -127.81 152.34 47.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.862 -0.608 . . . . 10.0 109.891 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.572 ' HB ' HD23 ' B' ' 79' ' ' LEU . 88.6 t -135.67 127.99 46.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.744 -0.465 . . . . 10.0 109.744 179.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 18.7 tp -80.43 114.52 19.38 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 45.3 t -111.15 110.23 31.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.518 -178.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -86.35 128.89 9.1 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 109.335 -1.506 . . . . 10.0 109.335 178.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -114.89 155.94 25.92 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 117.42 0.61 . . . . 10.0 112.372 -178.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . 0.423 ' HB3' HD12 ' B' ' 120' ' ' LEU . 80.3 mttt 71.99 46.05 0.37 Allowed 'General case' 0 N--CA 1.462 0.146 0 O-C-N 124.174 0.921 . . . . 10.0 112.65 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . 0.817 ' HA ' HD11 ' B' ' 84' ' ' ILE . 26.3 p -79.0 -15.31 58.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.032 0.444 . . . . 10.0 110.642 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -86.22 1.29 51.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.165 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.423 HD12 ' HB3' ' B' ' 117' ' ' LYS . 24.4 mt -100.27 137.09 19.93 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.568 179.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.92 -3.16 13.5 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.914 2.409 . . . . 10.0 112.326 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 13.2 t -85.51 26.47 0.93 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.923 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 -64.52 107.0 1.26 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.052 0.453 . . . . 10.0 111.927 -179.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 2.8 m -97.25 -34.47 11.08 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.762 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 46.5 t -87.41 119.24 34.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.894 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . 0.656 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 27.8 t70 -72.78 153.8 40.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.521 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.25 -41.88 85.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.858 -0.61 . . . . 10.0 112.152 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -69.64 -38.03 77.0 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.308 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . 0.656 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 25.7 mt-30 -55.39 -45.38 76.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.179 0.514 . . . . 10.0 110.517 179.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.97 -41.96 77.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.458 -0.792 . . . . 10.0 110.929 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -60.43 -40.68 91.95 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.959 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -62.5 -45.5 92.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.9 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 32.3 tp -62.85 -45.86 90.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.873 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.67 -45.97 90.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.968 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -61.05 -31.8 71.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.516 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 32.3 m -70.8 -29.81 66.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.459 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -93.5 -6.78 46.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.797 0.332 . . . . 10.0 110.879 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 75.09 29.72 60.13 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.976 -0.631 . . . . 10.0 111.843 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . 0.461 HG21 ' HB2' ' B' ' 111' ' ' MET . 49.0 pt -122.02 154.82 61.44 Favored Pre-proline 0 C--N 1.329 -0.306 0 N-CA-C 110.55 -0.167 . . . . 10.0 110.55 -179.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -80.51 150.96 19.57 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.922 2.415 . . . . 10.0 112.268 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -113.14 121.51 44.74 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.502 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 11.9 mm -118.12 117.9 56.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.54 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -82.9 123.76 29.7 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.023 -1.103 . . . . 10.0 108.023 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . 0.537 ' HA ' ' O ' ' B' ' 150' ' ' GLN . 76.3 p -135.89 172.66 12.69 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 113.568 0.951 . . . . 10.0 113.568 -177.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -163.8 121.41 1.81 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 113.953 -1.476 . . . . 10.0 107.635 178.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -72.61 -25.63 61.38 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.317 0.488 . . . . 10.0 112.317 -178.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 22.5 tttt -66.26 -47.96 72.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.848 0.356 . . . . 10.0 111.6 -179.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.1 0.82 41.45 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.2 -0.455 . . . . 10.0 111.522 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 18.3 ttt85 54.5 47.81 21.92 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.18 -179.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . 0.537 ' O ' ' HA ' ' B' ' 144' ' ' THR . 32.8 tt0 -90.05 111.85 23.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.609 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 66.94 10.19 55.31 Favored Glycine 0 CA--C 1.519 0.286 0 N-CA-C 114.594 0.598 . . . . 10.0 114.594 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 90.6 t -59.68 -49.15 84.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 117.046 0.423 . . . . 10.0 111.119 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -63.75 -45.01 91.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.301 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -61.64 -38.35 87.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.863 -0.608 . . . . 10.0 112.055 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.92 -50.63 72.69 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.838 0.352 . . . . 10.0 110.915 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -65.81 -41.52 91.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.816 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . 0.407 ' O ' ' HG3' ' B' ' 161' ' ' ARG . 13.5 m-30 -63.01 -41.67 99.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.682 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 98.8 m -57.89 -41.5 82.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.798 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.889 HD22 ' HG ' ' B' ' 79' ' ' LEU . 30.3 tp -58.06 -50.75 72.38 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.212 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 39.3 t -62.73 -38.88 82.84 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.458 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' B' ' 161' ' ' ARG . 43.7 mtm-85 -61.76 -34.36 75.71 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.495 179.054 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -76.42 -37.13 57.52 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.194 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . 0.529 HG13 ' O ' ' B' ' 159' ' ' LEU . 78.5 mt -64.01 -44.5 97.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.849 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 29.0 ttm180 -59.53 -52.19 66.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.761 0.315 . . . . 10.0 110.646 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -61.19 -33.52 73.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.156 0.503 . . . . 10.0 110.244 179.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -65.09 -39.43 93.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.591 -0.731 . . . . 10.0 111.042 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' B' ' 163' ' ' ILE . 67.7 mttt -70.48 -42.64 71.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.455 -0.338 . . . . 10.0 110.464 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -71.56 -15.46 62.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.265 0.555 . . . . 10.0 110.145 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -80.5 -39.2 28.39 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.957 -0.757 . . . . 10.0 108.957 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . 0.451 ' O ' ' H71' ' A' ' 26' ' ' PCW . 17.0 mmt -67.99 -30.5 69.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.454 -0.794 . . . . 10.0 111.781 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 12.9 m -70.92 -13.18 61.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.782 0.325 . . . . 10.0 111.322 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 54.1 mttp -99.22 -2.4 36.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.83 0.348 . . . . 10.0 110.7 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . 0.532 ' OD1' ' H81' ' A' ' 1' ' ' PCW . 23.3 t70 -87.86 151.34 22.92 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.272 -179.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . -178.6 -139.29 3.45 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.183 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . 0.435 ' NZ ' ' HN1' ' A' ' 35' ' ' 17F . 1.6 ttpm? -79.31 81.12 5.62 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.901 0.381 . . . . 10.0 110.86 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 56.1 tptt -146.96 113.15 5.86 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.835 -0.432 . . . . 10.0 109.835 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . 0.516 ' HZ3' ' HN1' ' A' ' 38' ' ' 17F . 61.8 tttt -121.53 125.84 47.77 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.11 0.481 . . . . 10.0 110.572 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 4.6 tptp -86.84 -17.72 32.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.835 -0.621 . . . . 10.0 111.406 -179.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -123.75 105.49 9.72 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.108 0.48 . . . . 10.0 111.632 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 19.4 ttmm -96.64 94.04 7.09 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 1.3 m -132.0 102.43 5.82 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.765 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -87.21 38.49 0.82 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.374 0.607 . . . . 10.0 110.259 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 7.5 t -160.1 147.98 16.68 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.771 -0.649 . . . . 10.0 109.86 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -117.25 38.09 3.66 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.209 0.528 . . . . 10.0 110.254 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 7.1 m . . . . . 0 C--N 1.321 -0.631 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.176 -179.552 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.266 0 N-CA-C 111.79 -0.524 . . . . 10.0 111.79 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 809' ' ' THR . . . . . 0.422 HG21 HD11 ' B' ' 36' ' ' ILE . 36.1 p -121.42 118.08 28.49 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.359 -0.238 . . . . 10.0 110.359 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 3.5 t -101.69 134.23 42.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.036 0.446 . . . . 10.0 111.209 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 38.3 mtpt -83.35 114.54 21.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.653 -0.703 . . . . 10.0 110.326 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 44.4 t -100.88 122.61 53.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 813' ' ' TYR . . . . . 0.495 ' HB2' ' HA ' ' D' ' 876' ' ' ILE . 77.4 m-85 -89.86 137.76 32.06 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.462 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 814' ' ' LEU . . . . . 0.652 HD13 ' HD2' ' D' ' 841' ' ' ARG . 19.4 mt -109.35 147.92 37.0 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 115.647 -0.706 . . . . 10.0 110.782 -178.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 815' ' ' PRO . . . . . 0.484 ' HB3' ' HA ' ' D' ' 878' ' ' GLU . 65.2 Cg_endo -73.93 56.76 3.69 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.322 2.681 . . . . 10.0 111.79 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 816' ' ' ASN . . . . . 0.593 ' OD1' ' HB3' ' B' ' 41' ' ' ARG . 0.7 OUTLIER -163.47 33.48 0.09 Allowed 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 107.975 -1.12 . . . . 10.0 107.975 -179.535 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' D' D ' 817' ' ' LYS . . . . . 0.616 ' HB2' ' NH1' ' B' ' 41' ' ' ARG . 31.3 mtpt 52.51 39.79 28.57 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 114.357 -1.292 . . . . 10.0 111.66 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -139.18 -173.94 3.73 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 113.23 0.826 . . . . 10.0 113.23 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.51 172.02 17.81 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.678 -0.692 . . . . 10.0 112.218 -177.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 12.1 t -150.99 139.26 20.28 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.346 -1.353 . . . . 10.0 107.346 177.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 821' ' ' VAL . . . . . 0.584 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 2.3 t -110.03 107.53 23.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 120.331 -0.548 . . . . 10.0 111.295 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 10.6 t -109.49 143.59 19.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.01 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.57 136.37 39.26 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.521 -0.309 . . . . 10.0 110.73 179.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 59.1 t -89.02 127.45 41.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.917 0.389 . . . . 10.0 110.418 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 825' ' ' ARG . . . . . 0.443 ' HB2' ' SD ' ' D' ' 828' ' ' MET . 51.3 mtp180 -131.01 155.23 47.2 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.77 154.13 36.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.007 0.432 . . . . 10.0 110.883 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 95.49 -55.59 1.71 Allowed Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.817 -0.706 . . . . 10.0 113.071 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 828' ' ' MET . . . . . 0.443 ' SD ' ' HB2' ' D' ' 825' ' ' ARG . 10.2 ptm -64.67 147.73 52.42 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.406 0.622 . . . . 10.0 112.483 -179.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 829' ' ' SER . . . . . 0.661 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.1 OUTLIER -100.05 177.88 4.96 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.429 -0.805 . . . . 10.0 110.777 -179.667 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' D' D ' 830' ' ' VAL . . . . . 0.525 ' O ' ' HB2' ' D' ' 834' ' ' LEU . 69.6 t -59.06 -44.54 91.63 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 179.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 831' ' ' TYR . . . . . 0.637 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 27.4 t80 -55.83 -34.23 65.2 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.32 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -68.5 -64.58 0.84 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.675 -178.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 1.2 m -61.69 -38.56 88.29 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.382 0.512 . . . . 10.0 112.382 -179.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 834' ' ' LEU . . . . . 0.576 ' HB3' ' HZ3' ' D' ' 863' ' ' TRP . 3.7 mm? -75.4 -17.55 60.17 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.933 0.716 . . . . 10.0 112.933 -178.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 835' ' ' ASP . . . . . 0.416 ' HB2' ' O ' ' D' ' 831' ' ' TYR . 32.1 t70 -62.13 -48.88 78.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.95 0.405 . . . . 10.0 109.939 179.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 836' ' ' LYS . . . . . 0.406 ' O ' ' HB ' ' D' ' 840' ' ' VAL . 3.4 mmmm -67.43 -25.93 66.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.362 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -81.67 -18.34 44.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.57 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 838' ' ' LEU . . . . . 0.595 HD12 ' HG3' ' D' ' 845' ' ' GLN . 16.3 mt -99.26 -47.12 5.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.042 0.448 . . . . 10.0 111.007 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 839' ' ' LYS . . . . . 0.442 ' HA ' ' HD3' ' D' ' 839' ' ' LYS . 28.9 mmtp -62.01 -27.49 68.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.898 -0.592 . . . . 10.0 111.061 -179.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 840' ' ' VAL . . . . . 0.83 HG13 ' HG3' ' D' ' 841' ' ' ARG . 10.1 p -57.73 -22.84 19.09 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 O-C-N 123.739 0.649 . . . . 10.0 111.208 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 841' ' ' ARG . . . . . 0.83 ' HG3' HG13 ' D' ' 840' ' ' VAL . 2.5 mtp-105 -120.6 10.15 11.0 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.224 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 73.49 33.35 58.59 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.975 -0.631 . . . . 10.0 112.801 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 90.8 mt -104.93 142.69 34.31 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -108.56 153.82 22.83 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.523 -0.308 . . . . 10.0 111.22 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 845' ' ' GLN . . . . . 0.595 ' HG3' HD12 ' D' ' 838' ' ' LEU . 23.8 mp0 -76.49 51.36 0.72 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.245 0.545 . . . . 10.0 111.795 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -118.79 -71.74 0.72 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.85 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -92.73 32.45 1.24 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.817 -0.629 . . . . 10.0 111.597 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 36.2 m -125.0 137.84 54.23 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.74 -0.467 . . . . 10.0 109.74 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 4.7 p -126.9 137.8 56.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.622 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 850' ' ' VAL . . . . . 0.47 HG22 HG22 ' D' ' 877' ' ' VAL . 43.4 t -101.58 126.85 55.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 121.066 0.46 . . . . 10.0 111.05 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -109.32 144.74 37.08 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.9 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 852' ' ' ARG . . . . . 0.785 ' HD3' HD11 ' D' ' 870' ' ' LEU . 27.8 mtm180 -92.13 179.43 5.58 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.252 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 853' ' ' LEU . . . . . 0.473 HD23 HD11 ' D' ' 876' ' ' ILE . 0.2 OUTLIER -123.32 56.76 1.17 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.333 0.587 . . . . 10.0 110.455 -179.583 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 61.4 mt -83.21 100.96 7.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.816 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 855' ' ' LYS . . . . . 0.413 ' HE2' ' HA ' ' D' ' 855' ' ' LYS . 10.7 mmpt? 63.8 14.37 8.23 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.938 -0.573 . . . . 10.0 111.302 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 102.62 -13.26 56.62 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 121.067 -0.587 . . . . 10.0 111.92 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -83.05 130.53 35.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.007 0.432 . . . . 10.0 110.649 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 858' ' ' LYS . . . . . 0.565 ' HG2' H132 ' A' ' 3' ' ' PCW . 1.6 mppt? -84.07 104.37 14.08 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.102 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.95 136.68 41.36 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.962 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 42.3 t -67.07 126.41 26.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.922 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 5.1 m -119.49 142.85 47.91 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -86.89 162.49 17.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.785 0.326 . . . . 10.0 111.591 -178.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 863' ' ' TRP . . . . . 0.637 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 73.0 m95 -78.97 -25.3 43.49 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.886 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -72.95 -22.94 60.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.705 -0.679 . . . . 10.0 111.319 -179.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 5.3 m -62.96 146.19 53.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.388 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 866' ' ' ALA . . . . . 0.661 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -78.0 149.79 34.0 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.107 -0.331 . . . . 10.0 110.107 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 867' ' ' ILE . . . . . 0.591 HD11 HD11 ' D' ' 875' ' ' LEU . 7.9 tp -92.0 -10.41 9.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.111 0.481 . . . . 10.0 111.498 -179.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -55.07 -52.68 69.07 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 113.749 1.018 . . . . 10.0 113.749 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -77.51 9.85 2.73 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 121.864 1.709 . . . . 10.0 113.369 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 870' ' ' LEU . . . . . 0.785 HD11 ' HD3' ' D' ' 852' ' ' ARG . 1.3 mm? -104.25 4.7 34.09 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.045 0.387 . . . . 10.0 112.045 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -69.22 104.14 2.12 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.501 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 145.17 -13.55 1.87 Allowed Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.05 -1.071 . . . . 10.0 113.811 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -128.42 -174.85 3.34 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 117.554 0.677 . . . . 10.0 112.201 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -109.33 153.05 24.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.142 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 875' ' ' LEU . . . . . 0.591 HD11 HD11 ' D' ' 867' ' ' ILE . 47.8 mt -121.18 128.53 52.56 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.178 -0.305 . . . . 10.0 110.178 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 876' ' ' ILE . . . . . 0.649 HG21 ' H32' ' A' ' 3' ' ' PCW . 2.4 mp -113.65 122.23 67.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.835 0.35 . . . . 10.0 110.806 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 877' ' ' VAL . . . . . 0.48 HG11 HD21 ' D' ' 838' ' ' LEU . 17.6 t -106.42 130.13 58.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 878' ' ' GLU . . . . . 0.484 ' HA ' ' HB3' ' D' ' 815' ' ' PRO . 0.0 OUTLIER -128.1 163.34 24.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.765 0.317 . . . . 10.0 110.962 179.707 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 59.0 t -93.24 130.0 42.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.433 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 49.2 mt . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.551 -0.738 . . . . 10.0 110.46 179.54 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PCW . . . . . 0.66 H352 ' H32' ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PCW . . . . . 0.414 H342 H362 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PCW . . . . . 0.649 ' H32' HG21 ' D' ' 876' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PCW . . . . . 0.509 H431 H221 ' A' ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PCW . . . . . 0.609 H452 ' H34' ' A' ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PCW . . . . . 0.541 H432 H172 ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PCW . . . . . 0.548 ' H2 ' ' H52' ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PCW . . . . . 0.519 H471 ' H19' ' A' ' 8' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PCW . . . . . 0.88 ' H41' ' H31' ' A' ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PCW . . . . . 0.451 H141 H432 ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PCW . . . . . 0.497 H422 H152 ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PCW . . . . . 0.712 ' H42' ' N1 ' ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PCW . . . . . 0.862 H122 ' H37' ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PCW . . . . . 0.677 H421 ' H12' ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PCW . . . . . 0.409 H372 H152 ' A' ' 15' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PCW . . . . . 0.764 H451 ' H60' ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PCW . . . . . 0.734 ' H39' ' H18' ' A' ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PCW . . . . . 0.517 H432 H211 ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PCW . . . . . 0.453 H152 H261 ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PCW . . . . . 0.557 ' H31' H121 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PCW . . . . . 0.424 ' O1P' ' H83' ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PCW . . . . . 0.593 H483 H422 ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PCW . . . . . 0.617 ' H2 ' H131 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PCW . . . . . 0.522 H181 H181 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PCW . . . . . 0.701 H122 ' H12' ' A' ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PCW . . . . . 0.694 ' H19' ' H72' ' A' ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PCW . . . . . 0.649 ' H73' ' HB2' ' B' ' 70' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PCW . . . . . 0.659 H461 H482 ' A' ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PCW . . . . . 0.555 H431 H212 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PCW . . . . . 0.842 H352 H122 ' A' ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PCW . . . . . 0.701 ' H12' H122 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PCW . . . . . 0.559 H262 H462 ' A' ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' 17F . . . . . 0.573 ' H49' H462 ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' 17F . . . . . 0.677 ' H12' H421 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' 17F . . . . . 0.66 ' H32' H352 ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' 17F . . . . . 0.609 ' H34' H452 ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' 17F . . . . . 0.862 ' H37' H122 ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' 17F . . . . . 0.734 ' H18' ' H39' ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' 17F . . . . . 0.764 ' H60' H451 ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' 17F . . . . . 0.698 ' H61' H361 ' A' ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PCW . . . . . 0.545 H332 H252 ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PCW . . . . . 0.842 ' H71' ' HN1' ' A' ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PCW . . . . . 0.605 ' H81' ' O2P' ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PCW . . . . . 0.649 ' H62' HN1A ' A' ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PCW . . . . . 0.574 H171 ' H30' ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PCW . . . . . 0.805 ' H11' H381 ' A' ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PCW . . . . . 0.573 H452 ' H56' ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PCW . . . . . 0.614 H241 H481 ' A' ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PCW . . . . . 0.594 H242 H161 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PCW . . . . . 0.419 H321 H18A ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PCW . . . . . 0.501 H462 H231 ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PCW . . . . . 0.745 H121 ' H19' ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PCW . . . . . 0.778 H212 H151 ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PCW . . . . . 0.85 H131 H331 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PCW . . . . . 0.554 H272 ' H46' ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PCW . . . . . 0.879 H132 H331 ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PCW . . . . . 0.586 ' H61' ' O1P' ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PCW . . . . . 0.507 ' O2P' ' H81' ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PCW . . . . . 0.61 ' H51' ' H8A' ' A' ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' PCW . . . . . 0.507 ' H81' ' O2P' ' A' ' 58' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PCW . . . . . 0.463 ' O31' ' H41' ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PCW . . . . . 0.536 H142 ' H19' ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PCW . . . . . 0.659 H482 H461 ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PCW . . . . . 0.778 H151 H212 ' A' ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PCW . . . . . 0.459 H142 ' H5 ' ' A' ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PCW . . . . . 0.739 ' H41' ' H30' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PCW . . . . . 0.676 H151 H341 ' A' ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PCW . . . . . 0.51 H262 H241 ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PCW . . . . . 0.502 H451 H411 ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PCW . . . . . 0.805 H381 ' H11' ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PCW . . . . . 0.617 H272 ' H45' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' 17F . . . . . 0.573 ' H56' H452 ' A' ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' 17F . . . . . 0.615 ' H70' H141 ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' 17F . . . . . 0.842 ' HN1' ' H71' ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' 17F . . . . . 0.465 ' H70' ' H73' ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' 17F . . . . . 0.649 HN1A ' H62' ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' 17F . . . . . 0.739 ' H30' ' H41' ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' 17F . . . . . 0.478 ' H42' H262 ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' 17F . . . . . 0.584 ' H9A' H19A ' A' ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 201' ' ' GNP . . . . . 0.567 H5'1 ' HA ' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.621 ' HA ' HD12 ' A' ' 204' ' ' LEU . 52.6 mt . . . . . 0 C--O 1.236 0.375 0 CA-C-O 120.845 0.355 . . . . 10.0 110.652 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -64.57 -49.4 71.34 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 115.798 -0.637 . . . . 10.0 111.077 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 96.0 mt -77.07 14.63 0.84 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.871 0.367 . . . . 10.0 111.574 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . 0.621 HD12 ' HA ' ' A' ' 201' ' ' LEU . 90.0 mt -113.71 -59.95 1.95 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.357 179.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -73.31 -38.08 65.97 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.004 0.372 . . . . 10.0 112.004 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . 0.412 ' O ' HG23 ' A' ' 210' ' ' VAL . 23.2 t-20 -63.97 -41.74 97.47 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 16.8 m0 -69.23 -29.06 66.92 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.409 -0.814 . . . . 10.0 110.565 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -60.71 -48.74 80.45 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 109.177 -0.675 . . . . 10.0 109.177 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.9 m -57.75 -45.7 85.53 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 206' ' ' ASN . 63.0 t -60.52 -37.51 75.21 Favored 'Isoleucine or valine' 0 C--O 1.231 0.11 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.178 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 24.3 m -61.52 -45.2 95.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.113 -0.494 . . . . 10.0 109.778 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.27 -38.28 89.78 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.743 -0.466 . . . . 10.0 109.743 179.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 24.1 m -61.94 -42.91 99.65 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.749 -0.463 . . . . 10.0 109.749 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -63.27 -41.53 99.03 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.372 -0.377 . . . . 10.0 110.201 178.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 14.9 m -64.87 -48.78 73.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.08 -0.509 . . . . 10.0 109.867 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -61.38 -33.31 73.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.762 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 23.9 mt -70.86 -39.4 72.93 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.065 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 38.1 mtt180 -68.1 -39.85 82.75 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -70.07 -12.98 62.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.142 178.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -95.49 -42.79 8.28 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.415 -0.811 . . . . 10.0 108.898 178.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 38.1 mt -59.27 -32.58 70.15 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.119 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -55.28 -69.36 1.29 Allowed Glycine 0 C--N 1.332 0.312 0 N-CA-C 111.244 -0.742 . . . . 10.0 111.244 178.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -59.41 -37.02 92.39 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.316 2.011 . . . . 10.0 111.199 178.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . 0.532 ' O ' ' HB2' ' A' ' 228' ' ' PHE . 5.9 t -57.54 -48.86 82.14 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.199 0 CA-C-N 116.523 -0.308 . . . . 10.0 111.242 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 9.5 p -66.14 -38.3 87.82 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.873 -0.331 . . . . 10.0 110.395 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -62.4 -50.92 69.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.451 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -66.95 -38.47 86.18 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.392 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . 0.532 ' HB2' ' O ' ' A' ' 224' ' ' VAL . 1.6 t80 -62.24 -44.73 95.91 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 178.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . 0.668 ' HA ' ' HB2' ' A' ' 232' ' ' LEU . 0.9 OUTLIER -70.66 -34.08 71.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.696 179.461 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -60.33 -39.36 86.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.508 0.671 . . . . 10.0 109.367 178.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -78.54 -35.05 46.69 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . 0.668 ' HB2' ' HA ' ' A' ' 229' ' ' TRP . 14.5 mt -61.77 -35.61 78.66 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.406 179.05 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -61.58 -47.75 84.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.271 -0.422 . . . . 10.0 109.967 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -64.27 -36.97 85.82 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.048 -0.523 . . . . 10.0 109.66 179.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.15 -49.37 70.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.485 -0.78 . . . . 10.0 110.013 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 3.1 p -67.02 -36.57 82.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.301 -0.409 . . . . 10.0 111.013 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -62.04 -49.64 75.18 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -62.09 -47.58 88.95 Favored Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 111.248 -0.741 . . . . 10.0 111.248 178.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 69.7 mt -62.72 -38.08 89.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.544 0.211 . . . . 10.0 111.329 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 30.2 ttm180 -66.95 -44.03 81.61 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 178.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -61.07 -44.7 96.97 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 108.362 -0.977 . . . . 10.0 108.362 178.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . 0.42 ' OE1' ' HB3' ' C' ' 528' ' ' ARG . 20.5 mt-10 -59.11 -55.88 29.36 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.225 -0.898 . . . . 10.0 109.892 178.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . 0.42 ' HA ' ' HB3' ' A' ' 246' ' ' ASP . 81.4 mmm -58.57 -35.18 71.97 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 112.763 0.653 . . . . 10.0 112.763 -179.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . 0.473 ' O ' ' HG3' ' A' ' 248' ' ' GLU . 51.1 m -62.07 -38.02 87.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.168 0.508 . . . . 10.0 109.762 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -84.15 -40.43 18.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.004 -0.543 . . . . 10.0 109.539 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . 0.42 ' HB3' ' HA ' ' A' ' 243' ' ' MET . 12.8 t70 -56.61 -51.58 68.13 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.068 179.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 52.8 mt -60.02 -41.72 92.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.928 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . 0.473 ' HG3' ' O ' ' A' ' 244' ' ' SER . 7.3 mt-10 -66.67 -49.22 66.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.623 -0.262 . . . . 10.0 110.882 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.04 -43.47 98.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.017 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . 0.583 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 41.9 t -67.25 -46.95 82.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.577 0 CA-C-N 116.429 -0.35 . . . . 10.0 111.323 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.452 ' O ' HG12 ' A' ' 254' ' ' VAL . 53.6 mttm -68.15 -47.46 68.01 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.449 0.537 . . . . 10.0 112.449 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.53 -29.95 71.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.553 0.216 . . . . 10.0 111.285 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -92.8 -26.8 17.54 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 121.142 -0.223 . . . . 10.0 111.563 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.583 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 1.1 p -64.0 -28.5 45.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.573 0.225 . . . . 10.0 110.922 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . 0.492 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 21.7 mt-30 -61.33 -62.13 6.54 Favored Pre-proline 0 CA--C 1.533 0.314 0 N-CA-C 109.487 -0.56 . . . . 10.0 109.487 178.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . 0.492 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 15.5 Cg_endo -62.44 -31.6 80.79 Favored 'Trans proline' 0 C--N 1.359 1.114 0 C-N-CA 121.633 1.555 . . . . 10.0 111.262 177.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . 0.482 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 5.5 m-30 -62.53 -53.57 52.82 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 178.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 49.1 mt -68.99 -34.3 75.07 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.763 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . 0.584 ' HA ' HE21 ' A' ' 262' ' ' GLN . 13.2 t70 -59.93 -45.19 93.4 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.976 -0.749 . . . . 10.0 108.976 178.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -63.88 -43.92 94.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.359 -0.837 . . . . 10.0 109.625 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -63.81 -39.74 94.96 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.681 179.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . 0.584 HE21 ' HA ' ' A' ' 259' ' ' ASP . 12.8 mt-30 -65.25 -40.08 93.53 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 178.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 39.1 mttp -63.73 -47.24 81.87 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.562 -0.903 . . . . 10.0 108.562 178.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.633 ' HE3' ' HB1' ' C' ' 509' ' ' ALA . 13.2 mptt -58.34 -51.33 70.25 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.543 -0.753 . . . . 10.0 109.446 178.14 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -56.06 -38.65 70.92 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.956 179.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . 0.408 HE21 ' HB3' ' A' ' 266' ' ' GLN . 0.0 OUTLIER -63.81 -45.13 91.02 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.694 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -61.31 -48.04 83.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.18 -0.464 . . . . 10.0 109.795 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . 0.496 ' OE1' ' HD2' ' C' ' 506' ' ' ARG . 1.9 mt-10 -61.49 -52.58 63.91 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.865 -0.607 . . . . 10.0 111.075 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 89.4 mmm -62.13 -47.7 83.43 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.549 0.574 . . . . 10.0 112.549 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -59.71 -44.78 93.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.498 0.19 . . . . 10.0 110.601 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 41.4 mt -67.43 -37.33 82.87 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.843 -0.428 . . . . 10.0 109.843 178.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . 0.422 ' O ' HG23 ' A' ' 276' ' ' VAL . 2.5 m-30 -60.42 -50.52 73.25 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.571 -0.529 . . . . 10.0 109.571 178.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 273' ' ' ARG . 0.0 OUTLIER -62.06 -42.24 98.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.244 179.554 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -61.62 -23.54 66.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.458 -0.792 . . . . 10.0 110.694 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.657 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 14.8 mmtp -94.52 -40.6 9.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.673 178.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 272' ' ' TYR . 26.0 t -50.61 -44.38 25.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 O-C-N 123.175 0.297 . . . . 10.0 111.784 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . 0.477 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 1.3 mt-10 -57.18 -62.18 5.71 Favored Pre-proline 0 CA--C 1.536 0.432 0 N-CA-C 113.041 0.756 . . . . 10.0 113.041 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . 0.477 ' HD3' ' HB2' ' A' ' 277' ' ' GLU . 32.2 Cg_endo -67.03 -37.94 17.66 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 121.902 1.735 . . . . 10.0 112.344 179.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.657 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 33.7 mt -62.77 -42.45 99.69 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.624 0.249 . . . . 10.0 110.423 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . 0.496 ' O ' ' HB2' ' A' ' 284' ' ' GLN . 10.5 ttt180 -64.23 -36.46 84.15 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.14 -0.689 . . . . 10.0 109.14 178.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.56 -42.85 95.4 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.976 -0.556 . . . . 10.0 109.786 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -64.98 -46.37 81.76 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.59 -0.522 . . . . 10.0 109.59 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 89.0 mt -63.75 -40.66 97.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.119 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . 0.496 ' HB2' ' O ' ' A' ' 280' ' ' ARG . 0.5 OUTLIER -65.48 -50.35 65.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.188 179.185 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -58.78 -46.17 88.15 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.557 -0.534 . . . . 10.0 109.557 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.75 -43.93 97.03 Favored Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 111.101 -0.8 . . . . 10.0 111.101 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.3 -44.23 92.26 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 110.585 -0.154 . . . . 10.0 110.585 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 -56.0 -45.41 79.04 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.829 0.347 . . . . 10.0 110.105 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . 0.425 HE21 ' HB3' ' A' ' 289' ' ' GLN . 5.9 mt-30 -68.68 -56.82 6.89 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.692 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 37.3 mttt -55.45 -39.49 70.38 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.203 -0.453 . . . . 10.0 112.131 -179.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . 0.597 ' O ' ' HG3' ' A' ' 295' ' ' GLN . 39.4 mt -69.88 -43.51 71.69 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.889 -0.411 . . . . 10.0 109.889 178.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . 0.477 ' O ' ' HG3' ' A' ' 296' ' ' GLU . 53.5 t60 -65.9 -39.07 90.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.123 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -61.54 -39.38 90.84 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.739 -0.837 . . . . 10.0 108.739 178.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 59.0 mt -69.06 -38.13 78.92 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.218 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . 0.597 ' HG3' ' O ' ' A' ' 291' ' ' LEU . 55.7 mt-30 -60.69 -41.47 95.22 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.169 0.509 . . . . 10.0 109.906 178.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 292' ' ' HIS . 31.7 mt-10 -71.5 -4.68 28.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.269 -0.878 . . . . 10.0 111.276 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . 0.462 ' HD3' ' HA ' ' A' ' 297' ' ' LYS . 9.4 mmtp -111.2 -43.2 3.77 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 178.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 87.8 mt -60.76 -32.16 71.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.021 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . 0.503 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 13.1 m -69.36 -63.46 2.03 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 112.052 0.39 . . . . 10.0 112.052 179.502 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . 0.503 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 43.3 Cg_endo -68.03 -46.81 2.08 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 121.902 1.734 . . . . 10.0 112.942 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.487 HD13 ' HG2' ' C' ' 473' ' ' LYS . 89.5 mt -67.64 -32.6 73.41 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.645 -0.502 . . . . 10.0 109.645 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -69.45 -46.47 55.72 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 109.681 -1.368 . . . . 10.0 109.681 178.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -60.15 -42.34 94.69 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -62.36 -44.06 97.36 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.959 178.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 4.1 tpt -64.83 -37.83 88.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.316 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . 0.483 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 47.5 mtt180 -69.31 -38.1 78.09 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 178.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . 0.516 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 38.1 t70 -65.73 -45.34 83.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.762 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . 0.591 ' HG3' ' CD2' ' C' ' 469' ' ' LEU . 13.9 mmt180 -68.45 -28.41 67.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.654 -0.703 . . . . 10.0 109.386 178.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . 0.531 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -67.47 -34.28 76.84 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.692 -0.855 . . . . 10.0 108.692 177.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . 0.516 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 74.4 mtt180 -60.83 -49.54 77.08 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 108.432 -0.951 . . . . 10.0 108.432 177.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -66.62 -39.85 88.5 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.69 178.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . 0.531 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.2 OUTLIER -54.29 -54.72 36.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.596 -0.729 . . . . 10.0 110.031 178.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 61.7 t -73.05 -38.21 55.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.534 -0.757 . . . . 10.0 111.968 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -58.88 -53.18 61.26 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 110.392 -0.225 . . . . 10.0 110.392 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -60.97 -31.04 70.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.289 0.566 . . . . 10.0 109.918 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 316' ' ' LEU . 13.6 mt -71.42 -40.91 70.14 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.732 178.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 84.9 mtt180 -64.22 -43.64 94.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.604 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 2.8 m -65.07 -15.53 62.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.616 179.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 12.0 m80 -101.14 -39.76 7.52 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.22 -0.445 . . . . 10.0 110.322 178.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 47.5 mt -60.96 -40.03 91.8 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.593 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.62 -60.59 8.82 Favored Pre-proline 0 CA--C 1.535 0.381 0 O-C-N 123.135 0.272 . . . . 10.0 111.309 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -66.71 -36.3 25.15 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 121.337 1.358 . . . . 10.0 111.517 178.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 -58.68 -48.74 80.06 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.638 0.256 . . . . 10.0 111.035 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . 0.449 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 49.7 p -67.59 -38.62 84.27 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . 0.741 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 7.6 t0 -63.52 -40.93 98.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.194 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -64.36 -40.9 96.76 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 108.276 -1.009 . . . . 10.0 108.276 177.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 68.7 mt -63.25 -33.74 76.14 Favored 'General case' 0 C--O 1.221 -0.412 0 CA-C-N 115.386 -0.824 . . . . 10.0 109.604 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . 0.741 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 75.8 mtt180 -62.59 -42.49 99.6 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -70.43 -47.51 60.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.942 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . 0.528 ' O ' ' HG2' ' A' ' 334' ' ' ARG . 4.3 ttm180 -61.55 -48.98 78.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.051 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 49.3 mt -62.35 -34.67 77.11 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 116.539 -0.301 . . . . 10.0 110.477 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.9 -47.26 85.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -63.76 -43.23 97.03 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.03 178.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . 0.657 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 3.6 mmt85 -58.97 -52.06 67.38 Favored 'General case' 0 C--O 1.227 -0.108 0 N-CA-C 109.425 -0.583 . . . . 10.0 109.425 178.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 58.1 mt -63.82 -37.38 87.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.36 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -61.5 -45.14 95.49 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.268 -0.271 . . . . 10.0 110.268 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.17 -39.68 86.48 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 82.2 mt -67.53 -19.56 65.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.579 -0.737 . . . . 10.0 111.084 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 33.9 mtpt -91.47 -46.38 8.02 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.633 -0.506 . . . . 10.0 109.633 178.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -58.8 -53.38 59.05 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.983 -0.747 . . . . 10.0 108.983 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . 0.407 ' OD1' ' HB3' ' C' ' 432' ' ' LYS . 66.5 m-20 -76.17 -23.6 54.73 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.477 178.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -66.71 -46.09 78.55 Favored Glycine 0 CA--C 1.507 -0.455 0 N-CA-C 111.308 -0.717 . . . . 10.0 111.308 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.95 -38.38 95.95 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 110.113 -1.195 . . . . 10.0 110.113 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.13 -43.13 92.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.072 -0.714 . . . . 10.0 109.072 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . 0.539 ' HD3' ' OE2' ' C' ' 433' ' ' GLU . 19.2 mtm180 -60.19 -49.96 75.57 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.074 178.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 94.8 mt -60.03 -44.39 94.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.42 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.72 -48.16 80.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.032 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . 0.431 ' HB3' ' NZ ' ' A' ' 352' ' ' LYS . 4.7 mt-10 -62.03 -36.6 82.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.295 179.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -66.97 -38.66 86.48 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.543 -0.54 . . . . 10.0 109.543 178.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 34.5 m-70 -66.02 -39.5 90.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 10.0 109.975 178.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -63.88 -47.12 81.91 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.127 -0.694 . . . . 10.0 109.127 178.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . 0.456 ' NZ ' ' HB3' ' C' ' 425' ' ' GLU . 27.7 mttp -66.85 -33.28 75.26 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.762 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -67.11 -44.61 79.52 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 56.8 m -61.13 -47.32 86.8 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -61.59 -44.53 96.83 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.905 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . 0.448 ' HB2' ' O ' ' A' ' 352' ' ' LYS . 0.1 OUTLIER -58.35 -48.28 81.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.154 179.359 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.508 HD21 H152 ' A' ' 2' ' ' PCW . 62.7 mt -61.11 -35.57 77.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.574 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 19.2 m -63.9 -51.98 62.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.015 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.36 -30.88 71.76 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.087 0.47 . . . . 10.0 110.098 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 19.4 mt -68.23 -35.4 77.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.423 178.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 26.6 p -67.22 -27.73 67.48 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.561 -0.533 . . . . 10.0 109.561 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -77.23 -0.85 26.8 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 115.613 -0.722 . . . . 10.0 110.068 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.567 ' HG2' HG22 ' C' ' 411' ' ' THR . 89.7 mttt -116.78 -42.33 2.98 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.396 -0.82 . . . . 10.0 108.823 178.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -63.29 -21.14 66.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.538 -0.756 . . . . 10.0 111.573 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.969 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 94.2 mttt -104.98 -69.24 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.457 0 N-CA-C 112.172 0.434 . . . . 10.0 112.172 179.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.969 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 23.1 Cg_exo -66.28 -50.33 1.51 Allowed 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.502 2.134 . . . . 10.0 113.319 -178.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -64.62 -43.37 93.95 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.678 0.275 . . . . 10.0 111.74 -179.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . 0.465 HD23 ' HA ' ' A' ' 368' ' ' LEU . 13.8 mt -67.11 -35.99 80.96 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.763 -0.375 . . . . 10.0 110.278 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . 0.687 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 5.8 tt0 -66.11 -38.2 87.61 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.527 -0.916 . . . . 10.0 108.527 178.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.04 -43.06 96.69 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 178.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . 0.449 HD12 HD23 ' A' ' 368' ' ' LEU . 19.0 mt -62.28 -45.58 92.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.601 -0.727 . . . . 10.0 110.638 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 372' ' ' ARG . 17.9 mtt180 -67.53 -37.84 83.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.943 0.402 . . . . 10.0 109.941 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.687 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.7 mt-30 -67.27 -16.92 64.56 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 115.569 -0.741 . . . . 20.0 111.34 178.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -96.3 -40.36 3.99 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 108.746 -1.742 . . . . 10.0 108.746 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 62.4 mt -58.24 -36.84 73.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.66 -0.27 . . . . 10.0 111.672 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . 0.42 ' O ' ' HG2' ' A' ' 380' ' ' GLU . 96.1 mt -59.65 -63.8 3.78 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 120.925 -0.31 . . . . 10.0 111.364 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.416 ' CD ' ' HB2' ' A' ' 376' ' ' LEU . 19.7 Cg_endo -61.83 -35.14 80.3 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 121.994 1.796 . . . . 10.0 111.676 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 6.1 t -61.26 -49.5 84.33 Favored 'Isoleucine or valine' 0 C--O 1.231 0.108 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 178.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 34.3 mt -63.06 -33.66 75.92 Favored 'General case' 0 C--O 1.224 -0.255 0 N-CA-C 109.759 -0.459 . . . . 10.0 109.759 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . 0.442 ' O ' HG23 ' A' ' 384' ' ' VAL . 6.0 mm-40 -61.51 -55.51 30.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.017 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.3 p -63.37 -35.45 80.44 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.006 0.432 . . . . 10.0 110.136 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.9 m-30 -63.76 -47.33 81.39 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.144 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -57.8 -40.5 80.07 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 380' ' ' GLU . 68.8 t -58.09 -50.82 76.86 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.103 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.844 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -66.45 -34.63 78.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.731 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . 0.535 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 22.0 m-30 -69.34 -45.58 69.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.904 0.383 . . . . 10.0 110.109 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.45 -38.02 89.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.223 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . 0.573 ' HB2' ' HD3' ' C' ' 594' ' ' LYS . 3.4 p -74.71 -31.89 61.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.8 0.333 . . . . 10.0 110.906 179.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -71.16 -34.89 71.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.367 179.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 87.3 mt -59.37 -37.19 77.28 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.256 179.248 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -64.43 -45.3 88.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.469 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . 0.424 ' O ' ' HE2' ' A' ' 396' ' ' LYS . 19.8 mm-40 -61.12 -49.95 75.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.518 -0.765 . . . . 10.0 111.609 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -57.4 -43.87 84.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.708 0.29 . . . . 10.0 111.228 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 27.5 m -63.98 -50.26 69.28 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.277 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -62.99 -38.15 90.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.864 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . 0.552 ' HD2' ' HB2' ' C' ' 587' ' ' ALA . 0.1 OUTLIER -70.69 -40.17 73.06 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.298 -0.41 . . . . 10.0 112.06 -179.338 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . 0.701 HD21 H261 ' A' ' 32' ' ' PCW . 64.8 mt -68.69 -46.58 68.65 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.059 0.457 . . . . 10.0 110.648 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 11.5 p30 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.236 -179.768 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.5 mm? . . . . . 0 CA--C 1.522 -0.13 0 CA-C-O 121.111 0.482 . . . . 10.0 110.222 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.59 15.81 18.86 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.706 -0.679 . . . . 10.0 109.92 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 92.7 mt -64.51 -31.41 72.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.758 -0.655 . . . . 10.0 110.277 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 85.2 mt -71.67 -31.51 66.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.395 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -67.32 -45.98 74.85 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.892 -0.781 . . . . 10.0 108.892 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -64.31 -40.32 95.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.439 178.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -35.85 79.6 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.328 179.132 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -60.55 -49.18 78.59 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.008 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 1.1 m -59.27 -42.14 90.51 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.936 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . 0.431 ' O ' ' HB2' ' C' ' 412' ' ' PHE . 70.8 t -64.41 -44.22 97.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.316 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 30.0 m -62.4 -45.99 90.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.396 -0.366 . . . . 10.0 110.496 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 25.2 m -63.17 -45.55 91.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.467 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . 0.567 HG22 ' HG2' ' A' ' 363' ' ' LYS . 12.8 p -67.14 -36.94 82.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.698 0.285 . . . . 10.0 111.11 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . 0.431 ' HB2' ' O ' ' C' ' 408' ' ' VAL . 2.7 t80 -67.87 -39.72 83.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.994 179.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 47.4 m -64.34 -43.28 95.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.307 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -66.14 -32.42 73.86 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.245 0.545 . . . . 10.0 109.969 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . 0.403 ' O ' ' HG ' ' C' ' 419' ' ' LEU . 7.7 mt -65.62 -44.24 87.1 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.067 -0.716 . . . . 10.0 109.067 177.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . 0.517 ' HA ' HD12 ' C' ' 419' ' ' LEU . 98.6 mtt180 -65.6 -34.3 77.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.259 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . 0.458 ' O ' ' HD2' ' C' ' 421' ' ' PRO . 42.2 mt-10 -65.58 -40.69 93.04 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -67.56 -33.91 75.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.862 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' C' ' 416' ' ' ARG . 85.7 mt -62.11 -12.84 21.58 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-N 115.722 -0.672 . . . . 10.0 111.867 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -74.32 -75.72 0.76 Allowed Glycine 0 CA--C 1.522 0.509 0 C-N-CA 120.494 -0.86 . . . . 10.0 111.058 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . 0.458 ' HD2' ' O ' ' C' ' 417' ' ' GLU . 16.2 Cg_endo -58.33 -39.6 82.82 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 123.12 2.547 . . . . 10.0 112.612 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 49.0 t -59.89 -43.12 91.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 87.8 m -68.44 -39.19 81.59 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.823 -0.436 . . . . 10.0 109.823 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -61.1 -48.31 82.27 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . 0.456 ' HB3' ' NZ ' ' A' ' 352' ' ' LYS . 69.1 mt-10 -62.69 -47.72 82.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.36 -0.837 . . . . 10.0 109.783 178.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -57.59 -41.12 80.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.3 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -67.84 -42.36 81.55 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.175 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . 0.489 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 3.9 t70 -63.59 -37.75 88.5 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.321 -0.622 . . . . 10.0 109.321 179.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -67.84 -43.39 79.62 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.486 -0.779 . . . . 10.0 108.96 178.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 30.5 mt -61.28 -36.57 80.42 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.915 -0.584 . . . . 10.0 109.74 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -67.4 -33.87 76.08 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.241 178.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 56.9 mttp -67.59 -47.78 68.75 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.028 -1.101 . . . . 10.0 108.028 177.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . 0.539 ' OE2' ' HD3' ' A' ' 345' ' ' ARG . 42.3 mt-10 -59.72 -47.6 85.01 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 114.951 -1.022 . . . . 10.0 111.106 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 2.8 p -63.41 -37.37 87.02 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.599 0.238 . . . . 10.0 110.825 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -62.98 -49.51 74.41 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.753 -0.832 . . . . 10.0 108.753 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.48 -46.38 93.94 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.885 -0.886 . . . . 10.0 110.885 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 59.2 mt -59.27 -34.12 71.88 Favored 'General case' 0 C--O 1.222 -0.385 0 CA-C-O 120.503 0.192 . . . . 10.0 110.564 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 52.3 mtt85 -69.24 -36.49 77.23 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 178.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -72.11 -33.02 67.51 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.997 -0.742 . . . . 10.0 108.997 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . 0.657 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 47.2 mt-10 -71.06 -53.39 14.86 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.182 -0.917 . . . . 10.0 109.197 178.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . 0.564 ' HA ' ' HB3' ' C' ' 444' ' ' ASP . 64.1 mtt -65.58 -29.16 69.73 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.616 0.969 . . . . 10.0 113.616 -178.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 1.8 p -61.17 -47.46 86.08 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.018 -0.673 . . . . 10.0 109.442 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -78.07 -39.61 41.11 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.954 -0.567 . . . . 10.0 109.855 178.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . 0.564 ' HB3' ' HA ' ' C' ' 441' ' ' MET . 11.8 t70 -56.04 -60.32 3.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.095 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 96.0 mt -60.31 -41.97 94.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.954 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.91 -39.79 90.89 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.851 -0.339 . . . . 10.0 110.91 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.67 -38.08 80.11 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.739 -0.838 . . . . 10.0 108.739 178.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 8.9 t -58.98 -43.42 88.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.292 0 CA-C-N 115.753 -0.658 . . . . 10.0 109.232 178.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -65.97 -40.77 91.54 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 178.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -74.48 -3.97 33.93 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.491 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . 0.677 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 4.1 mttp -106.34 -42.94 4.91 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.412 178.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 31.3 t -61.77 -41.47 90.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.678 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . 0.671 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 26.1 mt-30 -55.41 -60.48 8.27 Favored Pre-proline 0 CA--C 1.536 0.433 0 O-C-N 123.164 0.29 . . . . 10.0 111.461 179.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . 0.671 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 21.4 Cg_exo -67.74 -26.46 38.93 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 122.106 1.871 . . . . 10.0 111.334 178.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . 0.677 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.1 OUTLIER -64.23 -53.11 54.33 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 179.284 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 68.1 mt -66.31 -38.3 87.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.729 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . 0.449 ' HB3' ' HA ' ' C' ' 454' ' ' PRO . 1.5 t70 -59.57 -44.9 93.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.327 178.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . 0.518 ' HA ' ' HZ2' ' C' ' 461' ' ' LYS . 2.8 t70 -78.96 -33.6 45.09 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.917 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . 0.453 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 0.1 OUTLIER -62.85 -43.4 98.91 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 178.666 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -63.66 -42.18 98.11 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 123.368 0.417 . . . . 10.0 110.051 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . 0.518 ' HZ2' ' HA ' ' C' ' 458' ' ' ASP . 4.3 mttp -58.8 -43.09 90.42 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.213 0.53 . . . . 10.0 109.621 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -72.72 -40.6 65.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.306 -0.861 . . . . 10.0 110.436 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 1.2 m95 -62.49 -38.81 91.35 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.337 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -67.72 -42.97 81.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.161 178.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 0.595 ' HB3' HD11 ' C' ' 469' ' ' LEU . 38.7 mt-10 -62.61 -35.53 79.85 Favored 'General case' 0 C--N 1.333 -0.117 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 178.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -76.73 -48.21 19.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.148 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 9.8 ttt -61.4 -57.06 13.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.001 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -65.56 -38.67 90.25 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.252 -0.647 . . . . 10.0 109.252 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 0.595 HD11 ' HB3' ' C' ' 465' ' ' GLU . 96.4 mt -59.34 -36.27 75.39 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.358 -0.837 . . . . 20.0 109.925 178.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -77.19 -39.38 48.99 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.62 178.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -60.98 -38.65 86.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.996 0.427 . . . . 10.0 110.189 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -81.4 6.74 13.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.536 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . 0.487 ' HG2' HD13 ' A' ' 301' ' ' LEU . 51.3 mttp -123.0 -50.29 1.93 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.277 178.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 78.0 t -61.12 -36.89 75.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.691 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.28 -59.49 10.84 Favored Pre-proline 0 CA--C 1.534 0.327 0 N-CA-C 111.758 0.281 . . . . 10.0 111.758 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -60.96 -37.39 77.24 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 121.584 1.523 . . . . 10.0 111.051 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 38.5 mt -67.06 -33.85 76.4 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.006 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 24.9 mtt180 -63.55 -38.61 91.78 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 178.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -64.98 -45.76 84.27 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 178.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.68 -44.18 94.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.716 178.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 63.3 mt -65.92 -41.82 90.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.922 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -63.72 -49.68 72.11 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -65.06 -42.13 94.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.928 0.394 . . . . 10.0 110.278 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.54 -36.42 93.33 Favored Glycine 0 N--CA 1.447 -0.615 0 N-CA-C 111.011 -0.835 . . . . 10.0 111.011 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . 0.441 ' O ' ' HG ' ' C' ' 489' ' ' LEU . . . -76.12 -39.84 54.19 Favored 'General case' 0 C--O 1.219 -0.511 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 63.2 mtt180 -61.89 -43.78 98.16 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.978 -0.749 . . . . 10.0 108.978 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -65.74 -40.06 91.76 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 108.812 -0.81 . . . . 10.0 108.812 178.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -65.77 -34.81 79.04 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 109.614 -0.514 . . . . 10.0 109.614 178.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' C' ' 485' ' ' ALA . 57.9 mt -65.48 -41.44 93.29 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.728 -0.841 . . . . 10.0 108.728 178.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -68.55 -40.44 80.65 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.722 -0.844 . . . . 10.0 108.722 178.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -60.29 -44.26 95.52 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 108.521 -0.918 . . . . 10.0 108.521 177.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 46.7 mt -69.87 -33.06 71.73 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.854 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -61.09 -40.14 92.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.924 0.393 . . . . 10.0 110.56 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -79.57 11.66 2.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.586 0.708 . . . . 10.0 110.36 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.58 ' O ' ' HB2' ' C' ' 499' ' ' LEU . 54.7 mttp -125.59 -57.6 1.45 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.628 -0.715 . . . . 10.0 109.806 178.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 90.2 mt -60.71 -35.22 75.77 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.443 0.534 . . . . 10.0 112.443 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . 0.812 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 6.8 m -76.13 -62.84 0.67 Allowed Pre-proline 0 CA--C 1.538 0.517 0 C-N-CA 121.052 -0.259 . . . . 10.0 111.457 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . 0.812 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 52.1 Cg_exo -58.73 -54.54 2.76 Favored 'Trans proline' 0 C--N 1.357 1.015 0 C-N-CA 122.077 1.851 . . . . 10.0 111.787 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . 0.58 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 48.1 mt -65.92 -27.58 68.3 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 109.926 -0.398 . . . . 10.0 109.926 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -65.86 -47.12 77.89 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 110.127 -1.189 . . . . 10.0 110.127 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -64.8 -39.46 93.62 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.879 -0.785 . . . . 10.0 108.879 178.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -61.72 -52.39 64.46 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.64 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 88.0 mmm -58.87 -38.16 78.15 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.359 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -63.79 -45.57 89.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.853 0.359 . . . . 10.0 110.262 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . 0.441 ' O ' ' HB3' ' C' ' 508' ' ' ARG . 26.0 t70 -68.17 -45.52 73.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.696 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.496 ' HD2' ' OE1' ' A' ' 268' ' ' GLU . 13.4 mtt180 -63.73 -43.1 97.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.243 179.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -65.14 -33.42 75.97 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 177.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . 0.441 ' HB3' ' O ' ' C' ' 505' ' ' ASP . 37.5 ttm180 -62.94 -43.92 97.48 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 108.685 -0.858 . . . . 10.0 108.685 178.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . 0.633 ' HB1' ' HE3' ' A' ' 264' ' ' LYS . . . -65.74 -33.45 75.9 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.657 -0.702 . . . . 10.0 109.36 178.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . 0.543 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 6.2 m-70 -66.76 -51.12 59.55 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.103 -0.703 . . . . 10.0 109.103 178.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . 0.418 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 95.9 t -64.25 -42.33 95.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.659 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.52 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 34.9 t70 -61.95 -39.01 90.64 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 179.059 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -64.98 -40.22 94.65 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.332 -0.988 . . . . 10.0 108.332 177.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 87.6 mt -62.29 -29.71 70.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.472 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . 0.52 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 75.5 mtt180 -66.11 -30.68 71.22 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.396 -0.594 . . . . 10.0 109.396 178.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.4 10.94 33.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.605 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . 0.468 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 42.6 m170 -122.82 -49.64 1.98 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.332 -0.395 . . . . 10.0 111.435 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 89.8 mt -86.62 -42.77 13.18 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . 0.425 ' N ' ' HD2' ' C' ' 520' ' ' PRO . . . -56.18 -56.3 32.66 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 111.793 0.294 . . . . 10.0 111.793 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . 0.425 ' HD2' ' N ' ' C' ' 519' ' ' ALA . 25.6 Cg_endo -62.99 -29.89 76.05 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 121.857 1.704 . . . . 10.0 110.627 178.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . 0.407 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 0.0 OUTLIER -64.28 -39.63 94.32 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.886 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 15.8 m -62.52 -40.56 97.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.669 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . 0.479 ' O ' ' HG3' ' C' ' 527' ' ' GLN . 0.3 OUTLIER -65.68 -47.58 74.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.392 179.328 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -65.01 -37.08 86.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.615 -0.72 . . . . 10.0 110.804 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 23.8 mt -64.11 -38.41 90.95 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.117 -0.698 . . . . 10.0 109.117 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 50.6 mtt85 -62.94 -37.5 87.28 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.069 178.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' C' ' 523' ' ' ASP . 18.8 mt-30 -59.87 -42.92 94.78 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 179.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . 0.42 ' HB3' ' OE1' ' A' ' 242' ' ' GLU . 10.0 mtt180 -74.0 -44.44 54.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.103 179.268 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 68.0 mt -58.38 -38.82 78.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.031 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . 0.469 ' O ' ' HG2' ' C' ' 534' ' ' GLU . . . -62.6 -40.15 96.03 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.407 -0.361 . . . . 10.0 110.331 179.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.75 -41.33 79.08 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.127 -0.694 . . . . 10.0 109.127 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . 0.438 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 19.1 ttm180 -60.18 -42.29 94.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.357 -0.838 . . . . 10.0 109.108 178.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.68 -32.39 73.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.626 -0.716 . . . . 10.0 110.48 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' C' ' 538' ' ' GLU . 9.6 mm-40 -67.38 -44.65 78.39 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.57 -39.67 94.98 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.226 178.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 93.8 mt -68.7 -22.73 64.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.748 179.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -83.15 -47.25 11.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.289 -0.414 . . . . 10.0 109.972 179.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' C' ' 534' ' ' GLU . 9.3 mm-40 -64.69 -53.73 42.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.184 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -68.13 -43.28 78.72 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.311 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -58.49 -51.12 60.66 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.964 -0.636 . . . . 10.0 111.821 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.43 -41.88 99.74 Favored Glycine 0 N--CA 1.451 -0.361 0 N-CA-C 111.677 -0.569 . . . . 10.0 111.677 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -64.14 -50.35 68.56 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.982 -0.377 . . . . 10.0 109.982 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . 0.455 HH11 ' HD2' ' C' ' 543' ' ' ARG . 50.9 mtt180 -58.3 -35.55 72.0 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.624 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 33.2 mt -62.19 -47.09 86.03 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.696 -0.483 . . . . 10.0 109.696 178.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -64.45 -39.53 93.99 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.89 -0.596 . . . . 10.0 109.635 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 78.9 mt-10 -65.46 -47.69 75.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.777 178.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 15.7 m-30 -60.03 -40.86 90.8 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.323 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 29.8 m-70 -62.63 -46.14 89.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.827 0.346 . . . . 10.0 110.378 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.06 -47.5 77.11 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.354 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.39 -32.24 73.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.636 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.22 -37.1 80.5 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 23.1 m -66.2 -47.44 73.87 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.398 -0.964 . . . . 10.0 108.398 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -61.85 -33.98 75.16 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.717 -0.674 . . . . 10.0 109.521 178.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -74.0 -33.62 63.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.141 179.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 44.0 mt -69.34 -44.02 72.47 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.78 -0.452 . . . . 10.0 109.78 178.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 10.1 m -61.97 -40.73 96.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.471 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . 0.534 ' HA ' ' HG2' ' C' ' 560' ' ' GLU . 4.6 p -72.87 -17.57 61.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.247 0.546 . . . . 10.0 110.526 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' C' ' 558' ' ' LEU . 15.6 mt -87.09 -40.2 14.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.858 -0.61 . . . . 10.0 109.513 178.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.5 p -67.26 -28.03 67.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.217 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . 0.534 ' HG2' ' HA ' ' C' ' 557' ' ' THR . 2.7 pt-20 -72.75 -5.49 38.16 Favored 'General case' 0 C--N 1.339 0.12 0 CA-C-O 121.405 0.621 . . . . 10.0 110.106 178.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . 0.564 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 12.4 mptt -116.79 -39.3 3.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.241 177.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -65.87 -16.58 63.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.856 -0.611 . . . . 10.0 111.179 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . 0.944 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 95.9 mttt -103.59 -70.29 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.409 0 CA-C-O 119.311 -0.376 . . . . 10.0 111.199 178.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . 0.944 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 26.2 Cg_exo -64.04 -49.75 3.58 Favored 'Trans proline' 0 C--N 1.36 1.154 0 C-N-CA 122.405 2.07 . . . . 10.0 113.263 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -64.58 -38.95 92.78 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 121.14 -0.224 . . . . 10.0 111.54 -179.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' C' ' 566' ' ' LEU . 7.1 mt -66.64 -38.62 87.26 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.29 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -66.63 -36.87 83.62 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 178.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.62 -47.28 84.45 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.742 -0.836 . . . . 10.0 108.742 177.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . 0.447 HD12 HD23 ' C' ' 566' ' ' LEU . 89.4 mt -61.59 -40.89 96.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.455 178.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . 0.429 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 65.6 mtt180 -65.62 -46.93 77.41 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.015 -0.365 . . . . 10.0 110.015 178.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . 0.532 ' HA ' HD12 ' C' ' 574' ' ' LEU . 98.5 mt-30 -65.86 -22.74 66.55 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 115.788 -0.642 . . . . 20.0 111.983 179.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -86.15 -40.09 7.64 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 109.189 -1.564 . . . . 10.0 109.189 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 29.8 mt -64.88 -32.13 73.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.579 -0.31 . . . . 10.0 111.624 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . 0.532 HD12 ' HA ' ' C' ' 571' ' ' GLN . 35.7 mt -54.35 -62.28 4.22 Favored Pre-proline 0 CA--C 1.54 0.581 0 N-CA-C 112.357 0.502 . . . . 10.0 112.357 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -66.05 -31.09 46.72 Favored 'Trans proline' 0 C--N 1.357 0.974 0 C-N-CA 121.966 1.777 . . . . 10.0 111.001 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 11.6 t -64.65 -46.37 92.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.058 -0.519 . . . . 10.0 109.828 179.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 46.3 mt -64.71 -38.6 91.54 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . 0.46 ' O ' HG23 ' C' ' 582' ' ' VAL . 28.7 mt-10 -60.17 -50.84 72.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.55 178.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 2.7 p -68.27 -38.13 81.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.678 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -60.21 -44.44 95.14 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.246 178.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . 0.462 ' O ' ' HG ' ' C' ' 585' ' ' LEU . 68.5 mttm -62.1 -36.89 83.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.654 178.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . 0.46 HG23 ' O ' ' C' ' 578' ' ' GLU . 53.2 t -62.29 -46.3 96.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 178.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.63 -34.29 77.88 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.352 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -69.38 -44.44 71.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.287 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' C' ' 581' ' ' LYS . 88.0 mt -57.29 -47.2 82.06 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.538 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 1.9 p -68.81 -46.15 69.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.613 179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . 0.552 ' HB2' ' HD2' ' A' ' 396' ' ' LYS . . . -57.8 -54.0 51.88 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.441 -0.345 . . . . 10.0 111.743 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 88.9 mt -57.66 -41.06 80.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.804 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -71.4 -51.59 23.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.583 -0.28 . . . . 10.0 111.725 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -62.24 -40.69 97.0 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.944 0.35 . . . . 10.0 111.944 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . 0.477 ' O ' ' HG ' ' C' ' 595' ' ' LEU . 8.7 m-85 -64.46 -48.74 74.14 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.919 0.34 . . . . 10.0 111.919 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 11.8 p -63.18 -36.48 83.76 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 111.949 0.352 . . . . 10.0 111.949 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -63.8 -28.55 69.94 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.453 -0.34 . . . . 10.0 111.092 179.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . 0.573 ' HD3' ' HB2' ' A' ' 388' ' ' SER . 96.4 mttt -95.15 -15.49 23.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.428 -0.351 . . . . 10.0 111.504 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' C' ' 591' ' ' TYR . 60.9 mt -80.19 -25.07 39.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.293 -0.412 . . . . 10.0 111.381 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.793 -0.623 . . . . 10.0 109.759 179.989 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 16.7 ptp . . . . . 0 C--O 1.233 0.234 0 N-CA-C 110.283 -0.266 . . . . 10.0 110.283 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.92 138.32 50.49 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.027 0.441 . . . . 10.0 111.317 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.565 ' OE2' ' H81' ' A' ' 28' ' ' PCW . 9.3 mt-10 -115.32 130.61 56.95 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.047 -0.723 . . . . 10.0 109.047 178.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -122.26 136.38 54.89 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.851 0.357 . . . . 10.0 110.91 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.525 ' HD3' ' HB2' ' B' ' 54' ' ' ASP . 27.1 mmtt -107.52 114.37 28.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.372 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.48 HD22 HD23 ' B' ' 159' ' ' LEU . 14.2 mt -109.47 132.1 54.45 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.389 -179.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.429 HG22 ' HB3' ' B' ' 56' ' ' LEU . 67.2 t -121.44 125.92 74.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.965 0.412 . . . . 10.0 110.916 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 3.6 t -93.19 113.14 27.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.555 HG21 HD11 ' B' ' 100' ' ' ILE . 20.9 m -96.72 168.43 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.993 0.425 . . . . 10.0 111.801 -179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . 0.483 ' HA2' ' CZ ' ' B' ' 96' ' ' TYR . . . 131.65 161.0 9.99 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 110.873 -0.891 . . . . 10.0 110.873 -179.463 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.12 -140.55 0.07 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.891 0.376 . . . . 10.0 110.89 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -101.69 159.51 18.33 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.69 -0.767 . . . . 10.0 111.684 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.97 -24.54 15.13 Favored Glycine 0 CA--C 1.519 0.311 0 C-N-CA 121.048 -0.596 . . . . 10.0 113.004 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.447 HG23 ' HG3' ' B' ' 16' ' ' LYS . 3.3 m -60.65 -50.74 79.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 112.317 0.488 . . . . 10.0 112.317 -179.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 105.23 35.84 3.04 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.783 -0.722 . . . . 10.0 113.351 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.447 ' HG3' HG23 ' B' ' 14' ' ' VAL . 50.6 mtmt -59.49 -54.06 50.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.166 0.508 . . . . 10.0 111.255 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.62 -37.65 76.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.593 -0.731 . . . . 10.0 111.863 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.72 -44.79 92.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.339 -0.392 . . . . 10.0 110.997 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 99.1 mt -66.98 -33.26 75.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.055 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . 0.4 ' O ' HG12 ' B' ' 24' ' ' ILE . 7.1 m -71.15 -49.55 42.81 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.991 -0.549 . . . . 10.0 111.357 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 85.2 mt -63.31 -29.97 48.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.184 0.516 . . . . 10.0 110.43 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.597 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 6.3 tp-100 -66.75 -16.78 64.49 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.623 -0.717 . . . . 10.0 111.107 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 18.7 tp -106.5 -31.45 8.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.07 0.462 . . . . 10.0 110.901 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . 0.4 HG12 ' O ' ' B' ' 20' ' ' THR . 51.1 mm -76.04 -49.6 25.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.704 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -115.35 -8.97 12.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.764 0.316 . . . . 10.0 111.201 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.597 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 20.8 m120 65.83 41.53 3.8 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.317 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -133.75 142.79 48.09 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.018 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -99.97 137.23 38.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.491 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 19.1 m -89.87 159.55 2.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.906 0.384 . . . . 10.0 111.558 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -121.73 -19.92 6.63 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.351 0.596 . . . . 10.0 110.256 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -93.47 156.9 16.49 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.271 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.768 ' HA ' H5'1 ' B' ' 201' ' ' GNP . 11.1 t80 -86.28 104.83 16.18 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 110.111 -0.329 . . . . 10.0 110.111 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 31.9 t70 -77.54 115.77 52.43 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.757 179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 3.8 Cg_exo -78.31 62.59 8.16 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 123.24 2.626 . . . . 10.0 110.47 179.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . 0.513 HG22 ' HA ' ' B' ' 59' ' ' ALA . 0.8 OUTLIER -61.01 130.97 49.08 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.291 -0.868 . . . . 10.0 112.118 -179.628 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.438 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 74.3 mt -121.42 -53.12 3.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.106 -0.952 . . . . 10.0 108.566 178.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.28 104.79 3.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.514 -0.767 . . . . 10.0 109.345 179.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -159.0 137.5 10.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.423 -0.353 . . . . 10.0 111.269 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 15.4 m -135.76 149.63 49.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.812 0.339 . . . . 10.0 111.137 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -126.07 142.31 51.57 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . 0.528 ' HD3' ' OD2' ' B' ' 54' ' ' ASP . 30.2 ttp180 -129.06 133.05 47.54 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 111.838 0.31 . . . . 10.0 111.838 -178.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 30.1 mtpt -143.56 175.0 10.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.872 -0.604 . . . . 10.0 110.417 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -115.11 120.27 39.23 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 39.2 t -131.01 132.93 63.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.67 0.272 . . . . 10.0 110.651 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 38.9 t -78.61 111.66 15.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 108.635 -0.876 . . . . 10.0 108.635 178.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . 0.772 HD11 HD11 ' B' ' 53' ' ' LEU . 38.3 mt -114.28 117.7 56.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 120.883 0.373 . . . . 10.0 111.17 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.627 ' HB2' HH22 ' B' ' 164' ' ' ARG . 35.9 m-20 59.85 32.08 21.08 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.476 -0.783 . . . . 10.0 111.076 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.07 -29.93 7.13 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.69 -0.687 . . . . 10.0 113.004 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -84.8 146.59 27.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.906 0.384 . . . . 10.0 111.286 -179.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 14.8 t -102.86 139.19 38.75 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.899 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 3.0 p -154.12 158.45 40.44 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.316 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.551 HD13 ' H82' ' A' ' 6' ' ' PCW . 96.6 mt -93.67 120.56 34.1 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.235 -0.654 . . . . 10.0 109.235 179.282 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.772 HD11 HD11 ' B' ' 46' ' ' ILE . 63.7 mt -105.86 124.19 49.18 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.533 0.568 . . . . 10.0 112.533 -178.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.528 ' OD2' ' HD3' ' B' ' 41' ' ' ARG . 0.5 OUTLIER -107.77 110.49 22.32 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 107.591 -1.262 . . . . 10.0 107.591 177.84 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 22.8 mt -99.94 114.92 39.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 120.836 0.35 . . . . 10.0 111.489 -178.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.429 ' HB3' HG22 ' B' ' 7' ' ' VAL . 26.4 tp -94.49 112.13 23.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.931 -0.577 . . . . 10.0 111.147 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -93.67 94.83 8.81 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 178.658 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 37.6 p -67.51 161.74 24.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.174 -0.921 . . . . 10.0 113.157 -177.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.513 ' HA ' HG22 ' B' ' 35' ' ' THR . . . -65.61 165.24 12.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.578 -0.737 . . . . 10.0 111.112 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -84.28 -80.72 1.05 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.832 -0.699 . . . . 10.0 111.957 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -92.35 114.42 26.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.841 0.353 . . . . 20.0 110.718 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -150.05 160.93 43.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.493 -0.321 . . . . 10.0 110.22 -179.546 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 55.7 mm-40 -106.45 -170.61 1.75 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.009 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -80.12 76.75 6.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.201 0.524 . . . . 10.0 111.195 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.39 147.72 23.91 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.821 179.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.29 -35.63 77.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.9 0.381 . . . . 10.0 110.997 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 27.7 ttt -62.42 -37.02 84.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.794 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.65 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 55.8 ttt85 -60.95 -51.8 67.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.815 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.05 -35.35 78.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.776 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -61.17 -41.14 96.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.595 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . 0.65 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 2.5 p90 -84.09 -24.71 30.23 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 112.837 0.68 . . . . 10.0 112.837 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 53.1 mmm -76.36 -24.56 54.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.069 0.461 . . . . 10.0 111.242 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -79.73 -0.3 33.61 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.675 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.535 ' HA ' ' H63' ' A' ' 1' ' ' PCW . 0.1 OUTLIER -99.58 2.05 44.31 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.735 0.643 . . . . 10.0 112.735 -179.2 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -107.06 152.57 16.89 Favored Glycine 0 N--CA 1.454 -0.154 0 C-N-CA 120.248 -0.977 . . . . 10.0 113.108 -179.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -99.86 -60.6 1.5 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.964 0.411 . . . . 10.0 110.19 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -99.79 139.59 14.5 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.654 -0.703 . . . . 10.0 111.993 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -125.26 131.08 53.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.925 0.393 . . . . 10.0 111.082 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.776 ' HG ' HD22 ' B' ' 159' ' ' LEU . 77.6 mt -99.88 122.46 42.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.977 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 32.5 m -95.37 86.24 4.46 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.816 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.608 ' HA ' ' HB ' ' B' ' 114' ' ' VAL . 22.0 t -87.29 122.82 39.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.243 -178.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.825 ' HB3' HD11 ' B' ' 93' ' ' ILE . 38.9 p90 -130.04 169.3 15.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.41 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -104.94 123.16 47.28 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.504 179.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 2.3 pp -68.29 -10.97 13.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 112.01 0.374 . . . . 10.0 112.01 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . 0.566 ' HB3' ' O ' ' B' ' 122' ' ' SER . 2.2 p30 -102.95 10.96 37.97 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.373 -0.376 . . . . 10.0 111.46 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -136.83 104.29 5.45 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.93 -38.21 75.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.791 -0.64 . . . . 10.0 112.008 -178.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -63.0 -39.48 94.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.702 0.287 . . . . 10.0 110.992 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 24.0 t -60.19 -37.56 80.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.969 -0.559 . . . . 10.0 110.644 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -71.21 -39.28 71.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.395 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -66.86 -33.38 75.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.003 0.43 . . . . 10.0 111.145 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.24 -8.23 53.66 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.283 0.475 . . . . 10.0 112.283 -178.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . 0.825 HD11 ' HB3' ' B' ' 82' ' ' PHE . 25.8 mm -60.84 -35.83 67.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.109 0.48 . . . . 10.0 110.04 178.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . 0.441 ' O ' ' HG2' ' B' ' 98' ' ' GLU . 6.6 t-80 -68.63 -29.95 68.55 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 179.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -68.86 -44.12 74.01 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.091 -0.707 . . . . 10.0 109.091 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . 0.483 ' CZ ' ' HA2' ' B' ' 10' ' ' GLY . 22.5 m-85 -64.41 -43.87 93.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.6 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -54.87 -51.78 64.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.268 -0.878 . . . . 10.0 111.181 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' B' ' 94' ' ' HIS . 8.6 mm-40 -66.93 -37.39 84.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.354 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . 0.475 ' O ' HG13 ' B' ' 103' ' ' VAL . 32.5 tt0 -60.35 -46.94 88.13 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.484 -0.325 . . . . 10.0 110.213 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . 0.555 HD11 HG21 ' B' ' 9' ' ' VAL . 52.6 mt -66.69 -43.34 90.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.815 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . 0.539 ' HG2' ' HA ' ' B' ' 107' ' ' GLU . 33.7 mtpt -59.0 -35.98 74.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.856 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 45.9 ttp85 -77.05 -46.38 23.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.872 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.532 HG22 ' HA ' ' B' ' 100' ' ' ILE . 21.1 m -63.39 -28.17 44.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -95.03 -11.53 28.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.53 -0.305 . . . . 10.0 111.004 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 16.9 t70 60.73 21.06 11.09 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.383 0.611 . . . . 10.0 111.099 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 14.0 m -144.74 140.38 28.49 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.268 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . 0.539 ' HA ' ' HG2' ' B' ' 101' ' ' LYS . 26.9 mp0 -84.95 -20.0 31.29 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.317 0.58 . . . . 10.0 109.849 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -89.16 78.01 7.44 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.233 -0.894 . . . . 10.0 110.322 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.416 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 89.5 t -127.07 130.63 23.73 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.529 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 24.1 Cg_exo -64.74 112.36 1.96 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.967 2.445 . . . . 10.0 111.607 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . 0.586 ' HB2' HG21 ' B' ' 139' ' ' ILE . 54.1 mtt -130.21 158.27 40.19 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.598 -0.519 . . . . 10.0 109.598 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.617 ' HB ' HD23 ' B' ' 79' ' ' LEU . 84.3 t -137.31 129.72 42.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . 0.495 ' HG ' ' HE1' ' B' ' 82' ' ' PHE . 15.2 tp -82.44 117.74 22.7 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.808 -0.812 . . . . 10.0 108.808 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . 0.608 ' HB ' ' HA ' ' B' ' 81' ' ' VAL . 38.7 t -109.75 111.49 36.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 120.94 0.4 . . . . 10.0 111.984 -178.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -91.86 88.08 1.33 Allowed Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 110.375 -1.09 . . . . 10.0 110.375 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . 0.426 ' HA ' ' O ' ' B' ' 144' ' ' THR . 61.8 t30 -87.46 162.9 17.01 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 -178.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 28.3 mttm 67.72 32.84 5.2 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.242 -0.89 . . . . 10.0 111.731 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 28.0 p -85.8 6.71 26.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.288 0.566 . . . . 10.0 110.32 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.69 -21.73 26.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.987 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 82.3 mt -77.61 142.17 65.91 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.429 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.35 -19.91 55.43 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.945 2.43 . . . . 10.0 112.151 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . 0.566 ' O ' ' HB3' ' B' ' 85' ' ' ASN . 1.7 m -83.04 105.19 13.82 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 179.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -127.72 109.91 12.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.968 0.413 . . . . 10.0 111.657 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.05 -42.08 9.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.053 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 30.2 t -87.36 115.44 27.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.685 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -80.16 154.29 28.09 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.289 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . 0.488 HG23 ' HE2' ' B' ' 141' ' ' PHE . 5.9 m -60.23 -33.92 72.95 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.694 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -61.88 -37.72 85.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.061 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -68.18 -41.63 81.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.179 0.514 . . . . 10.0 110.084 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.99 -48.11 69.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.286 -0.87 . . . . 10.0 111.482 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.472 ' HG3' ' O ' ' B' ' 127' ' ' THR . 23.4 mt-30 -61.81 -38.03 86.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.956 0.408 . . . . 10.0 110.53 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -62.06 -51.5 67.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.744 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 55.6 tp -64.59 -41.77 96.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.003 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.76 -41.21 95.01 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.686 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -63.39 -40.23 96.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.41 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 12.9 m -66.03 -37.76 86.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.646 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 7.3 m-30 -73.87 -29.63 62.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.701 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 88.71 28.39 21.7 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 110.643 -0.983 . . . . 10.0 110.643 -178.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . 0.586 HG21 ' HB2' ' B' ' 111' ' ' MET . 46.0 pt -126.41 154.55 74.95 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.439 -0.38 . . . . 10.0 110.461 -179.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.21 157.05 29.85 Favored 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.448 2.098 . . . . 10.0 111.756 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.488 ' HE2' HG23 ' B' ' 127' ' ' THR . 37.9 t80 -119.57 126.89 52.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.606 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 36.6 mm -124.41 128.24 73.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.361 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -87.87 125.94 34.76 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.37 -0.974 . . . . 10.0 108.37 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . 0.426 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 40.6 p -123.3 138.13 54.69 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 113.323 0.86 . . . . 10.0 113.323 -177.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 7.7 t -107.47 125.17 50.92 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.094 -1.076 . . . . 10.0 108.094 178.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.24 -26.44 52.6 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.233 0.54 . . . . 10.0 110.41 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 46.5 tttp -77.26 -48.29 17.89 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.504 -0.771 . . . . 10.0 112.787 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' B' ' 149' ' ' ARG . 72.3 p -98.2 -10.99 23.21 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.629 0.603 . . . . 10.0 112.629 -178.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . 0.4 ' HB2' ' O ' ' B' ' 148' ' ' THR . 15.2 mtp-105 70.95 13.87 6.95 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 122.823 0.449 . . . . 10.0 111.329 -178.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . 0.403 ' O ' ' HA ' ' B' ' 144' ' ' THR . 6.4 tt0 -62.93 123.52 18.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.306 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 81.06 -13.78 30.29 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.938 -0.574 . . . . 10.0 113.97 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 86.9 t -61.71 -42.84 95.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.436 0.532 . . . . 10.0 112.436 -178.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -66.75 -48.26 69.67 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.852 0.316 . . . . 10.0 111.852 -179.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -66.77 -26.34 66.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.433 -0.349 . . . . 10.0 111.606 -179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.8 -47.69 85.19 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.966 0.413 . . . . 10.0 110.034 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -66.57 -40.14 88.82 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.958 178.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 19.3 m-30 -63.45 -45.39 91.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.065 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 69.8 m -57.79 -41.92 83.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.81 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.776 HD22 ' HG ' ' B' ' 79' ' ' LEU . 41.5 tp -57.66 -47.59 81.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.448 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.31 -36.42 76.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.232 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 77.7 mtt180 -66.8 -38.0 85.64 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.509 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . 0.539 ' HA ' ' HE3' ' B' ' 165' ' ' LYS . 76.0 mm-40 -65.05 -40.85 95.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.834 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . 0.49 HG13 ' O ' ' B' ' 159' ' ' LEU . 70.7 mt -61.25 -40.99 87.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.98 179.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . 0.627 HH22 ' HB2' ' B' ' 47' ' ' ASP . 0.5 OUTLIER -63.93 -40.0 95.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.038 179.465 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . 0.539 ' HE3' ' HA ' ' B' ' 162' ' ' GLU . 28.5 mtmt -61.34 -33.62 73.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.097 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 24.3 t-80 -65.0 -39.11 92.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.066 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . 0.728 ' HB3' ' H71' ' A' ' 4' ' ' PCW . 16.2 mmtt -69.01 -45.61 70.08 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.963 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -65.86 -47.03 76.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.963 -0.562 . . . . 10.0 111.938 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 54.5 tttm -56.66 -45.16 81.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.671 0.272 . . . . 10.0 111.533 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -65.85 -26.18 67.54 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 111.899 0.333 . . . . 10.0 111.899 -179.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . 0.416 ' OG ' ' H62' ' A' ' 4' ' ' PCW . 14.7 m -82.83 -23.44 33.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.808 0.337 . . . . 10.0 111.794 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp -114.24 14.08 18.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.691 -178.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.05 1.98 14.06 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 83.88 58.38 2.25 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.917 -0.659 . . . . 10.0 112.862 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . 0.46 ' HE2' ' H31' ' A' ' 32' ' ' PCW . 17.4 mttp -86.21 -30.79 22.14 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.914 0.388 . . . . 10.0 111.345 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -76.61 -8.5 57.36 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.185 0.517 . . . . 10.0 110.901 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -106.03 7.85 32.08 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.029 179.268 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . 0.452 ' HB3' ' HE2' ' B' ' 178' ' ' LYS . 39.0 mtpt 55.51 56.44 6.27 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.146 -0.934 . . . . 10.0 112.486 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 1.6 ttpm? -91.11 87.11 6.43 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.081 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 30.0 tttm 75.74 85.36 0.09 Allowed 'General case' 0 N--CA 1.469 0.487 0 O-C-N 124.095 0.872 . . . . 10.0 112.396 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 4.0 m -119.2 -56.29 2.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.898 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt 64.54 166.94 0.16 Allowed 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.735 0.643 . . . . 10.0 112.735 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.28 -5.18 56.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.112 -0.495 . . . . 10.0 111.213 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -160.76 132.46 5.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.582 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 71.7 m . . . . . 0 C--N 1.325 -0.469 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.789 179.492 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.44 0 N-CA-C 111.955 -0.458 . . . . 10.0 111.955 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 809' ' ' THR . . . . . 0.472 ' HB ' ' CG1' ' D' ' 821' ' ' VAL . 6.7 p -123.59 135.47 53.99 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.709 0.29 . . . . 10.0 110.972 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 6.8 t -118.5 133.85 64.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 110.206 -0.294 . . . . 10.0 110.206 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 811' ' ' LYS . . . . . 0.464 ' HE3' ' HB2' ' D' ' 811' ' ' LYS . 14.9 mtmt -87.69 112.92 22.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.485 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 39.1 t -91.52 124.78 44.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 109.736 -0.468 . . . . 10.0 109.736 179.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -88.97 115.01 26.22 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.765 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 83.0 mt -88.86 143.01 30.94 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.272 -179.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 815' ' ' PRO . . . . . 0.457 ' O ' ' H63' ' A' ' 11' ' ' PCW . 49.3 Cg_endo -68.44 -9.26 25.45 Favored 'Trans proline' 0 N--CA 1.476 0.451 0 C-N-CA 123.213 2.609 . . . . 10.0 112.666 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -88.39 18.59 4.37 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.735 -0.468 . . . . 10.0 109.735 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 26.4 mttt 61.87 47.29 6.14 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.547 0.689 . . . . 10.0 110.838 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 818' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -146.1 -177.19 5.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.758 -1.11 . . . . 10.0 108.639 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.92 165.23 37.35 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.952 -0.299 . . . . 10.0 111.351 -179.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 9.7 t -151.21 152.29 33.07 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.584 179.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 821' ' ' VAL . . . . . 0.472 ' CG1' ' HB ' ' D' ' 809' ' ' THR . 90.1 t -112.82 120.34 62.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 120.971 0.415 . . . . 10.0 110.934 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 31.3 m -113.13 157.51 13.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.612 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.21 133.09 35.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.621 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 13.1 t -86.98 109.29 18.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.556 -0.293 . . . . 10.0 110.328 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 -127.47 150.38 49.68 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -79.76 164.19 23.88 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 120.886 0.374 . . . . 10.0 110.696 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 89.25 -56.73 3.95 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 121.041 -0.599 . . . . 10.0 112.591 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 16.4 ptm -65.36 139.92 58.61 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.11 0.481 . . . . 10.0 111.268 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 829' ' ' SER . . . . . 0.914 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.0 OUTLIER -92.3 172.99 8.04 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.611 -179.374 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' D' D ' 830' ' ' VAL . . . . . 0.455 ' O ' ' HB2' ' D' ' 834' ' ' LEU . 90.5 t -60.83 -35.52 65.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.119 -0.697 . . . . 10.0 109.119 179.081 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 831' ' ' TYR . . . . . 0.629 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 87.0 t80 -58.68 -38.37 78.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.514 -0.766 . . . . 10.0 110.255 178.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -67.04 -58.49 4.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.958 -0.564 . . . . 10.0 111.444 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 1.3 m -61.27 -42.62 98.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.705 -0.68 . . . . 10.0 112.747 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 834' ' ' LEU . . . . . 0.674 HD11 HG21 ' D' ' 877' ' ' VAL . 0.5 OUTLIER -73.68 -24.14 59.92 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.96 0.356 . . . . 10.0 111.96 -179.273 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' D' D ' 835' ' ' ASP . . . . . 0.544 ' HB2' ' O ' ' D' ' 831' ' ' TYR . 35.1 t70 -59.45 -49.67 76.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.978 0.418 . . . . 10.0 110.605 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -60.69 -32.96 72.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.532 -0.758 . . . . 10.0 111.523 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -78.89 -33.4 45.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.774 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 838' ' ' LEU . . . . . . . . . . . . . 90.1 mt -81.82 -43.79 17.8 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -179.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 5.3 mmtp -61.79 -36.71 81.88 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 -179.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 3.4 p -72.49 -14.19 16.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.063 0.459 . . . . 10.0 111.459 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 841' ' ' ARG . . . . . 0.423 HH22 ' HB3' ' B' ' 41' ' ' ARG . 1.2 mmt180 -105.02 -6.58 19.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.215 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 83.9 26.59 40.86 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.803 -0.713 . . . . 10.0 112.478 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 8.1 mp -117.5 158.5 24.42 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.101 -0.333 . . . . 10.0 110.101 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -123.99 164.27 19.69 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -79.32 50.07 1.05 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.897 0.38 . . . . 10.0 110.562 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -102.8 -74.57 0.63 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.462 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 847' ' ' CYS . . . . . 0.636 ' HA ' ' H71' ' A' ' 29' ' ' PCW . 75.3 m -87.03 -16.96 34.09 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.793 -0.639 . . . . 10.0 111.237 -179.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 29.3 m -66.85 134.31 51.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.207 -0.452 . . . . 10.0 111.355 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 7.0 p -130.81 140.42 48.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.452 -0.573 . . . . 10.0 109.452 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 15.4 t -109.67 131.82 59.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.098 0.475 . . . . 10.0 111.584 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 851' ' ' TYR . . . . . 0.462 ' CE1' HG22 ' D' ' 860' ' ' VAL . 95.5 m-85 -117.48 157.21 26.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.356 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -110.35 153.79 24.44 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.021 -0.733 . . . . 10.0 109.021 178.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 853' ' ' LEU . . . . . 0.633 HD12 ' HB2' ' D' ' 874' ' ' GLU . 27.3 mt -105.04 51.86 0.75 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.853 0.359 . . . . 10.0 111.856 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 854' ' ' ILE . . . . . 0.718 ' HB ' ' H72' ' A' ' 13' ' ' PCW . 18.1 mt -72.29 86.95 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.398 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 855' ' ' LYS . . . . . 0.617 ' HD2' ' O1 ' ' A' ' 37' ' ' 17F . 65.1 mmtt 67.29 41.16 2.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.963 -1.017 . . . . 10.0 112.377 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 86.42 -33.17 3.71 Favored Glycine 0 C--N 1.332 0.312 0 CA-C-N 115.914 -0.584 . . . . 10.0 113.852 178.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 857' ' ' ARG . . . . . 0.669 ' HB2' ' H82' ' A' ' 13' ' ' PCW . 23.1 mmt-85 -70.58 114.34 8.58 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.783 0.325 . . . . 10.0 111.376 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 858' ' ' LYS . . . . . 0.849 ' H ' HN1A ' A' ' 34' ' ' 17F . 0.8 OUTLIER -66.94 100.14 0.7 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.804 179.999 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' D' D ' 859' ' ' THR . . . . . 0.469 ' OG1' ' H81' ' A' ' 13' ' ' PCW . 1.4 m -97.38 112.73 24.43 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.105 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 860' ' ' VAL . . . . . 0.462 HG22 ' CE1' ' D' ' 851' ' ' TYR . 2.0 t -58.17 150.88 4.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.989 -0.551 . . . . 10.0 110.799 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 4.3 t -137.53 166.72 23.22 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.34 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -106.67 160.25 15.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.681 0.277 . . . . 10.0 110.701 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 863' ' ' TRP . . . . . 0.629 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 73.3 m95 -76.86 -27.65 55.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.014 0.435 . . . . 10.0 110.688 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.33 -36.44 82.19 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.385 -0.825 . . . . 10.0 111.688 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.52 142.16 40.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.928 -0.578 . . . . 10.0 111.53 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 866' ' ' ALA . . . . . 0.914 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -78.16 162.12 26.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.831 -0.433 . . . . 10.0 109.831 179.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 867' ' ' ILE . . . . . 0.617 ' HA ' HD23 ' D' ' 870' ' ' LEU . 8.3 tp -87.7 1.66 6.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.118 0.485 . . . . 10.0 111.242 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -60.17 -53.21 67.21 Favored Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 113.688 0.995 . . . . 10.0 113.688 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.68 18.29 1.0 Allowed 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.222 1.948 . . . . 10.0 112.974 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 870' ' ' LEU . . . . . 0.703 HD12 ' HG2' ' D' ' 873' ' ' GLU . 2.9 mm? -106.99 20.57 18.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.386 0.612 . . . . 10.0 110.585 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -67.0 107.68 2.34 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.902 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 89.96 15.13 58.29 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.877 -0.677 . . . . 10.0 112.214 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 873' ' ' GLU . . . . . 0.703 ' HG2' HD12 ' D' ' 870' ' ' LEU . 10.0 tp10 -102.11 148.91 24.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.511 0.196 . . . . 10.0 110.544 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 874' ' ' GLU . . . . . 0.633 ' HB2' HD12 ' D' ' 853' ' ' LEU . 24.8 mt-10 -105.88 109.38 21.31 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 62.3 mt -87.26 118.21 26.53 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.286 0.476 . . . . 10.0 112.286 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 876' ' ' ILE . . . . . 0.807 HG23 ' H81' ' A' ' 9' ' ' PCW . 32.3 mt -103.18 114.59 43.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.499 179.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 877' ' ' VAL . . . . . 0.674 HG21 HD11 ' D' ' 834' ' ' LEU . 18.6 t -102.83 126.31 57.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.978 -0.379 . . . . 10.0 109.978 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 878' ' ' GLU . . . . . 0.478 ' OE1' ' H81' ' A' ' 11' ' ' PCW . 16.8 mm-40 -123.66 164.86 18.24 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.162 179.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 879' ' ' VAL . . . . . 0.593 ' O ' ' H42' ' A' ' 25' ' ' PCW . 48.5 t -112.13 108.63 26.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.856 0.36 . . . . 10.0 110.182 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 880' ' ' LEU . . . . . 0.733 ' HB2' ' H62' ' A' ' 29' ' ' PCW . 68.3 mt . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.266 -0.873 . . . . 10.0 109.798 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PCW . . . . . 0.677 ' C6 ' HN1A ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PCW . . . . . 0.53 H271 H483 ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PCW . . . . . 0.57 ' O2P' ' H63' ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PCW . . . . . 0.728 ' H71' ' HB3' ' B' ' 167' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PCW . . . . . 0.751 H431 H352 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PCW . . . . . 0.853 H152 H132 ' A' ' 24' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PCW . . . . . 0.606 ' H19' H432 ' A' ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PCW . . . . . 0.525 ' H73' ' O1P' ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PCW . . . . . 0.807 ' H81' HG23 ' D' ' 876' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PCW . . . . . 0.515 ' C7 ' HN1A ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PCW . . . . . 0.72 H322 ' H2 ' ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PCW . . . . . 0.797 ' H11' H121 ' A' ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PCW . . . . . 0.718 ' H72' ' HB ' ' D' ' 854' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PCW . . . . . 0.749 H131 H151 ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PCW . . . . . 0.639 ' H63' ' O1 ' ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PCW . . . . . 0.708 H352 ' H8A' ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PCW . . . . . 0.751 H352 H431 ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PCW . . . . . 0.629 ' H82' ' O1P' ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PCW . . . . . 0.756 ' H2 ' ' H11' ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PCW . . . . . 0.435 H241 H252 ' A' ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PCW . . . . . 0.489 ' H32' ' H31' ' A' ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PCW . . . . . 0.726 ' H52' ' H2 ' ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PCW . . . . . 0.756 ' H11' ' H2 ' ' A' ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PCW . . . . . 0.853 H132 H152 ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PCW . . . . . 0.62 H142 H381 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PCW . . . . . 0.785 ' H12' H132 ' A' ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PCW . . . . . 0.535 ' H83' ' O2P' ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PCW . . . . . 0.565 ' H81' ' OE2' ' B' ' 3' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PCW . . . . . 0.733 ' H62' ' HB2' ' D' ' 880' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PCW . . . . . 1.001 ' H73' ' HN1' ' A' ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PCW . . . . . 0.845 ' H2 ' ' H52' ' A' ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PCW . . . . . 0.732 ' H61' ' N1 ' ' A' ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' 17F . . . . . 0.621 ' H4 ' ' H11' ' A' ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' 17F . . . . . 0.849 HN1A ' H ' ' D' ' 858' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' 17F . . . . . 0.677 HN1A ' C6 ' ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' 17F . . . . . 0.664 ' H71' H271 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' 17F . . . . . 0.617 ' O1 ' ' HD2' ' D' ' 855' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' 17F . . . . . 0.751 ' O1 ' ' H81' ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' 17F . . . . . 0.708 ' H8A' H352 ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' 17F . . . . . 1.001 ' HN1' ' H73' ' A' ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PCW . . . . . 0.624 ' H32' H122 ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PCW . . . . . 0.623 H432 H231 ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PCW . . . . . 0.743 H221 H462 ' A' ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PCW . . . . . 0.48 H322 ' O3P' ' A' ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PCW . . . . . 0.69 H152 ' H19' ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PCW . . . . . 0.591 H432 H372 ' A' ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PCW . . . . . 0.591 H372 H432 ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PCW . . . . . 0.591 H341 H121 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PCW . . . . . 0.575 H341 H341 ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PCW . . . . . 0.578 H252 ' H78' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PCW . . . . . 0.743 H462 H221 ' A' ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PCW . . . . . 0.624 H122 ' H32' ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PCW . . . . . 0.543 ' H31' ' C3 ' ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PCW . . . . . 0.591 H121 H341 ' A' ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PCW . . . . . 0.48 ' O3P' H322 ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PCW . . . . . 0.656 H331 H131 ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PCW . . . . . 0.932 ' H42' HN1A ' A' ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PCW . . . . . 0.687 H121 H382 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PCW . . . . . 0.819 H342 ' H9A' ' A' ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' PCW . . . . . 0.538 H231 H251 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PCW . . . . . 0.687 H382 H121 ' A' ' 58' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PCW . . . . . 0.705 H472 H151 ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PCW . . . . . 0.654 H241 H261 ' A' ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PCW . . . . . 0.543 ' C3 ' ' H31' ' A' ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PCW . . . . . 0.519 ' H2 ' ' H41' ' A' ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PCW . . . . . 0.506 H241 H362 ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PCW . . . . . 0.813 ' H61' ' H8 ' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PCW . . . . . 0.711 ' H83' ' O1P' ' A' ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PCW . . . . . 0.584 H371 H132 ' A' ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PCW . . . . . 0.593 ' H41' ' O1P' ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PCW . . . . . 0.53 H431 ' H31' ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PCW . . . . . 0.723 H241 H352 ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' 17F . . . . . 0.498 ' H10' H261 ' A' ' 8' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' 17F . . . . . 0.69 ' H19' H152 ' A' ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' 17F . . . . . 0.559 ' H49' H481 ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' 17F . . . . . 0.446 ' H45' H182 ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' 17F . . . . . 0.819 ' H9A' H342 ' A' ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' 17F . . . . . 0.813 ' H8 ' ' H61' ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' 17F . . . . . 0.489 ' H78' H441 ' A' ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' 17F . . . . . 0.932 HN1A ' H42' ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 201' ' ' GNP . . . . . 0.768 H5'1 ' HA ' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 74.1 mt . . . . . 0 CA--C 1.521 -0.143 0 CA-C-O 120.919 0.39 . . . . 10.0 110.103 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -74.64 -17.47 60.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.287 0.565 . . . . 10.0 109.632 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 90.7 mt -69.26 -25.77 64.44 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.535 -0.757 . . . . 10.0 109.56 178.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 74.7 mt -69.77 -40.93 75.78 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.784 -0.643 . . . . 10.0 109.624 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.47 -36.07 82.79 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 178.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 41.0 t-20 -65.22 -52.7 52.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.273 -0.876 . . . . 10.0 109.094 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 4.2 m0 -58.61 -38.98 79.17 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.984 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -60.96 -39.63 90.26 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.128 0.49 . . . . 10.0 110.241 178.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 17.8 m -68.78 -22.25 64.29 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.572 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 90.5 t -85.13 -42.41 16.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.747 -0.66 . . . . 10.0 110.081 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.6 -33.43 75.88 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 121.066 -0.254 . . . . 10.0 110.868 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 13.6 p -71.81 -37.54 70.35 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.794 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.49 -37.12 71.31 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.977 -0.379 . . . . 10.0 109.977 179.049 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -64.53 -39.67 94.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.864 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 1.7 p -70.24 -42.76 71.78 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.486 -0.561 . . . . 10.0 109.486 178.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . 0.649 ' HD2' HG22 ' C' ' 557' ' ' THR . 20.2 mmtp -62.14 -32.54 73.14 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.553 178.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 14.7 mt -72.29 -49.16 36.86 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.426 -0.807 . . . . 10.0 109.98 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' A' ' 218' ' ' ARG . 8.2 ttm180 -60.3 -43.19 96.53 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.665 -0.243 . . . . 10.0 111.337 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -62.06 -21.26 64.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.251 -0.432 . . . . 10.0 111.283 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -99.66 -30.08 12.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.086 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 38.9 mt -64.09 -34.55 78.29 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.392 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -55.44 -68.44 1.69 Allowed Glycine 0 N--CA 1.451 -0.348 0 N-CA-C 110.287 -1.125 . . . . 10.0 110.287 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -55.07 -38.71 93.32 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.429 2.086 . . . . 10.0 111.353 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 5.7 t -58.31 -48.69 84.24 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 120.37 0.129 . . . . 10.0 111.118 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 9.3 p -66.78 -36.53 82.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.841 0.353 . . . . 10.0 110.504 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -65.8 -51.06 62.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.134 -0.485 . . . . 10.0 109.785 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -61.24 -44.06 97.87 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.124 179.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -63.25 -47.45 82.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.042 179.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 2.4 m95 -63.06 -42.2 99.63 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.714 -0.221 . . . . 10.0 110.807 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -69.05 -41.46 77.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.803 0.335 . . . . 10.0 110.475 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . 0.505 ' ND2' ' HG3' ' C' ' 543' ' ' ARG . 17.3 t-20 -61.98 -45.08 95.19 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.352 -0.981 . . . . 10.0 108.352 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 65.4 mt -67.94 -32.76 73.43 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.382 -0.826 . . . . 10.0 110.118 178.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -60.52 -45.68 92.94 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 109.598 -0.519 . . . . 10.0 109.598 178.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 31.0 mttt -60.73 -42.57 97.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.33 178.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -66.14 -47.38 74.25 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.415 -0.811 . . . . 10.0 110.495 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 22.7 p -63.85 -38.19 90.18 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 116.873 -0.149 . . . . 10.0 111.317 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -63.66 -47.88 79.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.995 0.426 . . . . 10.0 109.908 179.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -61.58 -47.04 92.88 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 109.573 -1.411 . . . . 10.0 109.573 178.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 28.6 mt -59.98 -35.16 74.4 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 115.435 -0.383 . . . . 10.0 110.96 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 59.5 mtt180 -66.96 -42.14 85.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.934 0.397 . . . . 10.0 110.141 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . 0.443 HE21 ' HB3' ' A' ' 241' ' ' GLN . 0.4 OUTLIER -67.47 -43.25 81.45 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.108 -0.701 . . . . 10.0 109.108 178.374 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -64.42 -44.95 89.62 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 115.441 -0.799 . . . . 10.0 109.965 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . 0.515 ' HA ' ' HB2' ' A' ' 246' ' ' ASP . 27.6 mmm -61.7 -30.48 70.78 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.337 179.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 70.7 m -63.91 -48.66 75.74 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 108.272 -1.01 . . . . 10.0 108.272 178.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -66.09 -44.55 84.07 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . 0.515 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.3 OUTLIER -54.07 -60.17 3.69 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 115.398 -0.819 . . . . 10.0 110.076 179.523 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 82.7 mt -61.64 -50.54 72.13 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.077 -0.51 . . . . 10.0 112.193 -179.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -57.28 -52.23 66.17 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.038 0.385 . . . . 10.0 112.038 -178.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -67.11 -42.19 84.94 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.63 0.233 . . . . 10.0 111.63 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . 0.511 HG22 ' HE1' ' C' ' 521' ' ' TYR . 24.5 t -65.37 -43.03 94.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.365 0 C-N-CA 121.156 -0.218 . . . . 10.0 111.215 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -66.6 -48.53 69.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.772 0.32 . . . . 10.0 110.806 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -60.28 -42.9 96.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.647 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -75.63 -29.06 59.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.41 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.459 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.8 OUTLIER -57.82 -31.85 41.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.593 179.623 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -60.75 -66.45 1.53 Allowed Pre-proline 0 N--CA 1.448 -0.525 0 CA-C-O 119.036 -0.506 . . . . 10.0 111.132 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.05 -31.95 83.79 Favored 'Trans proline' 0 C--N 1.357 0.998 0 C-N-CA 121.637 1.558 . . . . 10.0 112.053 178.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . 0.429 ' O ' ' HB2' ' A' ' 261' ' ' PHE . 5.5 m-30 -61.16 -50.3 73.74 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 120.741 0.305 . . . . 10.0 110.421 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 97.5 mt -80.63 -33.66 35.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.482 . . . . 10.0 111.179 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . 0.413 ' O ' ' HG3' ' A' ' 263' ' ' LYS . 15.1 t70 -64.31 -49.43 71.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.58 -0.282 . . . . 10.0 111.104 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -66.85 -39.19 87.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.06 0.457 . . . . 10.0 109.864 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' A' ' 257' ' ' TYR . 0.3 OUTLIER -64.35 -31.33 72.49 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.066 -0.716 . . . . 10.0 109.066 178.169 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -69.0 -40.81 78.48 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.006 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 259' ' ' ASP . 82.4 mttt -56.09 -48.05 76.87 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.093 -1.077 . . . . 10.0 108.093 178.246 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.413 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 14.5 mptt -63.86 -47.78 79.36 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.564 -1.198 . . . . 10.0 110.157 179.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -37.22 75.53 Favored 'General case' 0 N--CA 1.464 0.239 0 O-C-N 123.314 0.384 . . . . 10.0 111.204 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -62.99 -49.64 73.87 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.995 -0.743 . . . . 10.0 108.995 178.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -63.47 -38.35 90.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 10.0 109.667 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . 0.526 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 22.5 mt-10 -60.47 -52.93 63.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.522 179.114 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 81.0 mmm -66.18 -42.69 88.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.473 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -65.15 -48.73 72.5 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.549 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 45.5 mt -64.59 -35.85 82.31 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . 0.526 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 15.1 t80 -62.13 -49.93 73.9 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 54.8 mtt85 -65.34 -41.21 94.14 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.709 0.29 . . . . 10.0 110.415 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.39 -31.67 67.89 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.488 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.722 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 56.4 mttp -90.5 -42.25 10.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.021 178.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . 0.441 ' O ' ' HB2' ' A' ' 280' ' ' ARG . 5.6 t -53.53 -44.73 57.5 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.404 0 N-CA-C 112.255 0.465 . . . . 10.0 112.255 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -53.66 -62.0 4.34 Favored Pre-proline 0 CA--C 1.542 0.646 0 N-CA-C 112.556 0.576 . . . . 10.0 112.556 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . 0.506 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 29.3 Cg_endo -65.56 -36.84 31.93 Favored 'Trans proline' 0 C--N 1.353 0.816 0 C-N-CA 121.906 1.737 . . . . 10.0 112.287 178.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.868 HD22 ' HG2' ' C' ' 495' ' ' LYS . 58.1 mt -65.14 -34.22 77.87 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.098 0.475 . . . . 10.0 109.969 179.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 26.2 ttt180 -70.21 -35.13 73.69 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 108.065 -1.087 . . . . 10.0 108.065 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.75 -40.77 95.85 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.189 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 74.0 mt-10 -62.96 -43.04 99.89 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.704 -0.85 . . . . 10.0 108.704 178.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 63.9 mt -63.36 -37.62 87.99 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.429 -0.805 . . . . 10.0 109.918 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -68.3 -50.69 51.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.442 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -60.98 -43.53 98.67 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.37 -44.63 96.56 Favored Glycine 0 N--CA 1.438 -1.176 0 N-CA-C 110.486 -1.046 . . . . 10.0 110.486 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.82 -37.98 86.43 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 110.545 -0.169 . . . . 10.0 110.545 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -60.66 -42.26 96.66 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.765 -0.457 . . . . 10.0 109.765 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 11.1 tm0? -70.89 -49.82 41.72 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.751 -0.658 . . . . 10.0 109.713 178.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 46.8 mttt -56.68 -41.24 76.98 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.836 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 17.6 mt -70.52 -39.28 74.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.399 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.07 -41.23 99.4 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.4 -34.44 75.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.664 178.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 86.5 mt -75.51 -42.15 53.5 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.441 -0.799 . . . . 10.0 109.55 178.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -62.12 -39.19 91.7 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.393 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -77.5 14.98 0.86 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.745 178.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 23.8 mttp -133.07 -42.14 0.89 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.49 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . 0.41 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 93.3 mt -58.05 -32.67 68.23 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.361 179.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . 0.434 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 3.1 m -82.57 -62.32 0.31 Allowed Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . 0.434 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 18.1 Cg_endo -60.46 -49.92 8.02 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 121.832 1.688 . . . . 10.0 112.597 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.5 HD13 ' HG2' ' C' ' 473' ' ' LYS . 98.2 mt -75.8 -13.12 60.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.006 0.431 . . . . 10.0 110.271 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . 0.41 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -83.63 -47.92 5.46 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 109.815 -1.314 . . . . 10.0 109.815 178.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 57.5 mt-10 -61.1 -44.94 96.59 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . 0.518 ' O ' ' HG3' ' A' ' 308' ' ' ARG . 1.9 mt-10 -64.4 -39.15 93.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.366 179.243 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . 0.461 ' SD ' ' HE3' ' C' ' 473' ' ' LYS . 16.2 tpt -64.28 -39.3 93.65 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.228 -0.656 . . . . 10.0 109.228 178.477 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . 0.434 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 91.9 mtt180 -70.29 -39.83 74.62 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.284 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . 0.666 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 28.2 t70 -65.07 -43.71 91.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.958 0.408 . . . . 10.0 110.432 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . 1.13 ' CD ' HD21 ' C' ' 469' ' ' LEU . 11.7 mtp180 -69.92 -28.67 65.79 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.255 -0.646 . . . . 10.0 109.255 178.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . 0.629 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -71.81 -29.82 64.84 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 177.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . 0.666 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 77.9 mtt180 -62.58 -52.96 61.35 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.437 -0.949 . . . . 10.0 108.437 178.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -64.18 -35.36 80.53 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . 0.629 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.1 OUTLIER -57.08 -56.77 17.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.452 -0.794 . . . . 10.0 110.243 179.01 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 47.6 t -75.65 -39.69 39.76 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 CA-C-N 115.731 -0.668 . . . . 10.0 112.15 -179.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . 0.624 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 0.2 OUTLIER -59.96 -51.0 71.56 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 122.419 -0.176 . . . . 10.0 111.111 179.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -64.23 -26.43 68.5 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.351 -0.611 . . . . 10.0 109.351 178.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . 0.859 ' HG ' ' HE3' ' C' ' 462' ' ' LYS . 5.2 mt -71.79 -37.75 70.38 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.624 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 79.7 mtt180 -63.27 -49.94 72.12 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.32 -11.83 45.74 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.779 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -98.34 -41.58 7.77 Favored 'General case' 0 C--O 1.223 -0.331 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 178.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 316' ' ' LEU . 86.4 mt -65.6 -34.24 77.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.973 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . 0.412 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -55.31 -61.66 5.67 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.498 -0.319 . . . . 10.0 111.587 179.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.412 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 33.8 Cg_endo -66.86 -30.06 40.85 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.597 1.531 . . . . 10.0 111.541 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -63.79 -50.35 69.33 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 110.023 -0.362 . . . . 10.0 110.023 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . 0.497 ' HA ' ' HB2' ' A' ' 327' ' ' LEU . 18.7 p -70.64 -34.54 72.17 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 110.181 -0.304 . . . . 10.0 110.181 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -59.05 -53.84 53.82 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -70.09 -29.41 66.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.69 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . 0.497 ' HB2' ' HA ' ' A' ' 324' ' ' SER . 9.3 mt -63.2 -39.13 93.74 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.422 -0.585 . . . . 10.0 109.422 178.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 38.3 mtt180 -64.56 -35.26 80.4 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 109.492 -0.559 . . . . 10.0 109.492 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -69.84 -45.63 67.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.832 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . 0.537 ' HD3' ' OD2' ' C' ' 444' ' ' ASP . 9.6 ttm180 -63.5 -44.54 94.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.785 -0.643 . . . . 10.0 109.879 179.34 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 60.2 mt -65.31 -36.93 85.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.046 178.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -64.43 -44.84 89.91 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.22 -0.659 . . . . 10.0 109.22 178.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -60.45 -44.42 95.84 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.944 178.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . 0.488 ' HA ' ' HG2' ' C' ' 440' ' ' GLU . 3.6 mtt180 -63.33 -52.14 63.09 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-N 115.773 -0.648 . . . . 10.0 110.335 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 79.5 mt -60.25 -36.73 78.43 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.853 0.358 . . . . 10.0 111.054 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . 0.683 ' HA ' ' HE3' ' A' ' 339' ' ' LYS . 36.0 tt0 -67.39 -44.39 78.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.243 179.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.51 -46.66 72.22 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . 0.534 ' HA ' ' HB3' ' A' ' 341' ' ' ASN . 82.8 mt -63.99 -19.54 65.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.16 179.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . 0.683 ' HE3' ' HA ' ' A' ' 336' ' ' GLU . 12.9 ttmt -67.56 -48.15 67.77 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.671 -0.863 . . . . 10.0 108.671 178.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -77.87 -41.99 34.94 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . 0.664 HD21 ' HA ' ' C' ' 433' ' ' GLU . 27.7 t-20 -56.93 -48.97 77.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.804 -1.089 . . . . 10.0 109.629 179.282 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -76.77 -35.79 39.04 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.496 -0.775 . . . . 10.0 111.693 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.25 -47.94 88.6 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.761 -0.733 . . . . 10.0 111.329 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . 0.532 ' O ' ' HG2' ' A' ' 348' ' ' GLU . . . -66.97 -38.78 86.71 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 -61.43 -41.71 97.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.116 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 75.6 mt -63.4 -40.9 98.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.905 -0.589 . . . . 10.0 109.725 179.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -65.47 -41.08 93.72 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 344' ' ' ALA . 75.5 mm-40 -60.48 -53.28 59.4 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.575 -0.739 . . . . 10.0 109.537 178.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -63.92 -28.92 70.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.444 -0.798 . . . . 10.0 111.636 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.91 -50.42 29.29 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.112 -0.329 . . . . 10.0 110.112 179.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.99 98.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.957 0.408 . . . . 10.0 110.09 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . 0.595 ' HG2' HG22 ' C' ' 422' ' ' VAL . 8.1 mtmm -70.13 -23.55 63.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.066 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -70.09 -39.69 75.4 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -38.3 90.58 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.04 -0.726 . . . . 10.0 109.04 178.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -66.87 -38.0 85.5 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.18 -0.674 . . . . 10.0 109.18 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -62.68 -49.49 74.93 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 115.623 -0.717 . . . . 10.0 109.494 178.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 84.5 mt -61.13 -39.65 90.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.343 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . 0.415 ' O ' ' HG3' ' A' ' 362' ' ' GLU . 50.3 m -63.46 -52.87 59.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.534 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . 0.43 ' HA ' ' OE1' ' A' ' 362' ' ' GLU . 3.2 p -67.15 -26.0 66.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.206 0.527 . . . . 10.0 110.751 179.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 20.6 tp -74.11 -37.63 64.07 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 72.6 m -64.63 -29.88 70.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.11 0.481 . . . . 10.0 109.982 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . 0.43 ' OE1' ' HA ' ' A' ' 359' ' ' THR . 46.4 mt-10 -70.05 -7.54 42.02 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.122 178.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.476 ' HD3' HG23 ' C' ' 411' ' ' THR . 34.0 mttp -115.92 -32.87 5.29 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.709 -0.678 . . . . 10.0 109.356 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.38 -24.78 63.01 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.664 -0.698 . . . . 10.0 111.105 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.905 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 94.9 mttt -106.79 -71.72 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 112.134 0.42 . . . . 10.0 112.134 179.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.905 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 39.4 Cg_exo -59.11 -53.87 3.22 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 122.194 1.93 . . . . 10.0 113.028 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -62.77 -48.16 80.36 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.824 0.305 . . . . 10.0 111.824 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . 0.546 HD23 HD12 ' A' ' 371' ' ' LEU . 9.9 mt -62.04 -37.29 84.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.804 0.335 . . . . 10.0 110.731 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . 0.643 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 41.9 tt0 -65.35 -44.62 87.11 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 178.478 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.51 -37.61 88.15 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . 0.546 HD12 HD23 ' A' ' 368' ' ' LEU . 42.0 mt -63.32 -43.6 97.34 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 57.7 mtt180 -64.93 -38.21 90.22 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 108.359 -0.978 . . . . 10.0 108.359 178.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.643 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.5 mt-30 -65.61 -21.57 66.59 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.205 -0.907 . . . . 20.0 112.157 179.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -93.15 -37.35 5.69 Favored Glycine 0 CA--C 1.523 0.594 0 N-CA-C 108.75 -1.74 . . . . 10.0 108.75 178.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 49.1 mt -59.45 -37.8 79.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.811 -0.195 . . . . 10.0 111.433 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 75.8 mt -56.09 -62.43 4.75 Favored Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 112.038 0.384 . . . . 10.0 112.038 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -64.1 -34.81 56.44 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 121.983 1.789 . . . . 10.0 112.037 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 25.3 t -63.66 -54.57 30.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.517 0.199 . . . . 10.0 110.811 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 36.3 mt -63.35 -35.84 81.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.637 0.256 . . . . 10.0 110.921 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . 0.467 ' O ' HG23 ' A' ' 384' ' ' VAL . 14.1 tt0 -64.5 -51.01 65.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.554 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 12.6 p -65.28 -36.95 85.68 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.768 0.318 . . . . 10.0 110.879 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -68.31 -36.24 79.02 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.69 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 49.6 mttt -65.8 -37.2 85.63 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.682 -0.488 . . . . 10.0 109.682 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 380' ' ' GLU . 87.2 t -63.49 -44.24 98.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.084 178.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.35 -37.91 71.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.086 -0.507 . . . . 10.0 110.907 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . 0.459 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 1.6 m-85 -67.68 -45.9 73.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.516 -0.311 . . . . 10.0 111.139 179.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 34.6 mt -59.97 -45.38 92.88 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.998 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 77.4 p -70.76 -28.86 65.0 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.715 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -69.2 -38.45 78.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.087 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 95.8 mt -57.51 -40.98 79.92 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.478 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -60.63 -46.02 91.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.667 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . 0.681 ' HA ' ' HD2' ' A' ' 395' ' ' LYS . 0.0 OUTLIER -61.68 -41.51 97.67 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.341 -0.845 . . . . 10.0 111.666 -179.58 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -60.85 -44.29 97.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.063 0.459 . . . . 10.0 109.788 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 8.9 m -60.46 -39.3 87.08 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.487 -0.779 . . . . 10.0 111.45 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . 0.681 ' HD2' ' HA ' ' A' ' 392' ' ' GLU . 87.2 mttt -60.88 -28.45 68.89 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.738 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.18 -20.26 28.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.858 0.361 . . . . 10.0 111.618 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 76.7 mt -85.23 -50.07 7.68 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.127 -0.488 . . . . 10.0 109.949 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 30.6 p30 . . . . . 0 N--CA 1.466 0.339 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.215 179.729 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 41.0 tp . . . . . 0 C--O 1.231 0.128 0 CA-C-O 121.219 0.533 . . . . 10.0 109.563 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -74.64 -27.14 60.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.412 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 11.3 mt -61.23 -27.1 68.2 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.799 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 77.0 mt -62.61 -42.09 99.38 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -71.03 -31.75 68.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.962 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . 0.489 ' O ' HG23 ' C' ' 408' ' ' VAL . 14.5 t-20 -64.88 -48.23 75.0 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.637 -0.875 . . . . 10.0 108.637 178.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 47.4 m0 -63.72 -37.01 85.75 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.522 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.18 -45.61 87.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.551 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 31.0 m -63.81 -36.63 84.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.738 -0.664 . . . . 10.0 109.997 178.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . 0.489 HG23 ' O ' ' C' ' 404' ' ' ASN . 89.3 t -67.46 -33.74 64.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 24.2 m -66.17 -40.17 90.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.736 -0.665 . . . . 10.0 109.215 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . 0.446 ' O ' ' HG2' ' C' ' 414' ' ' LYS . 7.4 m -66.78 -37.17 84.04 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.494 -0.928 . . . . 10.0 108.494 177.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . 0.476 HG23 ' HD3' ' A' ' 363' ' ' LYS . 76.6 m -63.18 -44.32 95.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.158 -0.928 . . . . 10.0 109.671 178.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . 0.438 ' HA ' HD12 ' C' ' 415' ' ' LEU . 1.1 m-85 -61.26 -38.35 86.41 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.306 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 32.2 m -62.33 -41.84 98.89 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.802 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' C' ' 410' ' ' SER . 73.4 mmtt -66.11 -31.86 72.97 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.778 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' C' ' 411' ' ' THR . 95.4 mt -69.16 -40.23 78.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.059 -0.519 . . . . 10.0 109.688 178.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -66.55 -44.85 81.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.338 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -64.92 -25.61 67.95 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.956 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' C' ' 414' ' ' LYS . 0.0 OUTLIER -79.22 -51.86 8.91 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.69 179.213 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 84.4 mt -52.69 -40.0 62.51 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.637 -0.711 . . . . 10.0 112.523 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -48.24 -79.3 0.07 OUTLIER Glycine 0 CA--C 1.523 0.543 0 O-C-N 123.6 0.563 . . . . 10.0 113.679 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -60.14 -35.87 90.8 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.621 2.214 . . . . 10.0 112.212 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . 0.595 HG22 ' HG2' ' A' ' 352' ' ' LYS . 35.9 t -60.56 -49.49 84.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 N-CA-C 112.132 0.419 . . . . 10.0 112.132 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 51.5 p -70.39 -34.58 72.74 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 121.097 -0.241 . . . . 10.0 111.118 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -60.13 -50.6 73.03 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -74.09 -24.72 59.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.511 179.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . 0.431 ' HB2' ' O ' ' C' ' 422' ' ' VAL . 48.8 t80 -68.59 -46.14 70.16 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.276 -0.639 . . . . 10.0 109.276 178.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -37.35 87.09 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 108.72 -0.844 . . . . 10.0 108.72 178.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -64.5 -44.45 90.91 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.63 -0.878 . . . . 10.0 108.63 177.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.88 -37.06 86.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.495 178.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 44.7 mt -63.13 -41.06 99.25 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . 0.539 ' HA ' ' OG1' ' C' ' 434' ' ' THR . 4.7 mm-40 -68.18 -35.06 77.42 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.969 -0.559 . . . . 10.0 110.403 178.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 38.0 mttp -62.56 -36.65 83.32 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.861 -1.163 . . . . 10.0 107.861 177.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . 0.664 ' HA ' HD21 ' A' ' 341' ' ' ASN . 38.2 tt0 -69.66 -48.75 58.71 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 114.96 -1.018 . . . . 10.0 110.172 179.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . 0.539 ' OG1' ' HA ' ' C' ' 431' ' ' GLU . 0.3 OUTLIER -64.2 -36.01 82.67 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 116.792 -0.185 . . . . 10.0 110.736 179.727 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -63.93 -35.12 79.62 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.686 -0.487 . . . . 10.0 109.686 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -69.38 -45.39 60.75 Favored Glycine 0 N--CA 1.445 -0.748 0 N-CA-C 108.807 -1.717 . . . . 10.0 108.807 177.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 87.5 mt -64.32 -24.6 67.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.373 -0.413 . . . . 10.0 110.796 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 39.8 mtt180 -74.77 -3.49 31.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.24 0.543 . . . . 10.0 110.341 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -118.04 -38.37 3.23 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.112 -1.069 . . . . 10.0 108.112 177.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . 0.488 ' HG2' ' HA ' ' A' ' 334' ' ' ARG . 40.3 mt-10 -72.22 -59.8 2.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.092 -0.958 . . . . 10.0 110.73 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . 0.46 ' HA ' ' HB3' ' C' ' 444' ' ' ASP . 93.3 mmm -66.43 -31.35 72.05 Favored 'General case' 0 C--O 1.225 -0.236 0 N-CA-C 112.908 0.706 . . . . 10.0 112.908 -178.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.3 p -62.66 -52.08 64.73 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 179.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -66.73 -40.23 88.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.996 -0.742 . . . . 10.0 108.996 178.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . 0.537 ' OD2' ' HD3' ' A' ' 330' ' ' ARG . 15.5 t70 -55.07 -53.83 50.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.705 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . 0.505 ' HA ' HG12 ' C' ' 448' ' ' VAL . 96.6 mt -63.88 -47.09 82.01 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.552 0.575 . . . . 10.0 112.552 -179.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -65.31 -38.46 90.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.903 0.382 . . . . 10.0 110.999 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . 0.486 ' O ' ' HG2' ' C' ' 451' ' ' LYS . 0.8 OUTLIER -72.79 -42.56 63.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.447 179.295 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . 0.505 HG12 ' HA ' ' C' ' 445' ' ' LEU . 2.3 p -65.55 -35.59 75.62 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.189 0 CA-C-N 116.656 -0.247 . . . . 10.0 110.981 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -66.0 -37.76 86.74 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.779 -0.823 . . . . 10.0 108.779 178.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -72.98 -11.46 60.58 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.322 -0.854 . . . . 10.0 110.033 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . 0.486 ' HG2' ' O ' ' C' ' 447' ' ' GLU . 35.9 mmtm -94.66 -40.16 9.96 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . 0.478 HG23 ' O ' ' C' ' 448' ' ' VAL . 59.5 t -59.62 -42.25 87.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.727 -0.67 . . . . 10.0 111.654 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . 0.892 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 18.5 mt-30 -54.32 -61.54 5.35 Favored Pre-proline 0 CA--C 1.537 0.468 0 O-C-N 122.97 0.169 . . . . 10.0 111.403 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . 0.892 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 23.9 Cg_exo -66.78 -28.99 42.99 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 122.171 1.914 . . . . 10.0 111.605 178.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -64.49 -52.02 60.01 Favored 'General case' 0 C--O 1.222 -0.367 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 43.3 mt -65.64 -43.52 89.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.358 179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -58.72 -51.45 69.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.99 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -71.97 -32.17 67.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.766 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . 0.528 ' HZ ' ' H39' ' A' ' 73' ' ' 17F . 50.9 t80 -67.7 -48.03 67.7 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -68.04 -29.58 68.6 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . 0.406 ' HB2' ' HE3' ' C' ' 461' ' ' LYS . 5.0 ttmt -65.23 -46.69 79.6 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.539 -0.911 . . . . 10.0 108.539 177.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . 0.859 ' HE3' ' HG ' ' A' ' 316' ' ' LEU . 19.2 mttm -69.37 -38.75 78.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.432 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . 0.426 ' O ' ' HB2' ' C' ' 467' ' ' MET . 0.0 OUTLIER -62.75 -31.8 72.82 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 178.628 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -69.77 -45.59 67.69 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 0.832 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 59.2 mt-10 -55.66 -43.55 76.39 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . 0.458 ' HA ' HD12 ' C' ' 469' ' ' LEU . 19.3 mt-10 -73.47 -34.1 65.19 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 115.275 -0.875 . . . . 10.0 110.884 179.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . 0.426 ' HB2' ' O ' ' C' ' 463' ' ' TRP . 0.0 OUTLIER -62.45 -42.32 99.38 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.553 -0.906 . . . . 10.0 108.553 178.619 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -66.1 -47.21 74.97 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 107.894 -1.15 . . . . 10.0 107.894 177.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 1.13 HD21 ' CD ' ' A' ' 308' ' ' ARG . 96.2 mt -55.82 -44.62 78.05 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 115.217 -0.901 . . . . 20.0 111.489 178.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -62.6 -41.44 98.97 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 116.361 -0.381 . . . . 10.0 110.135 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 27.0 mtm180 -69.84 -36.93 75.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.964 0.412 . . . . 10.0 110.528 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -79.97 2.76 22.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.092 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . 0.5 ' HG2' HD13 ' A' ' 301' ' ' LEU . 29.3 mttm -120.51 -57.71 1.89 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.367 -0.378 . . . . 10.0 110.55 178.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . 0.576 HG13 ' H74' ' A' ' 76' ' ' 17F . 84.0 t -62.47 -42.77 97.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 112.752 0.649 . . . . 10.0 112.752 -179.022 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -61.28 -58.19 20.57 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 112.378 0.51 . . . . 10.0 112.378 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -60.48 -33.86 93.48 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 121.663 1.575 . . . . 10.0 110.51 178.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 12.2 mt -66.61 -44.11 82.96 Favored 'General case' 0 C--O 1.213 -0.828 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . 0.474 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 65.4 mtt180 -54.89 -41.39 70.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.886 0.374 . . . . 10.0 110.177 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -67.48 -56.78 8.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.523 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . 0.421 ' CD ' ' HZ1' ' A' ' 297' ' ' LYS . 0.1 OUTLIER -67.64 -34.61 77.32 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.148 0.796 . . . . 10.0 113.148 -179.211 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 30.5 mt -68.6 -35.26 77.09 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . 0.474 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 1.3 mt-30 -69.95 -36.84 75.59 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 177.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -67.8 -41.26 83.41 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.609 -0.886 . . . . 10.0 108.609 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -67.58 -35.04 85.62 Favored Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 110.061 -1.215 . . . . 10.0 110.061 177.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -70.32 -38.41 74.92 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 45.8 mtt180 -64.57 -39.4 93.68 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 108.484 -0.932 . . . . 10.0 108.484 177.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . 0.463 ' O ' ' HG3' ' C' ' 491' ' ' GLU . 10.9 mm-40 -63.81 -48.65 75.98 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.801 -0.815 . . . . 10.0 108.801 177.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -64.8 -35.83 82.37 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.583 179.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 17.4 mt -68.37 -43.27 77.73 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 178.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -62.04 -40.82 97.05 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 107.496 -1.298 . . . . 10.0 107.496 178.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . 0.725 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 30.6 mt-10 -60.59 -59.63 5.09 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.448 -0.945 . . . . 10.0 108.448 177.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 80.8 mt -52.04 -50.95 60.45 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 115.52 -0.764 . . . . 10.0 112.468 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -61.57 -41.77 97.87 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.689 0.255 . . . . 10.0 111.689 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -75.05 -12.98 60.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.674 0.273 . . . . 10.0 111.429 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.868 ' HG2' HD22 ' A' ' 279' ' ' LEU . 13.5 mttm -97.09 -44.09 7.12 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 178.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 95.1 mt -71.11 -29.66 65.54 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.937 0.717 . . . . 10.0 112.937 -179.096 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 49.3 m -61.21 -60.4 10.69 Favored Pre-proline 0 CA--C 1.537 0.462 0 C-N-CA 120.422 -0.511 . . . . 10.0 111.327 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -65.0 -35.38 43.32 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 121.717 1.611 . . . . 10.0 111.074 178.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 16.2 mt -67.91 -35.35 78.31 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 116.334 -0.393 . . . . 10.0 110.461 179.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -65.43 -45.3 90.95 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.212 -1.155 . . . . 10.0 110.212 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -64.41 -42.88 95.82 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . 0.497 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 23.2 tt0 -62.31 -43.83 97.91 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.586 178.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . 0.524 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 65.8 mmm -62.29 -38.04 87.84 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.135 -0.484 . . . . 10.0 109.826 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 89.9 mtt180 -63.99 -42.46 97.19 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.45 -41.64 88.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.711 -0.677 . . . . 10.0 109.763 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.524 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 46.5 mtt180 -62.23 -43.49 98.71 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 108.586 -0.894 . . . . 10.0 108.586 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -61.53 -44.22 97.45 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.236 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' C' ' 508' ' ' ARG . 50.6 mtt180 -63.65 -42.02 98.17 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -75.9 10.91 1.59 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.192 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . 0.41 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 2.5 m-70 -128.97 -55.68 1.2 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.718 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 79.9 t -69.17 -46.41 77.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.826 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.646 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 13.6 t70 -66.81 -35.64 80.52 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 179.044 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.81 -39.2 90.67 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.052 -1.092 . . . . 10.0 108.052 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . 0.729 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 32.3 mt -68.67 -23.2 64.37 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.314 178.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . 0.646 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 68.2 mtt180 -64.68 -39.82 94.33 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.641 -0.874 . . . . 10.0 108.641 178.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -93.19 7.9 42.39 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.474 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . 0.729 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 32.3 m170 -113.74 -53.07 2.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.037 -0.528 . . . . 10.0 111.011 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 95.8 mt -77.42 -34.56 54.66 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.7 0.63 . . . . 10.0 112.7 -178.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -57.27 -57.18 26.66 Favored Pre-proline 0 CA--C 1.532 0.26 0 C-N-CA 120.52 -0.472 . . . . 10.0 110.945 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -67.48 -28.84 38.22 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 121.403 1.402 . . . . 10.0 110.628 178.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . 0.581 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 19.9 t80 -63.76 -48.38 77.22 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.004 179.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 9.1 p -71.01 -29.97 66.07 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.625 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -68.08 -44.0 77.26 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.958 -0.756 . . . . 10.0 108.958 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -66.15 -44.13 85.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.089 177.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 37.7 mt -61.64 -38.36 87.42 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 115.852 -0.613 . . . . 10.0 109.836 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -61.81 -38.99 90.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.141 -0.481 . . . . 10.0 109.911 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -67.81 -39.66 83.93 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 178.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 62.6 mtt180 -68.6 -37.2 79.6 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 178.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 75.0 mt -69.49 -34.98 75.12 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.124 -0.695 . . . . 10.0 109.124 178.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . 0.47 ' O ' ' HG2' ' C' ' 534' ' ' GLU . . . -64.04 -45.5 88.58 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 178.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.33 -40.88 98.54 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 178.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 8.2 ttm180 -60.97 -40.67 94.28 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.273 -0.876 . . . . 10.0 108.884 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 74.7 mt -68.53 -36.15 78.45 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.114 178.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . 0.483 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 5.6 mm-40 -59.38 -44.02 92.82 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 178.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -68.25 -46.56 70.13 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.356 -0.838 . . . . 10.0 109.445 178.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 58.6 mt -58.57 -30.05 66.87 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.393 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . 0.483 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 49.1 mtmt -74.89 -49.85 18.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.66 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -67.02 -49.57 64.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.861 0.362 . . . . 10.0 110.943 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . 0.44 ' HB3' ' OD1' ' A' ' 231' ' ' ASN . 88.8 m-20 -66.0 -36.6 83.74 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -67.52 -41.8 89.69 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 110.853 -0.899 . . . . 10.0 110.853 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -63.94 -37.65 94.93 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 110.215 -1.154 . . . . 10.0 110.215 178.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -67.89 -44.9 75.93 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.614 -0.884 . . . . 10.0 108.614 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . 0.505 ' HG3' ' ND2' ' A' ' 231' ' ' ASN . 34.3 mtt180 -56.77 -39.98 75.01 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 115.522 -0.763 . . . . 10.0 110.542 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' C' ' 548' ' ' HIS . 81.7 mt -62.61 -41.29 98.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.408 179.14 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -69.47 -45.08 69.86 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.457 -0.571 . . . . 10.0 109.457 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -59.84 -49.33 78.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.097 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -64.0 -39.21 93.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.985 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . 0.49 ' HB2' ' O ' ' C' ' 544' ' ' LEU . 1.7 t-80 -65.68 -42.96 90.66 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.172 0.511 . . . . 10.0 110.314 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -64.52 -51.82 60.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.616 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -33.77 74.57 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.373 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.41 -45.94 88.69 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.392 -0.595 . . . . 10.0 109.392 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 4.4 m -66.49 -38.1 86.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.726 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -68.96 -25.97 64.81 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.605 -0.725 . . . . 10.0 110.649 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . 0.466 ' HA ' ' OG1' ' C' ' 557' ' ' THR . 3.2 m-70 -87.5 -34.24 18.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.766 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 49.0 mt -63.6 -32.45 73.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.856 0.36 . . . . 10.0 110.413 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 1.1 p -76.4 -41.32 48.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.117 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . 0.649 HG22 ' HD2' ' A' ' 216' ' ' LYS . 2.1 p -73.88 -12.75 60.76 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.336 0.588 . . . . 10.0 110.853 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 28.8 mt -91.31 -39.61 11.95 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.056 -0.72 . . . . 10.0 109.056 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . 0.469 ' HA ' ' HB3' ' C' ' 562' ' ' ALA . 2.5 p -69.46 -24.88 63.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.784 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . 0.513 ' HG3' ' HD3' ' C' ' 561' ' ' LYS . 7.6 pt-20 -64.11 -19.97 65.64 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.337 0.589 . . . . 10.0 109.967 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . 0.513 ' HD3' ' HG3' ' C' ' 560' ' ' GLU . 13.2 mptt -114.53 -29.77 6.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.222 178.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . 0.469 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -73.8 -5.7 42.45 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.143 0.423 . . . . 10.0 112.143 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . 0.922 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 87.8 mttt -119.87 -70.11 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.583 0 CA-C-O 119.446 -0.312 . . . . 10.0 111.323 178.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . 0.922 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 32.4 Cg_exo -61.6 -51.72 3.83 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.08 1.853 . . . . 10.0 112.242 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -63.6 -40.73 97.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.463 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . 0.514 HD23 HD12 ' C' ' 569' ' ' LEU . 6.9 mt -63.96 -41.79 97.47 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 110.063 -0.347 . . . . 10.0 110.063 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . 0.706 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 36.9 mt-10 -63.56 -38.55 91.54 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 178.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.31 -38.77 81.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.153 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . 0.514 HD12 HD23 ' C' ' 566' ' ' LEU . 36.4 mt -62.55 -41.01 98.63 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -68.84 -30.92 69.56 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.468 -0.567 . . . . 10.0 109.468 178.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . 0.706 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.9 mt-30 -70.63 -14.42 62.47 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.337 -0.847 . . . . 20.0 110.47 178.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -98.6 -37.6 4.19 Favored Glycine 0 CA--C 1.523 0.568 0 N-CA-C 108.659 -1.776 . . . . 10.0 108.659 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 73.5 mt -56.34 -45.03 80.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.529 -0.335 . . . . 10.0 111.602 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 86.8 mt -56.97 -62.0 5.96 Favored Pre-proline 0 CA--C 1.537 0.448 0 N-CA-C 112.508 0.559 . . . . 10.0 112.508 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -61.22 -36.97 77.52 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 121.964 1.776 . . . . 10.0 111.948 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 9.6 t -64.38 -45.34 96.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.637 0.256 . . . . 10.0 110.372 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 29.8 mt -62.75 -38.0 88.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.777 0.322 . . . . 10.0 110.145 179.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . 0.426 ' O ' HG23 ' C' ' 582' ' ' VAL . 62.4 mt-10 -65.72 -48.55 71.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.176 178.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 26.9 m -63.41 -39.91 95.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.152 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -65.91 -38.31 88.37 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 178.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . 0.445 ' O ' ' HG ' ' C' ' 585' ' ' LEU . 64.6 mttt -61.73 -39.49 91.72 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.858 -0.61 . . . . 10.0 109.744 178.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . 0.426 HG23 ' O ' ' C' ' 578' ' ' GLU . 69.6 t -59.8 -48.83 86.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 108.82 -0.808 . . . . 10.0 108.82 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 12.0 m -61.47 -41.98 98.07 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.386 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -63.47 -47.37 82.08 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.082 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' C' ' 581' ' ' LYS . 80.1 mt -57.9 -46.28 85.17 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.306 -0.407 . . . . 10.0 110.406 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 14.7 m -65.33 -44.53 87.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.216 179.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -58.03 -50.5 73.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.285 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.5 mt -56.63 -44.65 81.44 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 116.185 -0.462 . . . . 10.0 110.816 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -63.61 -52.55 60.39 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.065 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . 0.431 ' HA ' ' HE2' ' C' ' 593' ' ' LYS . 55.9 mt-10 -58.78 -39.33 80.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.897 -0.592 . . . . 10.0 112.234 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -73.26 -44.13 59.87 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.001 0.371 . . . . 10.0 112.001 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 14.2 p -64.75 -27.98 69.27 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.507 0.558 . . . . 10.0 112.507 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . 0.431 ' HE2' ' HA ' ' C' ' 590' ' ' GLU . 45.0 mtmt -65.61 -33.18 75.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.894 0.378 . . . . 10.0 110.924 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 24.0 mttt -85.48 -34.85 21.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.348 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 91.3 mt -85.77 49.46 1.77 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.456 0.646 . . . . 10.0 109.604 178.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.246 0.915 0 CA-C-N 115.487 -0.778 . . . . 10.0 110.123 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 32.9 tpp . . . . . 0 C--O 1.234 0.247 0 CA-C-O 120.801 0.334 . . . . 10.0 110.284 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.69 155.19 39.23 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.165 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.708 ' HB2' ' H63' ' A' ' 16' ' ' PCW . 33.2 tt0 -115.96 125.25 52.28 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 179.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -119.05 101.01 7.71 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.027 0.441 . . . . 10.0 111.165 -179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.56 ' HE2' HN1A ' A' ' 39' ' ' 17F . 5.5 mtpp -81.95 102.71 11.1 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.305 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 21.2 mt -100.92 138.41 38.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.553 -178.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 46.0 t -112.55 126.73 69.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.794 0.33 . . . . 10.0 110.742 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.534 HG12 ' HD2' ' B' ' 16' ' ' LYS . 57.1 t -95.87 118.3 41.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.724 -0.473 . . . . 10.0 109.724 179.189 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.418 ' HB ' ' CD1' ' B' ' 96' ' ' TYR . 35.9 m -112.33 163.21 9.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.773 0.32 . . . . 10.0 110.802 -179.528 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 148.99 167.49 13.91 Favored Glycine 0 N--CA 1.447 -0.632 0 N-CA-C 111.378 -0.689 . . . . 10.0 111.378 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.59 158.32 35.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.924 0.392 . . . . 10.0 111.724 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.65 92.4 1.0 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 121.019 -0.61 . . . . 10.0 111.867 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 151.12 -10.98 0.77 Allowed Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 111.645 -0.582 . . . . 10.0 111.645 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 17.5 m -73.42 -18.91 17.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.857 0.36 . . . . 10.0 111.666 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 89.59 44.7 4.83 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.82 -0.705 . . . . 10.0 112.927 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.534 ' HD2' HG12 ' B' ' 8' ' ' VAL . 53.8 mtmt -62.26 -49.73 74.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.544 0.211 . . . . 10.0 111.226 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.0 p -62.43 -31.23 71.91 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.686 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.38 98.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.286 -0.415 . . . . 10.0 110.312 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 94.2 mt -68.37 -35.75 78.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.98 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.87 -47.42 53.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.84 0.352 . . . . 10.0 110.953 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 97.5 mt -63.93 -35.75 74.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.766 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.576 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 6.4 tp-100 -69.58 -14.83 63.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.081 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 15.0 tp -102.23 -34.81 9.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.869 0.366 . . . . 10.0 110.659 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . 0.453 HG13 ' CD2' ' B' ' 40' ' ' TYR . 49.3 mm -79.73 -64.21 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.905 -179.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.732 ' NE2' ' HA ' ' D' ' 840' ' ' VAL . 19.1 mt-30 -93.21 -13.56 28.2 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.724 -178.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 95.3 m-20 64.48 40.66 6.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.654 -179.14 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -130.65 136.2 48.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.047 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -88.21 137.61 32.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.779 0.323 . . . . 10.0 110.774 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 1.7 m -99.69 151.96 4.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.361 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . 0.479 ' HA ' " H3'" ' B' ' 201' ' ' GNP . 32.5 t70 -121.17 -21.94 6.24 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.183 0.516 . . . . 10.0 111.363 -178.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.496 ' O ' H5'2 ' B' ' 201' ' ' GNP . 2.3 pm0 -77.0 157.22 31.33 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.358 0.599 . . . . 10.0 111.243 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.51 68.23 5.68 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.035 179.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.3 134.62 70.21 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.747 -0.66 . . . . 10.0 110.753 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -80.11 -164.72 0.29 Allowed 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.857 2.371 . . . . 10.0 111.783 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -173.33 141.47 0.92 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.279 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.902 HD11 HG21 ' D' ' 809' ' ' THR . 63.8 mt -121.92 -66.56 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 108.217 -1.031 . . . . 10.0 108.217 178.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.502 ' O ' HG23 ' D' ' 821' ' ' VAL . 1.8 tm-20 -148.11 93.43 2.17 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.702 -0.851 . . . . 10.0 108.702 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . 0.623 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 52.0 m-20 -114.61 160.56 19.16 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.551 -179.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.1 p -147.28 142.83 27.59 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.715 0.293 . . . . 10.0 111.608 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . 0.661 ' CE2' HG22 ' D' ' 840' ' ' VAL . 40.7 m-85 -131.56 141.06 49.62 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.245 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . 0.635 ' HB3' ' ND2' ' D' ' 816' ' ' ASN . 0.4 OUTLIER -120.34 131.04 54.68 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.573 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 58.1 tttp -139.93 144.15 36.95 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.23 -0.441 . . . . 10.0 109.962 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -113.44 118.23 33.94 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.971 -0.381 . . . . 10.0 109.971 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -143.65 169.09 11.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.012 0.434 . . . . 10.0 111.271 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 19.1 t -107.09 112.85 41.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 179.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . 0.41 HD13 HG21 ' B' ' 160' ' ' VAL . 50.3 mt -109.92 112.37 40.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.824 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 61.27 34.52 18.59 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.304 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.88 -8.73 78.91 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.927 -0.654 . . . . 10.0 112.791 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -100.52 113.43 26.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.833 0.349 . . . . 10.0 111.267 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 5.3 t -78.83 121.28 24.61 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.489 -0.93 . . . . 10.0 108.489 178.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -140.39 166.68 24.05 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.286 0.565 . . . . 10.0 112.47 -178.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 25.5 tp -107.02 122.1 45.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.256 -0.884 . . . . 10.0 109.112 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.449 ' O ' ' HA ' ' B' ' 41' ' ' ARG . 77.7 mt -99.98 117.35 34.08 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.284 -0.416 . . . . 10.0 111.561 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.448 ' O ' ' HA ' ' B' ' 5' ' ' LYS . 4.8 t70 -104.53 89.55 3.25 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.354 -1.35 . . . . 10.0 107.354 178.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 14.8 mt -82.69 136.58 22.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.641 -0.709 . . . . 10.0 112.306 -177.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.435 HD12 ' O ' ' B' ' 38' ' ' ASP . 47.3 tp -110.3 120.89 43.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.606 -0.725 . . . . 10.0 111.124 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.623 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 6.0 t0 -99.36 96.76 7.94 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.072 -0.714 . . . . 10.0 109.072 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . 0.445 HG22 ' CE1' ' B' ' 71' ' ' TYR . 32.0 p -81.02 162.41 23.82 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.373 -0.83 . . . . 10.0 112.342 -178.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.493 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -76.51 156.47 32.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.905 178.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -84.31 -67.49 1.43 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.436 -0.888 . . . . 10.0 111.767 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -83.15 102.43 11.86 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.328 0.585 . . . . 20.0 111.257 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.418 ' OE1' ' HD2' ' B' ' 68' ' ' ARG . 0.4 OUTLIER -142.59 163.83 31.76 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.374 179.509 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -118.67 -161.46 0.84 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.698 -0.683 . . . . 10.0 109.312 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -80.44 110.27 15.74 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.982 0.42 . . . . 10.0 110.173 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 44.2 t -135.56 137.4 41.97 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.028 -0.533 . . . . 10.0 109.933 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.85 -38.46 78.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.055 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . 0.5 ' HA ' ' NE2' ' B' ' 70' ' ' GLN . 90.4 mmm -60.81 -40.74 93.87 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.407 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.676 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 56.3 ttt85 -66.58 -48.43 69.61 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.482 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.479 ' O ' ' HG3' ' B' ' 73' ' ' ARG . 0.1 OUTLIER -59.88 -32.6 70.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.582 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.5 ' NE2' ' HA ' ' B' ' 67' ' ' MET . 7.1 mt-30 -61.35 -56.3 21.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.98 -0.554 . . . . 10.0 111.523 179.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . 0.676 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 5.4 p90 -72.55 -27.83 62.46 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.436 0.902 . . . . 10.0 113.436 -178.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . 0.462 ' HB3' HG21 ' B' ' 103' ' ' VAL . 59.7 mtp -68.57 -21.27 64.54 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.939 0.348 . . . . 10.0 111.939 -179.478 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' B' ' 69' ' ' ASP . 66.9 mtt-85 -95.6 11.74 32.11 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.859 0.318 . . . . 10.0 111.859 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.3 m -113.01 18.16 18.29 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.408 0.623 . . . . 10.0 110.749 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -115.94 144.26 18.37 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.521 -0.847 . . . . 10.0 112.693 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -84.99 -67.9 0.76 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.214 -0.291 . . . . 10.0 110.214 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -105.19 152.4 17.27 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 111.149 -0.78 . . . . 10.0 111.149 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -124.75 127.46 47.26 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.116 0.484 . . . . 10.0 111.677 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.754 ' HG ' HD22 ' B' ' 159' ' ' LEU . 55.5 mt -95.33 113.43 25.1 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.883 -0.598 . . . . 10.0 110.03 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 3.2 m -87.37 86.31 7.23 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.934 -0.395 . . . . 10.0 109.934 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.462 ' HA ' ' HB ' ' B' ' 114' ' ' VAL . 28.6 t -88.31 126.3 41.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.138 0.494 . . . . 10.0 111.837 -178.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.644 ' HB3' HD11 ' B' ' 93' ' ' ILE . 29.4 p90 -133.14 157.9 44.17 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.114 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -94.16 121.71 35.94 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.471 ' CD1' ' HA ' ' B' ' 118' ' ' CYS . 12.6 pt -68.46 -11.23 14.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 112.129 0.418 . . . . 10.0 112.129 -179.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -100.97 12.06 38.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.911 0.386 . . . . 10.0 110.963 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -137.6 113.13 9.45 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.0 0.428 . . . . 10.0 110.861 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.39 -37.71 88.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.908 -0.587 . . . . 10.0 112.321 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 17.3 tptp -63.79 -30.68 71.75 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.987 0.422 . . . . 10.0 110.878 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 15.2 t -66.42 -40.37 89.5 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.791 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -65.62 -35.67 81.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.356 0.598 . . . . 10.0 110.195 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -80.93 -1.72 44.75 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.679 -0.692 . . . . 10.0 111.574 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.19 -12.1 33.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.146 0.498 . . . . 10.0 110.024 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . 0.644 HD11 ' HB3' ' B' ' 82' ' ' PHE . 43.8 mm -60.26 -42.74 91.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.398 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -64.4 -37.79 88.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.26 -0.427 . . . . 10.0 109.871 179.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -59.03 -43.83 91.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.414 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . 0.418 ' CD1' ' HB ' ' B' ' 9' ' ' VAL . 2.9 m-85 -77.6 -34.92 53.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.95 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -55.17 -50.58 68.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.406 -0.361 . . . . 10.0 111.335 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -69.46 -35.79 75.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.081 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -63.9 -48.33 77.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.658 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . 0.502 ' HA ' HG22 ' B' ' 103' ' ' VAL . 65.2 mt -66.92 -38.05 80.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.273 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.84 -37.34 78.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.097 0.475 . . . . 10.0 110.422 179.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 64.3 ttp85 -71.43 -42.9 67.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.664 -0.698 . . . . 10.0 111.918 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' B' ' 100' ' ' ILE . 28.3 m -72.83 -30.0 31.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 N-CA-C 112.288 0.477 . . . . 10.0 112.288 -179.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 19.8 mmmt -88.0 -22.29 24.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.549 0.214 . . . . 10.0 111.169 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 26.0 t0 57.84 30.32 18.87 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.725 0.774 . . . . 10.0 110.782 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 3.0 m -127.44 143.28 51.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.381 -0.827 . . . . 10.0 109.756 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -75.06 -41.64 58.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.199 0.523 . . . . 10.0 110.487 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -106.24 109.03 20.84 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.573 0.701 . . . . 10.0 110.775 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.417 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 78.5 t -118.92 131.67 24.24 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.256 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 32.9 Cg_exo -59.63 101.76 0.15 Allowed 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.718 2.279 . . . . 10.0 111.381 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . 0.565 ' HB2' HG21 ' B' ' 139' ' ' ILE . 65.8 mtt -127.16 149.67 49.86 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.154 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.518 ' HB ' HD23 ' B' ' 79' ' ' LEU . 98.0 t -132.36 122.57 48.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 12.9 tp -76.87 115.68 16.87 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.274 -0.639 . . . . 10.0 109.274 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . 0.462 ' HB ' ' HA ' ' B' ' 81' ' ' VAL . 49.3 t -110.58 112.41 40.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.04 0.448 . . . . 10.0 111.425 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -95.56 95.51 1.85 Allowed Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.319 -1.112 . . . . 10.0 110.319 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -85.18 163.48 18.69 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -178.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . 0.51 ' HB3' HD12 ' B' ' 120' ' ' LEU . 92.5 mttt 72.13 33.19 1.62 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 115.38 -0.827 . . . . 10.0 112.208 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . 0.471 ' HA ' ' CD1' ' B' ' 84' ' ' ILE . 20.4 p -67.31 -17.0 64.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.761 0.315 . . . . 10.0 111.723 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -84.07 -8.93 58.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.464 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.51 HD12 ' HB3' ' B' ' 117' ' ' LYS . 34.2 mt -84.7 124.65 72.77 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 120.762 0.315 . . . . 10.0 111.429 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -75.77 42.67 0.97 Allowed 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.111 2.541 . . . . 10.0 112.248 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 26.7 m -134.75 30.49 3.42 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.899 -0.778 . . . . 10.0 108.899 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 40.8 ttm-85 -57.63 108.93 0.62 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.379 -0.828 . . . . 10.0 111.989 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 2.5 m -98.87 -27.6 13.84 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.635 -0.711 . . . . 10.0 109.151 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 40.4 t -106.96 114.24 45.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.187 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -76.98 154.36 33.62 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.34 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . 0.554 HG23 ' HE2' ' B' ' 141' ' ' PHE . 3.8 m -55.7 -41.06 73.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.921 -0.581 . . . . 10.0 111.517 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 11.0 ttpp -62.21 -45.11 94.81 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.803 0.335 . . . . 10.0 110.973 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -56.91 -46.8 81.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.583 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.77 -40.42 84.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.477 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -63.9 -40.44 96.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.524 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -60.7 -42.31 96.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.094 0.474 . . . . 10.0 110.44 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 42.0 tp -68.39 -44.68 74.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.415 179.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.58 -45.35 92.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.218 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -61.8 -36.01 79.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.255 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 22.9 m -67.66 -25.57 65.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.47 -179.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -95.29 -6.01 42.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.453 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 72.59 31.49 62.86 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.865 -0.684 . . . . 10.0 111.75 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . 0.565 HG21 ' HB2' ' B' ' 111' ' ' MET . 49.5 pt -126.25 153.05 74.48 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 110.295 -0.261 . . . . 10.0 110.295 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -81.14 158.05 20.26 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.586 2.191 . . . . 10.0 112.389 179.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.554 ' HE2' HG23 ' B' ' 127' ' ' THR . 45.0 t80 -122.8 129.51 51.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.535 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 32.3 mm -128.03 124.42 62.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.418 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -85.15 124.76 32.19 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.669 -0.863 . . . . 10.0 108.669 178.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 82.6 p -128.55 171.5 12.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.792 0.805 . . . . 10.0 112.974 -177.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 7.9 t -154.06 121.12 5.67 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.659 -1.155 . . . . 10.0 108.043 178.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.97 -17.79 62.64 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.864 0.364 . . . . 10.0 111.01 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 29.8 ttmt -81.55 -48.28 12.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.16 -0.473 . . . . 10.0 111.526 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 24.4 p -90.42 -12.8 36.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.802 0.334 . . . . 10.0 111.532 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . 0.576 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 40.2 ttt-85 70.04 20.22 6.56 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.694 -0.684 . . . . 10.0 111.531 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -75.7 131.93 40.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.604 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.9 -13.0 5.74 Favored Glycine 0 C--O 1.225 -0.436 0 N-CA-C 114.934 0.734 . . . . 10.0 114.934 177.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 59.7 t -53.55 -56.88 6.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -178.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -45.69 93.03 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.926 -179.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -66.62 -32.67 74.15 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.918 0.71 . . . . 10.0 112.918 -178.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.8 -46.52 84.52 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.074 0.464 . . . . 10.0 110.481 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -68.53 -37.41 79.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.713 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 21.4 m-30 -61.86 -45.3 94.36 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.315 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.519 ' HA ' ' HE ' ' B' ' 161' ' ' ARG . 12.2 m -61.71 -38.17 86.89 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.901 -0.591 . . . . 10.0 111.004 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.754 HD22 ' HG ' ' B' ' 79' ' ' LEU . 21.5 tp -61.53 -43.58 98.61 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . 0.41 HG21 HD13 ' B' ' 46' ' ' ILE . 67.0 t -65.7 -39.06 83.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.115 -0.493 . . . . 10.0 109.809 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . 0.519 ' HE ' ' HA ' ' B' ' 158' ' ' THR . 41.5 mtm-85 -61.6 -41.38 97.36 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.938 -0.574 . . . . 10.0 109.987 178.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -63.0 -40.5 97.97 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.202 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . 0.414 HG13 ' O ' ' B' ' 159' ' ' LEU . 93.1 mt -62.78 -42.07 94.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.444 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . 0.431 HH11 ' HD2' ' B' ' 164' ' ' ARG . 59.1 mtt180 -57.17 -52.23 66.16 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.783 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt -61.07 -39.38 89.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.666 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 -65.07 -36.92 85.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.009 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 7.8 mttt -73.63 -35.1 65.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.933 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 67.2 tt0 -69.15 -33.84 74.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.306 0.574 . . . . 10.0 109.574 179.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 16.2 tttp -64.59 -33.35 75.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.506 -0.77 . . . . 10.0 110.49 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 23.2 ttp -62.48 -25.42 67.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.704 -0.68 . . . . 10.0 112.067 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . 0.411 ' OG ' ' H61' ' A' ' 7' ' ' PCW . 39.0 m -79.95 -12.63 59.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.018 0.437 . . . . 10.0 111.299 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . 0.436 ' HB3' ' O4 ' ' A' ' 38' ' ' 17F . 29.5 mtpp -110.26 -53.36 2.69 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.281 0.562 . . . . 10.0 109.98 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -99.76 76.4 1.97 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.635 -0.711 . . . . 10.0 109.662 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . -63.13 -72.04 0.73 Allowed Glycine 0 N--CA 1.447 -0.602 0 CA-C-N 115.295 -0.866 . . . . 10.0 112.196 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -172.37 117.67 0.36 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.915 0.388 . . . . 10.0 110.775 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -111.5 112.03 23.48 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.674 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . 0.46 ' NZ ' ' N1 ' ' A' ' 40' ' ' 17F . 9.8 ptmm? -111.4 -179.67 3.78 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.925 -0.579 . . . . 10.0 109.915 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -63.54 128.18 34.67 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.643 -0.503 . . . . 10.0 109.643 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 15.0 ptpt -153.53 174.16 14.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.679 -0.237 . . . . 10.0 111.195 -179.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? 74.67 -49.0 0.66 Allowed 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.927 0.767 . . . . 10.0 112.805 179.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 62.9 m -118.62 126.53 52.15 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 110.029 -0.36 . . . . 10.0 110.029 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . 0.763 ' NZ ' HN1A ' A' ' 36' ' ' 17F . 28.8 mmtm -91.11 -29.48 17.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.416 -179.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 1.3 m 61.35 60.0 1.8 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.034 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 10.7 mmtp 57.8 72.69 0.5 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.484 -0.78 . . . . 10.0 111.472 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . 0.442 ' O ' ' H72' ' A' ' 12' ' ' PCW . 2.1 p . . . . . 0 C--N 1.324 -0.526 0 CA-C-N 115.541 -0.754 . . . . 10.0 111.729 -179.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.595 0 N-CA-C 112.084 -0.406 . . . . 10.0 112.084 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' D' D ' 809' ' ' THR . . . . . 0.902 HG21 HD11 ' B' ' 36' ' ' ILE . 0.2 OUTLIER -137.2 134.2 36.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.686 0.279 . . . . 10.0 111.024 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' D' D ' 810' ' ' VAL . . . . . 0.601 HG23 HG22 ' D' ' 824' ' ' VAL . 75.3 t -106.14 133.4 50.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.122 -179.122 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 26.0 ttmt -87.27 110.31 20.11 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.419 -0.586 . . . . 10.0 109.419 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 57.5 t -99.2 125.4 52.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 120.894 0.378 . . . . 10.0 110.418 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -96.24 142.4 28.44 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.808 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 56.1 mt -107.96 150.09 39.91 Favored Pre-proline 0 C--N 1.318 -0.8 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.07 -179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -61.78 -16.87 51.72 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 123.178 2.585 . . . . 10.0 112.273 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 816' ' ' ASN . . . . . 0.635 ' ND2' ' HB3' ' B' ' 41' ' ' ARG . 4.0 t30 -85.84 34.94 0.61 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.984 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 817' ' ' LYS . . . . . 0.605 ' HB2' ' NH1' ' B' ' 41' ' ' ARG . 5.0 mtpm? 52.43 38.25 24.83 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.124 -0.944 . . . . 10.0 112.161 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 818' ' ' GLN . . . . . 0.465 HE22 ' C ' ' B' ' 40' ' ' TYR . 72.0 mt-30 -135.73 -170.5 2.63 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 112.838 0.681 . . . . 10.0 112.838 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.36 168.4 26.75 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.336 0.589 . . . . 10.0 112.148 -178.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 14.1 t -152.38 139.15 18.87 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 107.301 -1.37 . . . . 10.0 107.301 178.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 821' ' ' VAL . . . . . 0.595 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 2.9 t -108.05 114.53 46.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 C-N-CA 120.147 -0.621 . . . . 10.0 112.02 -178.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 3.7 t -110.29 148.33 13.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.939 -178.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.89 146.94 37.33 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.78 0.324 . . . . 10.0 111.564 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 824' ' ' VAL . . . . . 0.601 HG22 HG23 ' D' ' 810' ' ' VAL . 47.7 t -84.68 96.39 4.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.069 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 825' ' ' ARG . . . . . 0.444 ' HB2' ' SD ' ' D' ' 828' ' ' MET . 15.3 mtp85 -99.65 103.46 15.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.52 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -59.3 123.62 17.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.952 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 128.03 -41.67 1.55 Allowed Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 115.665 -0.698 . . . . 10.0 112.041 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 828' ' ' MET . . . . . 0.444 ' SD ' ' HB2' ' D' ' 825' ' ' ARG . 12.7 ptm -81.86 154.89 25.63 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.916 0.389 . . . . 10.0 110.854 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 829' ' ' SER . . . . . 0.474 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 2.1 m -96.72 168.9 10.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.203 -0.453 . . . . 10.0 111.334 -179.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 830' ' ' VAL . . . . . 0.477 ' O ' ' HB2' ' D' ' 834' ' ' LEU . 69.7 t -54.86 -42.53 63.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.714 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 831' ' ' TYR . . . . . 0.515 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 36.6 t80 -55.89 -33.07 64.29 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.365 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -73.73 -59.35 2.76 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.367 0.506 . . . . 10.0 112.367 -178.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.99 -39.17 93.51 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 -179.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 834' ' ' LEU . . . . . 0.665 ' HG ' HG21 ' D' ' 850' ' ' VAL . 4.0 mm? -75.47 -14.9 60.46 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.429 0.529 . . . . 10.0 112.429 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 835' ' ' ASP . . . . . 0.523 ' O ' ' HG2' ' D' ' 839' ' ' LYS . 12.8 t70 -60.15 -49.52 77.31 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 7.6 mmmm -63.65 -32.5 74.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.449 -0.796 . . . . 10.0 111.046 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 837' ' ' ALA . . . . . 0.582 ' O ' HG12 ' D' ' 840' ' ' VAL . . . -70.02 -28.49 65.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.139 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 838' ' ' LEU . . . . . 0.513 HD12 ' HG3' ' D' ' 845' ' ' GLN . 91.6 mt -87.83 -39.33 14.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.549 179.125 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 839' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' D' ' 835' ' ' ASP . 30.9 mmtp -64.99 -31.88 73.33 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.404 179.046 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 840' ' ' VAL . . . . . 0.732 ' HA ' ' NE2' ' B' ' 25' ' ' GLN . 2.0 p -58.33 -24.95 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-O 121.426 0.632 . . . . 10.0 111.441 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 841' ' ' ARG . . . . . 0.484 ' O ' ' H82' ' A' ' 15' ' ' PCW . 3.7 mmp_? -100.78 -37.89 8.51 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.314 -0.857 . . . . 10.0 110.154 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 117.01 20.29 4.92 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 111.085 -0.806 . . . . 10.0 111.085 -178.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 59.1 mt -105.32 179.74 4.18 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.775 0.322 . . . . 10.0 110.346 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -140.7 164.47 30.11 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.651 -0.5 . . . . 10.0 109.651 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 845' ' ' GLN . . . . . 0.513 ' HG3' HD12 ' D' ' 838' ' ' LEU . 22.4 mp0 -72.86 64.87 0.7 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.087 0.47 . . . . 10.0 111.2 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -123.0 -78.13 0.6 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.614 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -92.47 14.27 17.2 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.324 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 14.8 m -111.13 143.74 41.37 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.29 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 7.1 p -138.14 143.56 32.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.383 -0.371 . . . . 10.0 110.489 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 850' ' ' VAL . . . . . 0.665 HG21 ' HG ' ' D' ' 834' ' ' LEU . 18.8 t -97.13 124.31 49.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.967 0.413 . . . . 10.0 111.618 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 851' ' ' TYR . . . . . 0.673 ' HD2' ' HB3' ' D' ' 858' ' ' LYS . 4.4 m-30 -101.96 130.61 48.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.111 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 852' ' ' ARG . . . . . 0.515 ' HG3' ' HB ' ' D' ' 861' ' ' THR . 20.0 mtm180 -96.79 146.54 24.81 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.719 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 853' ' ' LEU . . . . . 0.479 HD12 ' HB2' ' D' ' 874' ' ' GLU . 13.4 mt -90.26 89.33 7.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.103 -0.499 . . . . 10.0 111.876 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 73.5 mt -105.47 106.25 20.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 178.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt 63.35 21.56 12.86 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.161 0.505 . . . . 10.0 110.706 -178.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 93.61 -22.03 37.78 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.571 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 857' ' ' ARG . . . . . . . . . . . . . 44.2 ttt-85 -81.25 122.45 27.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.718 0.294 . . . . 10.0 111.057 -179.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 858' ' ' LYS . . . . . 0.673 ' HB3' ' HD2' ' D' ' 851' ' ' TYR . 87.9 mttt -65.22 118.65 9.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.07 179.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 7.2 m -119.76 134.78 55.11 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.433 -0.349 . . . . 10.0 111.26 -179.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 17.4 t -71.03 137.17 24.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.833 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 861' ' ' THR . . . . . 0.515 ' HB ' ' HG3' ' D' ' 852' ' ' ARG . 3.0 t -127.1 164.71 20.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.091 179.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -90.84 159.13 16.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.756 0.312 . . . . 10.0 110.913 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 863' ' ' TRP . . . . . 0.515 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 96.5 m95 -79.53 -23.31 42.98 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.053 0.454 . . . . 10.0 110.801 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -79.75 -13.72 59.24 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.61 -179.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 865' ' ' THR . . . . . 0.408 ' O ' HG23 ' D' ' 830' ' ' VAL . 3.8 m -63.49 139.92 58.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.488 -0.324 . . . . 10.0 110.851 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 866' ' ' ALA . . . . . 0.474 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -74.94 147.42 40.91 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.293 -0.262 . . . . 10.0 110.293 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 867' ' ' ILE . . . . . 0.447 HD12 ' HG ' ' D' ' 870' ' ' LEU . 5.2 tp -83.75 4.87 2.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.912 0.387 . . . . 10.0 111.599 -179.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 868' ' ' ALA . . . . . 0.555 ' HB3' ' HD3' ' D' ' 869' ' ' PRO . . . -56.0 -58.01 18.7 Favored Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 113.595 0.961 . . . . 10.0 113.595 -179.112 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 869' ' ' PRO . . . . . 0.555 ' HD3' ' HB3' ' D' ' 868' ' ' ALA . 67.9 Cg_endo -86.56 33.95 0.45 Allowed 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.115 1.877 . . . . 10.0 112.597 -179.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 870' ' ' LEU . . . . . 0.447 ' HG ' HD12 ' D' ' 867' ' ' ILE . 3.1 mm? -105.07 -5.4 20.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.943 0.401 . . . . 10.0 111.724 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -70.48 131.97 44.84 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.762 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 103.51 -0.5 46.26 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.527 -0.844 . . . . 10.0 113.542 179.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -136.83 173.75 11.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.449 0.625 . . . . 10.0 111.733 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 874' ' ' GLU . . . . . 0.479 ' HB2' HD12 ' D' ' 853' ' ' LEU . 69.6 mt-10 -109.9 162.18 14.75 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.066 -0.516 . . . . 10.0 109.973 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 96.7 mt -131.13 119.5 22.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.43 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 876' ' ' ILE . . . . . 0.635 HD13 ' HE2' ' D' ' 858' ' ' LYS . 3.0 mp -106.65 124.61 62.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 877' ' ' VAL . . . . . 0.434 HG11 HD21 ' D' ' 838' ' ' LEU . 39.0 t -93.02 120.04 41.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 120.895 0.378 . . . . 10.0 110.828 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -106.48 153.73 21.87 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 94.7 t -118.37 118.68 58.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.834 -0.432 . . . . 10.0 109.834 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 37.9 mt . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.406 -0.806 . . . . 10.0 110.246 -179.488 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PCW . . . . . 0.871 ' H41' ' H1 ' ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PCW . . . . . 0.796 H341 H152 ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PCW . . . . . 0.839 ' H11' ' H11' ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PCW . . . . . 0.776 H332 ' H31' ' A' ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PCW . . . . . 0.796 H152 H341 ' A' ' 2' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PCW . . . . . 0.562 H142 H421 ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PCW . . . . . 0.776 ' H31' H332 ' A' ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PCW . . . . . 0.55 ' H72' ' O2P' ' A' ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PCW . . . . . 0.559 ' H73' ' O2P' ' A' ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PCW . . . . . 0.915 H131 H351 ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PCW . . . . . 0.639 ' O31' ' H71' ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PCW . . . . . 0.908 ' H73' HN1A ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PCW . . . . . 0.668 H283 H352 ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PCW . . . . . 0.5 H341 ' H72' ' A' ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PCW . . . . . 0.484 ' H82' ' O ' ' D' ' 841' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PCW . . . . . 0.708 ' H63' ' HB2' ' B' ' 3' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PCW . . . . . 0.599 H321 ' H12' ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PCW . . . . . 0.839 ' H11' ' H11' ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PCW . . . . . 0.435 ' H2 ' ' H61' ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PCW . . . . . 0.534 ' P ' HG12 ' D' ' 876' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PCW . . . . . 0.638 H341 H352 ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PCW . . . . . 0.915 H351 H131 ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PCW . . . . . 0.427 H332 ' H52' ' A' ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PCW . . . . . 0.55 H221 H212 ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PCW . . . . . 0.488 H342 H172 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PCW . . . . . 0.783 H321 ' H19' ' A' ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PCW . . . . . 0.724 ' H41' ' O2 ' ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PCW . . . . . 0.587 ' O2P' ' H61' ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PCW . . . . . 0.905 H152 H362 ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PCW . . . . . 0.43 H232 ' H20' ' A' ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PCW . . . . . 0.581 H342 H12A ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' 17F . . . . . 0.662 ' H9 ' H321 ' A' ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' 17F . . . . . 0.688 HN1A ' H2 ' ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' 17F . . . . . 0.871 ' H1 ' ' H41' ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' 17F . . . . . 0.763 HN1A ' NZ ' ' B' ' 182' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' 17F . . . . . 0.908 HN1A ' H73' ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' 17F . . . . . 0.79 H18A H122 ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' 17F . . . . . 0.56 HN1A ' HE2' ' B' ' 5' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' 17F . . . . . 0.783 ' H19' H321 ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PCW . . . . . 0.617 H231 H232 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PCW . . . . . 0.564 H252 H131 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PCW . . . . . 0.51 ' O2P' ' H51' ' A' ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PCW . . . . . 0.605 H432 ' H40' ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PCW . . . . . 0.51 ' H51' ' O2P' ' A' ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PCW . . . . . 0.508 H352 H371 ' A' ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PCW . . . . . 0.661 H241 H11A ' A' ' 76' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PCW . . . . . 0.665 H421 ' H58' ' A' ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PCW . . . . . 0.616 H441 ' H59' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PCW . . . . . 0.755 H432 ' H46' ' A' ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PCW . . . . . 0.551 ' O2P' ' H71' ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PCW . . . . . 0.468 ' O1P' ' H32' ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PCW . . . . . 0.716 H352 H122 ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PCW . . . . . 0.75 ' H63' ' H11' ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PCW . . . . . 0.522 H382 H431 ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PCW . . . . . 0.567 H412 H241 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PCW . . . . . 0.522 H331 H171 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PCW . . . . . 0.572 H372 H181 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' PCW . . . . . 0.601 H411 H162 ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PCW . . . . . 0.617 H232 H231 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PCW . . . . . 0.538 H272 H341 ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PCW . . . . . 0.532 H172 H152 ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PCW . . . . . 0.75 ' H11' ' H63' ' A' ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PCW . . . . . 0.499 H251 H483 ' A' ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PCW . . . . . 0.631 ' H20' ' H62' ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PCW . . . . . 0.831 ' H83' ' H37' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PCW . . . . . 0.404 ' H32' H142 ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PCW . . . . . 0.592 H411 H351 ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PCW . . . . . 0.501 H231 H172 ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PCW . . . . . 0.786 H132 H181 ' A' ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PCW . . . . . 0.716 H122 H352 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' 17F . . . . . 0.528 ' H39' ' HZ ' ' C' ' 459' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' 17F . . . . . 1.026 ' H4 ' ' HN1' ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' 17F . . . . . 0.452 ' H64' ' H42' ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' 17F . . . . . 0.661 H11A H241 ' A' ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' 17F . . . . . 0.591 HN1A ' C5 ' ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' 17F . . . . . 0.831 ' H37' ' H83' ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' 17F . . . . . 0.531 ' H54' ' H10' ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' 17F . . . . . 0.665 ' H58' H421 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 201' ' ' GNP . . . . . 0.496 H5'2 ' O ' ' B' ' 31' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 73.7 mt . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.994 0.426 . . . . 10.0 110.566 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 55.2 mmtt -59.64 -42.12 92.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.67 -0.695 . . . . 10.0 110.984 -179.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 96.9 mt -64.35 -33.38 75.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.625 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 39.8 mt -66.6 -46.26 76.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.1 0.476 . . . . 10.0 110.033 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -67.93 -39.61 83.45 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.414 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -65.46 -39.21 91.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.729 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 15.7 m95 -73.92 -21.49 60.03 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.357 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -60.85 -44.02 97.56 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -66.54 -38.06 86.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.297 -0.865 . . . . 10.0 110.179 179.477 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 60.2 t -67.68 -46.72 82.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.291 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 24.4 m -59.29 -48.14 82.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.702 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.4 p -60.09 -40.78 90.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.841 0.353 . . . . 10.0 110.725 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . 0.417 ' O ' ' HG ' ' A' ' 217' ' ' LEU . 22.9 m -66.32 -41.43 89.7 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 178.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.4 -40.96 98.19 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 65.0 m -63.18 -41.04 99.15 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.804 -0.635 . . . . 10.0 109.825 178.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . 0.478 ' HA ' ' HD3' ' A' ' 216' ' ' LYS . 62.4 mmtt -67.27 -35.0 78.6 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.32 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . 0.425 ' O ' ' HG ' ' A' ' 221' ' ' LEU . 80.6 mt -63.19 -44.36 95.58 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -68.0 -36.99 80.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.608 179.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -61.86 -38.45 88.32 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.863 178.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -80.46 -28.86 37.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.347 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 16.7 mt -58.55 -34.14 70.69 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 116.565 -0.288 . . . . 10.0 111.106 179.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -54.93 -69.49 1.25 Allowed Glycine 0 C--N 1.332 0.308 0 N-CA-C 110.992 -0.843 . . . . 10.0 110.992 178.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -57.68 -42.08 63.86 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.52 2.147 . . . . 10.0 111.275 177.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 14.0 t -53.31 -52.12 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 O-C-N 123.015 0.197 . . . . 10.0 111.296 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 18.8 p -64.71 -39.86 94.37 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.812 -0.355 . . . . 10.0 110.719 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -62.11 -50.05 73.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.724 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -64.42 -35.95 82.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.022 -0.536 . . . . 10.0 109.955 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 2.5 m-30 -66.73 -46.43 75.48 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.44 -0.578 . . . . 10.0 109.44 178.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 6.5 m95 -63.74 -40.67 97.3 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -55.12 -50.41 69.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.109 0.481 . . . . 10.0 109.705 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . 0.799 ' HA ' ' HE2' ' A' ' 234' ' ' LYS . 58.5 m-80 -68.71 -40.59 79.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.668 -0.697 . . . . 10.0 110.891 179.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 49.5 mt -63.92 -36.57 84.37 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.298 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -65.74 -43.62 88.45 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 109.977 -0.379 . . . . 10.0 109.977 178.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . 0.799 ' HE2' ' HA ' ' A' ' 231' ' ' ASN . 38.8 mtmt -66.97 -33.09 74.81 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.546 -0.909 . . . . 10.0 108.546 178.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.61 -52.7 50.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.091 -0.959 . . . . 10.0 109.64 178.54 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 3.1 p -65.67 -34.01 77.21 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.637 -0.256 . . . . 10.0 110.784 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -61.85 -49.64 75.46 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.775 -0.824 . . . . 10.0 108.775 178.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -66.69 -45.81 81.09 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 110.679 -0.968 . . . . 10.0 110.679 178.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 26.0 mt -56.94 -44.51 82.59 Favored 'General case' 0 C--O 1.22 -0.491 0 C-N-CA 122.411 0.284 . . . . 10.0 111.723 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 240' ' ' ARG . 45.4 mtt85 -72.43 -38.45 68.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.545 0.212 . . . . 10.0 111.364 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -65.12 -24.05 67.31 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.151 -0.685 . . . . 10.0 109.151 178.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . 0.541 ' OE1' ' HA ' ' C' ' 528' ' ' ARG . 8.3 mt-10 -89.83 -43.49 10.6 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.043 -0.98 . . . . 10.0 110.053 178.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . 0.612 ' HA ' ' HB2' ' A' ' 246' ' ' ASP . 75.4 mmm -59.38 -30.58 68.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.834 0.35 . . . . 10.0 111.114 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . 0.635 ' O ' ' HB2' ' A' ' 248' ' ' GLU . 1.4 p -66.05 -32.83 74.53 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 178.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 249' ' ' GLU . 42.1 mmtt -81.82 -43.69 17.94 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 108.695 -0.854 . . . . 10.0 108.695 178.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . 0.612 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.3 OUTLIER -52.47 -59.09 4.85 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.464 178.868 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 71.8 mt -65.19 -33.23 75.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.617 -0.719 . . . . 10.0 111.42 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . 0.635 ' HB2' ' O ' ' A' ' 244' ' ' SER . 28.3 tt0 -60.57 -54.78 41.27 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.924 -0.399 . . . . 10.0 109.924 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 245' ' ' LYS . 44.3 mt-10 -67.46 -37.82 83.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.511 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . 0.611 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 25.2 t -65.2 -46.41 90.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.618 -0.265 . . . . 10.0 111.246 179.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.428 ' O ' HG12 ' A' ' 254' ' ' VAL . 97.7 mttt -71.67 -42.25 67.71 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.708 0.262 . . . . 10.0 111.708 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -65.19 -35.25 80.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.845 0.355 . . . . 10.0 110.658 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -88.33 -21.95 24.11 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.678 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.611 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -60.33 -27.83 40.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.743 0.306 . . . . 10.0 110.765 179.72 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -64.62 -63.9 3.25 Favored Pre-proline 0 N--CA 1.452 -0.337 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.587 178.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.29 -32.38 72.98 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 121.821 1.681 . . . . 10.0 111.841 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 5.8 m-30 -63.87 -51.12 66.05 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.769 0.319 . . . . 10.0 110.445 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 59.2 mt -73.87 -34.66 64.55 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.032 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . 0.411 ' HA ' HE21 ' A' ' 262' ' ' GLN . 32.3 t70 -64.06 -48.07 77.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.805 0.336 . . . . 10.0 110.737 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . 0.488 ' O ' ' HE2' ' A' ' 264' ' ' LYS . 38.3 t70 -60.72 -44.45 96.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.069 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -69.09 -34.8 75.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.649 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . 0.429 HE21 ' HB3' ' A' ' 262' ' ' GLN . 2.4 tt0 -63.57 -45.74 89.07 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 178.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . 0.519 ' O ' ' HG3' ' A' ' 267' ' ' GLU . 21.6 mttt -63.87 -42.66 97.45 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.044 -0.725 . . . . 10.0 109.044 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.526 ' HD2' ' HB1' ' C' ' 509' ' ' ALA . 0.1 OUTLIER -60.28 -48.7 80.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.438 178.565 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 1.6 m95 -60.75 -37.72 82.78 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.434 179.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -63.19 -50.41 70.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.86 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 13.0 mt-10 -62.25 -43.22 99.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 179.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . 0.455 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 26.6 mt-10 -60.74 -48.81 80.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.111 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 67.1 mmm -68.12 -40.48 82.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.499 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -62.69 -49.44 75.09 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.175 -0.305 . . . . 10.0 110.175 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 71.4 mt -64.73 -34.51 78.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.393 -0.595 . . . . 10.0 109.393 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . 0.427 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 11.9 t80 -64.5 -50.86 65.75 Favored 'General case' 0 C--O 1.217 -0.649 0 CA-C-N 115.495 -0.775 . . . . 10.0 109.753 178.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 273' ' ' ARG . 58.0 mtt180 -62.57 -42.35 99.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.926 0.393 . . . . 10.0 110.492 179.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -59.76 -25.44 64.89 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.956 -179.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.728 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 73.0 mttt -100.83 -36.45 9.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.435 179.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . 0.421 HG22 H231 ' A' ' 3' ' ' PCW . 3.0 t -51.92 -44.86 38.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 122.394 0.278 . . . . 10.0 111.17 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -60.37 -61.97 6.88 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 112.519 0.563 . . . . 10.0 112.519 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . 0.467 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 14.0 Cg_endo -59.53 -38.63 81.66 Favored 'Trans proline' 0 C--N 1.356 0.973 0 C-N-CA 121.886 1.724 . . . . 10.0 111.954 178.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.869 HD22 ' HG2' ' C' ' 495' ' ' LYS . 44.0 mt -65.66 -32.15 73.56 Favored 'General case' 0 N--CA 1.46 0.07 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . 0.474 HH21 ' C19' ' A' ' 3' ' ' PCW . 54.6 mtt180 -72.07 -33.92 68.3 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 177.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.22 -39.51 89.64 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 178.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 83.4 mt-10 -65.0 -45.88 83.75 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 108.78 -0.822 . . . . 10.0 108.78 178.046 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 47.8 mt -63.5 -37.82 88.76 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 115.364 -0.835 . . . . 10.0 109.946 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -66.41 -56.46 10.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.48 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -59.03 -46.21 88.79 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.737 -0.468 . . . . 10.0 109.737 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -59.72 -49.94 73.12 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 111.336 -0.706 . . . . 10.0 111.336 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.12 -40.51 94.05 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 110.596 -0.15 . . . . 10.0 110.596 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . 0.431 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 90.0 mtt180 -61.36 -42.18 98.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.57 -0.286 . . . . 10.0 110.233 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -64.9 -51.14 63.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.31 0.576 . . . . 10.0 109.656 178.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 50.9 mttt -60.2 -46.41 89.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.195 -0.912 . . . . 10.0 110.957 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 19.9 mt -67.05 -39.81 86.99 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.954 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . 0.431 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 20.2 t-160 -58.12 -46.55 85.4 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 297' ' ' LYS . 0.2 OUTLIER -65.3 -45.67 83.44 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.86 179.367 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . 0.435 ' O ' ' HG ' ' A' ' 298' ' ' LEU . 88.8 mt -64.5 -42.64 95.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.43 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -63.47 -42.5 98.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.7 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -77.8 -6.72 55.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.025 0.44 . . . . 10.0 110.932 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 293' ' ' GLU . 14.1 tptt -94.28 -37.04 11.71 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.19 -1.041 . . . . 10.0 108.19 177.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 294' ' ' LEU . 79.8 mt -62.93 -24.49 67.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.381 -0.827 . . . . 10.0 111.48 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . 0.522 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 0.7 OUTLIER -68.79 -65.12 1.4 Allowed Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 121.193 -0.203 . . . . 10.0 111.444 179.232 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . 0.522 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 30.8 Cg_endo -64.56 -42.86 14.95 Favored 'Trans proline' 0 C--N 1.358 1.047 0 C-N-CA 122.13 1.887 . . . . 10.0 111.894 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.813 HD22 ' HE2' ' C' ' 473' ' ' LYS . 45.0 mt -66.5 -29.98 70.21 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 179.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -72.73 -39.58 55.11 Favored Glycine 0 N--CA 1.445 -0.73 0 N-CA-C 110.265 -1.134 . . . . 10.0 110.265 178.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -61.27 -41.57 97.15 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.525 -0.917 . . . . 10.0 108.525 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' ' 308' ' ' ARG . 96.9 mt-10 -62.15 -49.38 76.06 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.27 -0.877 . . . . 10.0 108.905 178.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -59.22 -41.12 87.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.052 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 -62.62 -48.75 78.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.768 0.318 . . . . 10.0 110.332 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.35 -39.82 89.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.003 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . 1.25 ' HG3' ' CD1' ' C' ' 469' ' ' LEU . 2.4 mmt85 -66.9 -37.91 85.27 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.773 -0.455 . . . . 10.0 109.773 178.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -67.89 -36.78 80.84 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.376 -0.972 . . . . 10.0 108.376 177.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' A' ' 310' ' ' ARG . 36.0 ttm180 -61.67 -50.49 72.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.352 -0.84 . . . . 10.0 108.896 178.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.08 -41.12 95.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.146 0.498 . . . . 10.0 109.684 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . 0.416 ' HA ' ' HD3' ' C' ' 462' ' ' LYS . 0.8 OUTLIER -57.65 -56.21 24.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.487 179.314 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 83.6 t -69.68 -42.24 80.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.475 -0.784 . . . . 10.0 112.306 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . 0.563 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 0.5 OUTLIER -64.26 -43.2 95.58 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.518 -0.473 . . . . 10.0 111.493 -179.655 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 319' ' ' HIS . . . -65.06 -32.37 74.05 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.491 -0.929 . . . . 10.0 108.491 178.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 12.8 mt -70.5 -32.52 70.05 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.3 -0.864 . . . . 10.0 109.566 178.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.563 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 95.3 mtt180 -64.69 -52.07 59.14 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 178.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.74 -11.31 58.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.829 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . 0.424 ' HB2' ' O ' ' A' ' 315' ' ' ALA . 0.1 OUTLIER -96.69 -47.47 5.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.975 178.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . 0.465 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 81.4 mt -67.71 -31.57 71.6 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.242 -0.436 . . . . 10.0 112.055 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . 0.409 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -55.86 -60.16 9.51 Favored Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 121.29 -0.164 . . . . 10.0 111.293 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.409 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 42.5 Cg_endo -70.06 -30.86 20.23 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 121.492 1.461 . . . . 10.0 110.69 178.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . 0.465 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 3.7 m-30 -63.19 -43.03 99.37 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 116.544 -0.298 . . . . 10.0 111.379 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . 0.505 ' HA ' HD12 ' A' ' 327' ' ' LEU . 13.6 p -69.88 -30.83 68.38 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.087 -0.708 . . . . 10.0 109.087 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -68.5 -39.27 81.34 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.642 -0.873 . . . . 10.0 108.642 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 74.4 mt-10 -67.17 -36.29 81.48 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 107.859 -1.163 . . . . 10.0 107.859 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . 0.522 ' HA ' ' HG2' ' A' ' 330' ' ' ARG . 70.0 mt -61.82 -38.08 86.82 Favored 'General case' 0 C--O 1.222 -0.361 0 N-CA-C 108.681 -0.859 . . . . 10.0 108.681 178.02 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 328' ' ' ARG . 48.6 mtt180 -67.63 -33.28 74.65 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -67.17 -53.67 28.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.763 -0.653 . . . . 10.0 109.455 178.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . 0.539 ' O ' ' HG2' ' A' ' 334' ' ' ARG . 7.7 ptp180 -63.98 -39.46 94.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.915 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 19.0 mt -61.6 -43.55 98.65 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 178.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.82 -47.47 84.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.674 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.58 -47.37 85.84 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.348 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . 0.566 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 8.1 mmt180 -61.69 -44.67 96.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.336 179.273 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 63.5 mt -65.57 -44.05 87.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.775 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -61.5 -37.04 82.22 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.044 0.45 . . . . 10.0 110.354 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -74.53 -43.31 56.41 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.445 -0.576 . . . . 10.0 109.445 178.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 7.9 mt -63.8 -27.61 69.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.637 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -76.24 -40.35 52.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.893 0.378 . . . . 10.0 110.139 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -71.47 -53.96 12.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.064 -0.516 . . . . 10.0 109.633 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . 0.432 HD21 ' HA3' ' C' ' 436' ' ' GLY . 98.0 m-20 -65.89 -31.21 72.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.629 -0.714 . . . . 10.0 109.724 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -70.6 -42.61 62.71 Favored Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.141 -0.783 . . . . 10.0 111.141 178.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.18 -40.96 99.66 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 109.637 -1.385 . . . . 10.0 109.637 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -67.84 -43.01 80.5 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.157 -0.683 . . . . 10.0 109.157 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 20.9 mtt180 -54.55 -50.7 67.31 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.406 178.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 87.7 mt -58.98 -42.89 91.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.498 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -64.15 -45.79 86.9 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -60.36 -50.61 72.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.128 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -59.05 -43.72 91.72 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.062 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -68.74 -44.64 73.34 Favored 'General case' 0 C--N 1.33 -0.252 0 O-C-N 123.11 0.257 . . . . 10.0 111.434 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.57 -33.3 73.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.234 0.54 . . . . 10.0 110.688 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . 0.649 ' HG2' HG22 ' C' ' 422' ' ' VAL . 4.9 mtmm -86.75 -20.71 27.25 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.246 178.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -72.49 -38.74 68.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.086 -0.506 . . . . 10.0 109.764 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -40.63 94.79 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 178.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -69.16 -27.56 65.64 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.671 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -71.33 -47.77 54.52 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 108.159 -1.052 . . . . 10.0 108.159 177.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 84.9 mt -62.26 -43.2 99.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.124 -0.944 . . . . 10.0 111.984 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 10.0 p -60.43 -50.41 73.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.731 0.3 . . . . 10.0 111.095 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 7.5 p -66.38 -35.96 81.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.942 179.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 34.1 mt -67.27 -31.6 72.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.429 -0.35 . . . . 10.0 110.185 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 50.7 m -67.81 -29.34 68.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.147 0.499 . . . . 10.0 109.929 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . 0.45 ' C ' ' HD2' ' A' ' 366' ' ' PRO . 11.4 mt-10 -76.3 -5.18 45.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.526 0.679 . . . . 10.0 109.73 178.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.552 ' O ' ' HB3' ' A' ' 367' ' ' ALA . 39.6 mttm -109.13 -38.92 5.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.83 -0.804 . . . . 10.0 108.83 178.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -71.07 -21.12 62.28 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.502 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.817 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 99.5 mttt -105.62 -74.48 0.02 OUTLIER Pre-proline 0 CA--C 1.537 0.448 0 N-CA-C 112.457 0.54 . . . . 10.0 112.457 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.817 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 32.2 Cg_exo -59.63 -47.74 15.27 Favored 'Trans proline' 0 C--N 1.357 1.005 0 C-N-CA 122.27 1.98 . . . . 10.0 113.278 -179.273 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . 0.552 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -66.93 -43.19 83.9 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.912 -0.315 . . . . 10.0 111.327 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 1.1 mt -65.92 -39.05 90.18 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 121.03 -0.268 . . . . 10.0 110.901 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . 0.639 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 5.6 mm-40 -64.43 -38.55 91.42 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.036 -0.728 . . . . 10.0 109.036 178.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -63.37 -41.44 98.82 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 79.3 mt -62.82 -45.0 94.66 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.362 -0.836 . . . . 10.0 110.006 178.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 72.0 mtt180 -64.95 -40.11 94.52 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.583 -0.525 . . . . 10.0 109.583 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.639 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.5 mt-30 -63.54 -30.97 72.01 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.56 -0.745 . . . . 20.0 112.051 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -85.75 -34.85 12.43 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 109.481 -1.448 . . . . 10.0 109.481 178.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 13.9 mt -57.11 -41.88 79.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.652 -0.274 . . . . 10.0 111.51 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 72.8 mt -54.34 -62.98 3.14 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 112.491 0.552 . . . . 10.0 112.491 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -63.39 -37.52 48.87 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 121.836 1.691 . . . . 10.0 111.657 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 18.3 t -61.66 -49.39 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 O-C-N 122.986 0.179 . . . . 10.0 110.677 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 59.4 mt -61.38 -39.45 90.72 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.503 -0.554 . . . . 10.0 109.503 178.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . 0.499 ' O ' HG23 ' A' ' 384' ' ' VAL . 19.1 mt-10 -63.24 -49.28 74.75 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.678 178.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 5.1 p -63.02 -38.92 93.11 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 120.928 0.394 . . . . 10.0 110.541 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -65.42 -43.43 90.52 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.737 178.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . 0.441 ' O ' ' HG ' ' A' ' 387' ' ' LEU . 83.5 mttt -61.81 -40.25 94.59 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.357 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 380' ' ' GLU . 73.2 t -60.43 -44.99 97.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 13.5 m -63.73 -42.66 97.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.706 178.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -64.38 -41.13 96.84 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.941 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 383' ' ' LYS . 83.6 mt -60.1 -37.95 81.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.37 0.605 . . . . 10.0 110.372 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . 0.736 ' HB3' ' HE2' ' C' ' 594' ' ' LYS . 13.1 m -77.27 -41.11 42.22 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.681 -0.69 . . . . 10.0 110.002 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -62.83 -43.52 98.58 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.692 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 77.6 mt -65.54 -32.46 74.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.852 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -66.14 -49.04 68.84 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 179.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.49 -29.05 70.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.742 -0.663 . . . . 10.0 109.891 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -67.86 -20.87 65.18 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.48 0.712 . . . . 10.0 111.078 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.89 12.07 31.08 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 121.091 0.472 . . . . 10.0 110.705 -179.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . 0.793 ' O ' ' HB2' ' A' ' 396' ' ' LYS . 46.3 mtmt -129.48 154.03 47.39 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.09 0.471 . . . . 10.0 111.265 179.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . 0.793 ' HB2' ' O ' ' A' ' 395' ' ' LYS . 99.4 mttt 90.08 -54.63 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.891 0 N-CA-C 112.914 0.709 . . . . 10.0 112.914 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 96.0 mt -59.91 -44.23 94.41 Favored 'General case' 0 C--N 1.353 0.734 0 N-CA-C 112.673 0.62 . . . . 10.0 112.673 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 . . . . . 0 CA--C 1.512 -0.506 0 N-CA-C 108.199 -1.037 . . . . 10.0 108.199 178.382 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 89.8 mt . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 108.574 -0.898 . . . . 10.0 108.574 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt 79.19 -56.02 0.43 Allowed 'General case' 0 C--O 1.236 0.391 0 CA-C-N 113.64 -1.618 . . . . 10.0 110.99 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.89 -32.41 71.86 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 120.783 0.325 . . . . 10.0 111.518 179.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 12.9 mt -78.08 -31.61 50.27 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.874 -0.417 . . . . 10.0 109.874 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -71.81 -47.87 50.29 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.009 -0.996 . . . . 10.0 111.51 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -62.91 -42.58 99.84 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 114.956 -1.02 . . . . 10.0 110.567 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -37.43 75.98 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 123.337 0.398 . . . . 10.0 110.563 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -62.18 -44.15 97.24 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.326 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 3.1 m -64.89 -36.11 83.3 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.331 0.586 . . . . 10.0 109.582 178.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 62.4 t -67.47 -46.95 82.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.06 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 52.6 m -60.83 -43.58 98.07 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.441 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 28.7 m -62.71 -40.41 97.05 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 120.846 0.355 . . . . 10.0 110.633 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 10.9 p -76.65 -11.23 59.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 10.0 111.057 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . 0.511 ' O ' ' HB2' ' C' ' 415' ' ' LEU . 45.8 t80 -85.6 -38.59 18.27 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 108.667 -0.864 . . . . 10.0 108.667 177.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 24.9 m -62.25 -39.91 94.42 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.616 -0.883 . . . . 10.0 108.616 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -66.49 -19.81 65.88 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.284 -0.871 . . . . 10.0 110.451 178.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . 0.511 ' HB2' ' O ' ' C' ' 412' ' ' PHE . 30.1 mt -76.37 -32.97 58.91 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 108.529 -0.915 . . . . 10.0 108.529 177.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 -74.16 -42.59 59.68 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 178.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -68.17 -14.09 62.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.624 -0.717 . . . . 10.0 109.852 178.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -94.67 -53.72 3.77 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.171 -0.922 . . . . 10.0 108.989 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . 0.419 ' HA ' ' HB ' ' C' ' 422' ' ' VAL . 43.5 mt -60.32 -28.92 68.52 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.711 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -54.19 -73.03 0.45 Allowed Glycine 0 CA--C 1.518 0.256 0 N-CA-C 111.37 -0.692 . . . . 10.0 111.37 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.32 -34.9 98.67 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.391 2.061 . . . . 10.0 111.177 178.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . 0.649 HG22 ' HG2' ' A' ' 352' ' ' LYS . 12.6 t -58.87 -50.0 81.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.273 -0.422 . . . . 10.0 111.08 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 18.4 p -70.22 -38.2 75.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.66 0.267 . . . . 10.0 110.805 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -60.52 -48.32 82.27 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.816 -0.439 . . . . 10.0 109.816 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -67.39 -37.75 83.61 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.077 -0.511 . . . . 10.0 109.624 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -63.19 -36.91 85.2 Favored 'General case' 0 C--O 1.225 -0.188 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 28.4 m95 -66.27 -42.9 87.79 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 178.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . 0.554 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 37.7 t70 -65.17 -37.31 86.98 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.972 -0.751 . . . . 10.0 108.972 178.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -65.28 -44.79 86.9 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.702 -0.851 . . . . 10.0 108.702 177.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 46.9 mt -62.38 -32.43 73.24 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.469 -0.787 . . . . 10.0 109.371 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -66.37 -41.6 89.23 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 178.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . 0.554 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 53.0 mttp -64.72 -45.27 87.22 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 108.423 -0.954 . . . . 10.0 108.423 178.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -61.2 -48.42 81.63 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.051 -0.977 . . . . 10.0 110.734 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 10.7 p -66.17 -38.6 88.44 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.826 -0.17 . . . . 10.0 111.195 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -61.59 -47.59 84.76 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.843 -0.799 . . . . 10.0 108.843 178.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . 0.432 ' HA3' HD21 ' A' ' 341' ' ' ASN . . . -63.87 -46.5 91.49 Favored Glycine 0 N--CA 1.443 -0.889 0 N-CA-C 110.048 -1.221 . . . . 10.0 110.048 177.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 34.6 mt -58.61 -33.26 69.81 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-O 120.517 0.199 . . . . 10.0 110.925 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -70.32 -38.29 74.9 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 178.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -71.39 -30.54 66.24 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.017 -0.735 . . . . 10.0 109.017 178.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . 0.566 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 37.4 mt-10 -75.29 -57.56 3.82 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.253 -0.885 . . . . 10.0 109.782 178.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 95.7 mmm -61.71 -29.21 69.95 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 113.743 1.016 . . . . 10.0 113.743 -178.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 5.5 p -63.15 -51.87 64.72 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -71.62 -36.23 70.71 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.587 -0.733 . . . . 10.0 109.531 178.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 5.7 t0 -57.29 -57.72 11.39 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.503 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 24.9 mt -64.18 -37.13 86.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.568 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -62.67 -49.94 73.16 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 178.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . 0.474 ' HB3' HH21 ' A' ' 330' ' ' ARG . 7.5 tt0 -66.14 -34.02 77.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.661 -0.7 . . . . 10.0 109.662 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . 0.534 HG23 HH22 ' A' ' 330' ' ' ARG . 2.6 t -60.96 -46.93 95.63 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.232 0 N-CA-C 109.367 -0.605 . . . . 10.0 109.367 178.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 83.9 mttt -67.21 -38.38 85.21 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 178.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -70.35 -11.69 61.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.318 178.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . 0.637 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 43.3 mttm -98.76 -50.1 4.35 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 63.0 t -58.22 -41.71 81.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.688 -0.687 . . . . 10.0 111.998 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -53.95 -63.52 2.57 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 112.213 0.449 . . . . 10.0 112.213 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . 0.418 ' HG2' ' OH ' ' A' ' 323' ' ' TYR . 43.1 Cg_endo -70.98 -20.9 28.5 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 121.643 1.562 . . . . 10.0 111.789 179.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . 0.637 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.4 OUTLIER -70.0 -50.85 37.4 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 179.1 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . 0.457 ' O ' ' HB2' ' C' ' 460' ' ' GLN . 17.5 mt -69.47 -36.31 76.45 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.061 -0.518 . . . . 10.0 109.915 179.154 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . 0.426 ' O ' ' HG3' ' C' ' 461' ' ' LYS . 7.7 t70 -62.13 -40.45 95.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.286 0.565 . . . . 10.0 110.558 179.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -79.33 -42.67 25.16 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.621 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . 0.444 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 1.0 OUTLIER -63.31 -40.89 98.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.662 179.377 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' C' ' 456' ' ' LEU . 6.6 mt-30 -62.44 -36.61 82.97 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.446 179.02 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . 0.426 ' HG3' ' O ' ' C' ' 457' ' ' ASP . 17.9 mttp -67.35 -40.6 85.84 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.054 -0.721 . . . . 10.0 109.054 178.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' C' ' 466' ' ' GLU . 15.5 mtmm -65.7 -43.74 88.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.324 178.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . 0.499 ' O ' ' HB2' ' C' ' 467' ' ' MET . 23.6 m0 -66.39 -34.4 77.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.15 178.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . 0.553 ' O ' ' HG3' ' C' ' 468' ' ' GLU . 15.6 mt-30 -67.0 -53.03 35.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.281 179.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 0.979 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 4.1 pt-20 -63.3 -31.61 72.8 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.076 0.465 . . . . 10.0 110.295 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . 0.506 ' HA ' HD12 ' C' ' 469' ' ' LEU . 6.9 tt0 -73.83 -37.82 64.72 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.188 -0.671 . . . . 10.0 109.188 178.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . 0.499 ' HB2' ' O ' ' C' ' 463' ' ' TRP . 0.0 OUTLIER -63.64 -45.73 88.9 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.743 -0.836 . . . . 10.0 108.743 178.609 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . 0.553 ' HG3' ' O ' ' C' ' 464' ' ' GLN . 46.4 mt-10 -62.42 -40.45 96.58 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.498 -0.927 . . . . 10.0 108.498 178.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 1.25 ' CD1' ' HG3' ' A' ' 308' ' ' ARG . 96.4 mt -61.92 -40.16 94.53 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 115.169 -0.923 . . . . 20.0 110.0 178.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . 0.65 ' HB3' ' H70' ' A' ' 76' ' ' 17F . 13.8 m-30 -67.23 -41.26 86.0 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.501 178.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -60.82 -48.57 81.21 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . 0.453 HE21 ' HB3' ' C' ' 472' ' ' GLN . 0.0 OUTLIER -82.34 28.12 0.47 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.595 179.596 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . 0.813 ' HE2' HD22 ' A' ' 301' ' ' LEU . 0.0 OUTLIER -134.99 -62.78 0.71 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.383 -0.826 . . . . 10.0 109.028 178.675 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 61.8 t -65.66 -39.11 83.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.26 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -62.42 -58.62 16.18 Favored Pre-proline 0 CA--C 1.535 0.394 0 N-CA-C 112.061 0.393 . . . . 10.0 112.061 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -63.52 -37.88 45.39 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 121.649 1.566 . . . . 10.0 111.389 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' C' ' 477' ' ' LEU . 29.2 mt -66.98 -31.38 71.91 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.49 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -63.56 -36.19 82.98 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -70.89 -43.31 68.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.492 178.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.95 -43.61 95.29 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 178.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 59.1 mt -68.95 -30.48 68.94 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.551 -0.75 . . . . 10.0 110.195 178.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -66.97 -47.54 71.27 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -69.26 -34.27 74.51 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -68.21 -40.94 87.56 Favored Glycine 0 N--CA 1.445 -0.724 0 N-CA-C 109.873 -1.291 . . . . 10.0 109.873 177.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.41 76.72 Favored 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 44.8 mtt180 -61.73 -41.56 97.8 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . 0.542 ' O ' ' HG3' ' C' ' 491' ' ' GLU . 0.0 OUTLIER -63.69 -44.22 94.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.363 178.007 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . 0.402 ' O ' ' HG ' ' C' ' 492' ' ' LEU . 83.0 tttt -67.14 -40.4 86.74 Favored 'General case' 0 C--N 1.33 -0.249 0 O-C-N 123.276 0.36 . . . . 10.0 110.355 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 45.6 mt -64.76 -44.51 89.83 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.349 -0.611 . . . . 10.0 109.349 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.04 -39.19 91.48 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 108.795 -0.817 . . . . 10.0 108.795 178.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . 0.726 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 36.7 mt-10 -61.71 -49.97 74.31 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 108.133 -1.062 . . . . 10.0 108.133 177.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' C' ' 488' ' ' LYS . 90.3 mt -58.89 -37.34 76.36 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.872 -0.603 . . . . 10.0 110.674 179.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -63.69 -37.05 85.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.91 0.386 . . . . 10.0 110.151 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -88.93 -0.88 57.78 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.626 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.869 ' HG2' HD22 ' A' ' 279' ' ' LEU . 12.3 mttm -113.37 -55.75 2.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.817 0.341 . . . . 10.0 110.998 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 90.8 mt -64.96 -31.52 72.8 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.913 0.709 . . . . 10.0 112.913 -178.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 12.8 m -68.14 -59.09 6.69 Favored Pre-proline 0 CA--C 1.537 0.459 0 C-N-CA 120.722 -0.391 . . . . 10.0 112.005 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -62.63 -36.63 62.8 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.745 1.63 . . . . 10.0 110.866 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 34.5 mt -71.04 -34.96 71.77 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.095 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -65.7 -49.56 58.96 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 110.725 -0.95 . . . . 10.0 110.725 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.11 -41.63 97.03 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 178.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . 0.474 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 25.0 tt0 -64.84 -47.61 77.34 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.493 -0.776 . . . . 10.0 109.819 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . 0.786 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 62.9 mmm -59.44 -38.05 79.7 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.752 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 20.5 mtt85 -64.98 -40.47 95.03 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 178.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . 0.519 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 0.4 OUTLIER -70.63 -36.1 73.27 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 178.599 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.786 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 44.3 mtt180 -62.87 -45.86 90.57 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 107.442 -1.318 . . . . 10.0 107.442 177.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -62.21 -38.73 90.29 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 114.857 -1.065 . . . . 10.0 109.361 178.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . 0.519 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 78.7 mtt180 -58.3 -53.57 56.81 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . 0.526 ' HB1' ' HD2' ' A' ' 264' ' ' LYS . . . -60.08 -36.14 76.73 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.485 -0.78 . . . . 10.0 111.144 179.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . 0.5 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 16.2 m-70 -74.47 -49.64 21.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.577 0.227 . . . . 10.0 111.549 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 79.2 t -65.74 -41.67 90.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 120.715 0.293 . . . . 10.0 110.509 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.403 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 3.3 t70 -63.97 -37.41 87.32 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.48 -44.78 86.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.344 -0.984 . . . . 10.0 108.344 177.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 89.2 mt -58.99 -32.67 69.89 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.372 178.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . 0.403 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 66.4 mtt180 -65.04 -34.7 79.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.326 178.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.3 5.19 46.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.684 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 44.2 m170 -117.22 -43.97 2.81 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.848 0.314 . . . . 10.0 111.848 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 92.1 mt -90.07 -47.83 7.57 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.409 0.522 . . . . 10.0 112.409 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . 0.411 ' N ' ' HD2' ' C' ' 520' ' ' PRO . . . -50.54 -55.37 26.68 Favored Pre-proline 0 N--CA 1.468 0.472 0 N-CA-C 112.904 0.705 . . . . 10.0 112.904 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . 0.411 ' HD2' ' N ' ' C' ' 519' ' ' ALA . 29.7 Cg_endo -64.91 -31.8 56.0 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 121.692 1.595 . . . . 10.0 110.701 178.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -64.11 -43.85 94.06 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.725 -0.67 . . . . 10.0 109.786 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.85 -31.24 71.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.001 0.429 . . . . 10.0 109.968 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . 0.688 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 30.3 t70 -70.02 -39.14 75.97 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.425 -0.583 . . . . 10.0 109.425 178.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -72.38 -33.23 67.05 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 177.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . 0.741 HD23 ' HD2' ' C' ' 528' ' ' ARG . 25.3 mt -66.89 -29.13 68.94 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.541 -0.754 . . . . 10.0 109.23 177.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . 0.688 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 63.5 mtt180 -60.91 -38.62 86.37 Favored 'General case' 0 C--O 1.224 -0.249 0 N-CA-C 109.681 -0.489 . . . . 10.0 109.681 178.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . 0.434 HE21 ' HB2' ' C' ' 527' ' ' GLN . 15.5 mt-30 -66.95 -44.47 80.5 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.831 -0.803 . . . . 10.0 108.831 178.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . 0.741 ' HD2' HD23 ' C' ' 525' ' ' LEU . 77.6 mtt180 -63.85 -41.77 97.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 114.849 -1.069 . . . . 10.0 110.662 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 62.1 mt -68.09 -43.18 79.08 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.256 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.87 -43.51 98.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.922 179.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.3 -45.1 77.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.361 -0.381 . . . . 10.0 110.153 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . 0.569 ' NH2' ' HB3' ' C' ' 528' ' ' ARG . 1.1 ttm180 -61.9 -40.58 95.96 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' C' ' 537' ' ' LYS . 18.9 mt -64.29 -36.6 84.64 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.021 178.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -66.37 -40.92 90.02 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.839 -0.43 . . . . 10.0 109.839 178.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.26 -45.8 86.49 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 178.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 91.6 mt -69.94 -19.05 63.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.539 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . 0.501 ' HB2' ' O ' ' C' ' 533' ' ' LEU . 64.7 tttt -82.23 -44.37 16.42 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.662 -0.496 . . . . 10.0 109.662 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -68.6 -50.23 53.17 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . 0.576 ' OD1' ' HE3' ' A' ' 234' ' ' LYS . 69.8 m-20 -67.97 -37.58 81.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.727 -0.669 . . . . 10.0 109.388 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . 0.517 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -65.75 -43.04 94.84 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.251 -0.74 . . . . 10.0 111.251 179.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -63.18 -42.54 99.39 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 110.399 -1.08 . . . . 10.0 110.399 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -64.3 -42.69 96.24 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . 0.401 ' HD2' HH11 ' C' ' 543' ' ' ARG . 44.4 mtt85 -60.14 -39.54 86.71 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.367 179.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 79.8 mt -58.62 -42.23 87.76 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 178.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.92 -45.33 74.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.754 -0.657 . . . . 10.0 109.437 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -60.0 -48.49 81.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.318 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -59.72 -39.84 86.03 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.261 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 40.5 m170 -65.98 -43.26 88.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.449 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.48 -44.8 85.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.091 -0.504 . . . . 10.0 109.876 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . 0.473 ' HA ' ' OE1' ' C' ' 553' ' ' GLU . 0.2 OUTLIER -67.85 -27.33 66.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.256 179.345 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.62 -44.7 73.66 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.163 -0.68 . . . . 10.0 109.163 178.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.94 -38.19 85.71 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.702 -0.481 . . . . 10.0 109.702 178.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . 0.473 ' OE1' ' HA ' ' C' ' 550' ' ' LYS . 85.2 mt-10 -63.86 -36.71 84.83 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -72.05 -45.65 59.97 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.105 178.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 63.1 mt -61.68 -38.74 88.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.099 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 33.9 m -64.4 -46.35 83.68 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.5 -0.318 . . . . 10.0 110.38 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 1.1 p -69.47 -26.94 64.81 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.103 0.477 . . . . 10.0 110.694 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 54.2 mt -77.91 -25.84 48.68 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.391 178.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 56.7 m -64.59 -41.24 96.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.042 0.449 . . . . 10.0 111.112 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -72.96 -11.47 60.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.176 0.512 . . . . 10.0 111.005 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . 0.51 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 11.3 mptt -104.51 -28.13 11.48 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.792 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -83.96 -18.49 37.09 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.433 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . 0.853 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 50.0 mtmt -112.29 -74.9 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.348 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . 0.853 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 74.7 Cg_exo -52.92 -49.19 18.45 Favored 'Trans proline' 0 C--N 1.359 1.081 0 C-N-CA 122.171 1.914 . . . . 10.0 112.517 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -64.07 -40.18 95.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.698 0.285 . . . . 10.0 110.923 179.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 49.5 tp -66.78 -38.87 87.41 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.579 -0.282 . . . . 10.0 110.46 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . 0.928 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 4.0 mm-40 -59.06 -45.56 90.46 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -68.91 -41.59 77.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.449 178.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 43.6 mt -58.98 -44.93 91.66 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.837 0.351 . . . . 10.0 110.123 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . 0.454 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 60.1 mtt180 -68.85 -35.54 77.07 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.576 -0.528 . . . . 10.0 109.576 178.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . 0.928 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.6 mt-30 -66.28 -30.68 71.16 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.447 -0.797 . . . . 20.0 111.346 179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -84.02 -35.76 14.73 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 109.429 -1.468 . . . . 10.0 109.429 178.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 17.8 mt -62.28 -34.47 76.63 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 122.044 0.138 . . . . 10.0 111.302 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . 0.6 ' O ' ' HG3' ' C' ' 578' ' ' GLU . 91.4 mt -55.63 -63.25 3.34 Favored Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 112.003 0.372 . . . . 10.0 112.003 179.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . 0.428 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 36.5 Cg_endo -67.38 -29.25 38.34 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.877 1.718 . . . . 10.0 111.708 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 4.7 t -64.9 -45.21 95.49 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 N-CA-C 109.343 -0.614 . . . . 10.0 109.343 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' C' ' 581' ' ' LYS . 26.7 mt -64.5 -39.51 93.93 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.614 -0.513 . . . . 10.0 109.614 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . 0.6 ' HG3' ' O ' ' C' ' 574' ' ' LEU . 48.2 mt-10 -63.17 -51.19 67.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.056 179.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 4.7 p -62.19 -41.33 98.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.779 0.323 . . . . 10.0 110.343 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -61.7 -48.27 81.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.072 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' C' ' 577' ' ' LEU . 41.8 mtmt -58.75 -46.77 86.7 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.406 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.95 -48.49 83.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.887 0.375 . . . . 10.0 110.286 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 16.2 m -61.62 -44.06 97.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.109 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -66.97 -41.18 87.3 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.521 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' C' ' 581' ' ' LYS . 73.2 mt -59.28 -51.28 70.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.875 0.369 . . . . 10.0 110.483 179.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 13.1 m -63.87 -35.23 79.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.652 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . 0.5 ' HB2' ' HD3' ' A' ' 396' ' ' LYS . . . -67.8 -45.35 75.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.574 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 86.2 mt -65.11 -37.03 86.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.011 0.434 . . . . 10.0 110.311 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -66.6 -29.77 69.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.461 179.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -79.5 -44.66 20.81 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.046 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -63.59 -41.89 98.32 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.805 0.669 . . . . 10.0 112.805 -179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . 0.457 ' O ' ' HB2' ' C' ' 596' ' ' ASN . 2.1 p -60.69 -28.59 68.74 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.836 0.31 . . . . 10.0 111.836 -179.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -69.19 -40.21 78.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.043 0.449 . . . . 10.0 110.499 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . 0.736 ' HE2' ' HB3' ' A' ' 388' ' ' SER . 5.1 mptt -76.68 -37.61 55.9 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.96 -0.564 . . . . 10.0 111.105 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 90.1 mt -85.36 34.53 0.57 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.649 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . 0.457 ' HB2' ' O ' ' C' ' 592' ' ' THR . 9.2 t-20 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.515 -0.755 . . . . 10.0 110.007 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 19.5 ttt . . . . . 0 C--O 1.23 0.07 0 CA-C-O 121.392 0.615 . . . . 10.0 110.0 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 14.6 t -98.61 168.26 10.28 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.106 -0.952 . . . . 10.0 110.601 -179.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.441 ' HA ' ' O ' ' B' ' 52' ' ' LEU . 24.9 tt0 -116.29 101.37 8.62 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.884 -0.413 . . . . 10.0 109.884 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -73.7 144.49 45.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.676 -178.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.419 ' HB3' ' HA2' ' B' ' 75' ' ' GLY . 4.0 mptt -100.37 113.91 27.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.493 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.62 HD22 HD23 ' B' ' 159' ' ' LEU . 34.3 mt -110.01 108.9 19.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.49 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 58.8 t -101.89 115.09 43.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-O 120.961 0.41 . . . . 10.0 110.918 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 21.3 t -91.73 117.74 35.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.537 ' HB ' ' CE1' ' B' ' 96' ' ' TYR . 26.8 m -112.88 165.45 7.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 120.995 0.426 . . . . 10.0 111.327 -179.477 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 151.07 174.23 21.8 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.21 -0.756 . . . . 10.0 111.21 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.16 177.29 6.01 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.922 0.391 . . . . 10.0 111.271 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.84 125.64 8.48 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.873 -0.679 . . . . 10.0 111.775 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 115.24 -12.98 19.19 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.775 -0.726 . . . . 10.0 112.514 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 20.9 m -72.54 -31.73 38.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 112.003 0.371 . . . . 10.0 112.003 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 93.65 43.4 3.94 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.54 -0.838 . . . . 10.0 113.204 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 42.0 mtmt -62.13 -46.88 87.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.854 0.359 . . . . 10.0 111.64 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.5 p -63.26 -36.52 83.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.465 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.48 -47.15 82.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.653 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 45.1 mt -62.69 -44.27 96.67 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.918 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 12.7 m -64.88 -50.15 67.67 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.672 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 97.4 mt -65.43 -28.26 43.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-O 120.782 0.325 . . . . 10.0 110.999 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.644 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 6.5 tp-100 -68.29 -22.62 64.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.153 0.501 . . . . 10.0 110.8 179.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.7 tp -96.93 -41.48 8.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.306 0.574 . . . . 10.0 110.481 179.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . 0.644 ' HA ' ' HD2' ' B' ' 42' ' ' LYS . 51.1 mm -73.88 -49.16 35.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.691 -0.686 . . . . 10.0 112.506 -178.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.517 ' NE2' ' HA ' ' D' ' 840' ' ' VAL . 5.8 mt-30 -107.83 -18.92 13.69 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.092 0.404 . . . . 10.0 112.092 -178.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.552 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 33.1 m-80 66.61 35.22 5.45 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.468 -0.938 . . . . 10.0 108.468 -177.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -124.53 130.99 53.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 114.183 -1.371 . . . . 10.0 109.628 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -93.51 134.76 35.45 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.456 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 16.7 m -100.43 138.41 24.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.996 0.427 . . . . 10.0 111.031 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -103.46 -26.57 12.82 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.508 0.671 . . . . 10.0 109.838 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -78.38 148.31 33.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.384 -0.826 . . . . 10.0 110.726 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.43 ' HA ' H5'2 ' B' ' 201' ' ' GNP . 54.3 t80 -91.47 77.64 5.74 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.651 -0.5 . . . . 10.0 109.651 178.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.85 134.91 68.06 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.094 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.49 177.17 3.48 Favored 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 123.081 2.521 . . . . 10.0 112.849 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -166.72 135.37 2.82 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.199 0.523 . . . . 10.0 112.163 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.823 HD11 HG21 ' D' ' 809' ' ' THR . 4.3 mt -119.98 -67.01 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 108.551 -0.907 . . . . 10.0 108.551 179.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.453 ' O ' HG23 ' D' ' 821' ' ' VAL . 4.0 tt0 -146.08 92.39 2.19 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.372 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . 0.711 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 57.7 m-20 -111.79 160.84 16.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.379 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . 0.415 ' HA ' ' O ' ' B' ' 55' ' ' ILE . 1.7 p -148.1 139.89 23.88 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.643 -0.253 . . . . 10.0 111.594 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . 0.659 ' CE2' HG22 ' D' ' 840' ' ' VAL . 24.3 m-85 -125.53 145.28 50.18 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -178.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . 0.459 ' NH1' ' HD3' ' D' ' 817' ' ' LYS . 1.2 ttp180 -126.81 127.98 45.85 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.754 0.311 . . . . 10.0 111.561 -178.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . 0.644 ' HD2' ' HA ' ' B' ' 24' ' ' ILE . 37.9 tttp -151.24 150.69 30.87 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.589 178.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . 0.673 HE22 ' H1A' ' A' ' 38' ' ' 17F . 24.9 tt0 -114.07 125.2 53.71 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 110.326 -0.249 . . . . 10.0 110.326 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 10.3 m -136.19 158.83 38.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.965 0.412 . . . . 10.0 110.848 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 47.2 t -99.77 107.11 20.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.414 -0.587 . . . . 10.0 109.414 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 72.7 mt -106.19 120.01 56.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.82 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.88 16.1 7.71 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.808 0.67 . . . . 10.0 112.808 178.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.21 -9.03 45.64 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.755 -0.736 . . . . 10.0 112.666 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -106.97 124.33 49.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.037 0.446 . . . . 10.0 110.665 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.438 HG21 ' H62' ' A' ' 5' ' ' PCW . 9.5 t -85.75 128.1 34.71 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.101 -0.499 . . . . 10.0 109.742 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 1.6 p -144.71 163.05 35.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.866 0.365 . . . . 10.0 111.42 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' B' ' 3' ' ' GLU . 15.1 tp -97.5 135.75 38.91 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.09 -0.708 . . . . 10.0 109.09 179.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 90.6 mt -113.6 122.72 48.06 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 111.986 0.365 . . . . 10.0 111.986 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -103.53 102.33 12.23 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.103 -1.073 . . . . 10.0 108.103 177.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.566 HD12 HD11 ' B' ' 24' ' ' ILE . 44.8 mt -93.58 129.52 43.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.447 -178.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.406 HD21 ' CD1' ' B' ' 71' ' ' TYR . 53.4 tp -105.94 116.0 31.2 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.943 -0.572 . . . . 10.0 111.206 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.711 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 7.3 t0 -92.97 93.2 8.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.236 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 48.7 p -72.61 162.71 29.13 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.203 -0.908 . . . . 10.0 112.155 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.6 159.07 32.68 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.232 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -80.05 -32.07 37.03 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.747 -0.739 . . . . 10.0 111.918 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -139.24 128.45 23.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.618 0.247 . . . . 20.0 110.541 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -169.92 142.88 2.46 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.591 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -100.98 -141.33 0.34 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.252 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -68.22 122.43 18.3 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . 0.4 ' HB3' ' HB3' ' B' ' 68' ' ' ARG . 13.5 t -144.99 125.08 13.61 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.172 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . 0.467 ' O ' ' H61' ' A' ' 6' ' ' PCW . . . -62.27 -31.79 72.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.111 0.482 . . . . 10.0 109.909 179.253 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 40.7 mmm -70.86 -44.52 66.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.691 -0.686 . . . . 10.0 109.599 179.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.554 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 47.9 ttt85 -63.27 -44.86 93.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.71 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.446 ' O ' ' HB2' ' B' ' 73' ' ' ARG . 0.1 OUTLIER -59.25 -20.84 57.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.677 -0.692 . . . . 10.0 111.593 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.93 -47.92 6.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.114 179.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . 0.554 ' CE2' ' HA ' ' B' ' 68' ' ' ARG 0.253 0.5 OUTLIER -66.01 -28.52 68.94 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 113.121 0.786 . . . . 10.0 113.121 -178.968 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 2.7 mtp -91.82 4.07 53.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.185 0.517 . . . . 10.0 110.609 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' B' ' 69' ' ' ASP . 11.7 ttm180 -98.33 -28.35 13.7 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.135 0.493 . . . . 10.0 110.402 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.6 -5.7 53.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.615 -0.72 . . . . 10.0 112.119 -179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . 0.419 ' HA2' ' HB3' ' B' ' 5' ' ' LYS . . . -83.15 144.16 22.46 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.552 -0.832 . . . . 10.0 112.701 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -96.68 -49.28 5.16 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.033 0.444 . . . . 10.0 110.005 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -112.19 139.61 15.73 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 111.203 -0.759 . . . . 10.0 111.203 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.403 ' O ' ' HA ' ' B' ' 111' ' ' MET . 62.2 m-85 -121.25 123.58 42.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.166 0.507 . . . . 10.0 111.999 -179.079 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.921 ' HG ' HD22 ' B' ' 159' ' ' LEU . 45.0 mt -95.4 108.72 20.94 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.107 179.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 11.4 m -84.58 88.93 7.36 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.991 -0.374 . . . . 10.0 109.991 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.497 HG22 ' HB ' ' B' ' 114' ' ' VAL . 43.7 t -90.52 127.72 42.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.78 -178.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.7 ' HB3' HD11 ' B' ' 93' ' ' ILE . 29.2 p90 -132.78 159.38 39.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.108 178.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.409 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -96.04 119.86 35.29 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.993 -0.373 . . . . 10.0 109.993 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.737 HD11 ' HA ' ' B' ' 118' ' ' CYS . 13.1 pt -69.6 -5.45 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 112.231 0.456 . . . . 10.0 112.231 -179.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . 0.409 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 4.4 p-10 -94.33 -1.8 53.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.984 0.421 . . . . 10.0 110.949 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -138.86 112.34 8.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.244 -0.434 . . . . 10.0 110.693 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . 0.456 ' O ' ' HG3' ' B' ' 91' ' ' GLU . 0.2 OUTLIER -60.18 -33.73 72.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.024 -0.535 . . . . 10.0 111.939 -179.519 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 38.6 tptt -62.07 -34.56 76.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.108 0.48 . . . . 10.0 110.368 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 31.8 t -67.27 -30.21 70.03 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.091 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . 0.418 ' CE1' ' HA ' ' B' ' 130' ' ' ALA . 68.6 t80 -80.72 -38.6 28.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.372 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' B' ' 87' ' ' THR . 40.5 mt-10 -72.02 -23.26 61.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.833 -179.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . 0.456 ' O ' ' HB3' ' B' ' 95' ' ' HIS . 0.4 OUTLIER -81.43 -3.57 53.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.525 -0.307 . . . . 10.0 111.549 -179.749 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . 0.7 HD11 ' HB3' ' B' ' 82' ' ' PHE . 22.4 mm -61.48 -39.73 83.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.278 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 28.9 t60 -64.16 -33.57 76.1 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . 0.456 ' HB3' ' O ' ' B' ' 92' ' ' ASP . 5.1 t-160 -60.95 -39.91 91.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.443 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . 0.537 ' CE1' ' HB ' ' B' ' 9' ' ' VAL . 1.9 m-85 -74.66 -39.84 61.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.654 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -56.2 -44.57 79.58 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.185 -0.462 . . . . 10.0 110.359 179.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -66.34 -40.27 89.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.883 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -64.81 -47.9 76.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.482 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 58.6 mt -62.89 -44.71 99.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.883 0.373 . . . . 10.0 110.25 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . 0.815 ' HD2' ' HG3' ' B' ' 107' ' ' GLU . 13.1 tttp -59.37 -37.84 78.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.302 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 65.4 ttp85 -67.5 -47.21 70.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.779 -0.646 . . . . 10.0 112.109 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 34.1 m -71.35 -25.85 25.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 112.672 0.619 . . . . 10.0 112.672 -178.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -95.14 -10.28 31.07 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 25.8 t0 58.79 22.88 10.59 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.486 0.66 . . . . 10.0 111.309 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 4.6 m -144.47 151.88 39.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.85 -0.613 . . . . 10.0 110.647 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . 0.815 ' HG3' ' HD2' ' B' ' 101' ' ' LYS . 3.7 mp0 -92.76 -38.49 11.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.147 0.498 . . . . 10.0 110.895 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -81.43 62.54 5.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.459 0.647 . . . . 10.0 112.382 -178.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.413 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 49.1 t -101.46 132.92 21.22 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.74 -0.664 . . . . 10.0 109.243 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 49.4 Cg_exo -57.11 104.7 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.94 2.426 . . . . 10.0 112.382 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . 0.403 ' HA ' ' O ' ' B' ' 78' ' ' PHE . 43.2 mtt -130.88 143.63 50.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.881 -0.599 . . . . 10.0 109.695 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.561 ' HB ' HD23 ' B' ' 79' ' ' LEU . 92.4 t -128.29 127.67 67.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.612 -0.514 . . . . 10.0 109.612 179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 18.9 tp -81.0 120.91 25.38 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . 0.497 ' HB ' HG22 ' B' ' 81' ' ' VAL . 40.3 t -118.52 117.66 55.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.904 0.383 . . . . 10.0 111.426 -178.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.71 99.59 2.1 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 110.237 -1.145 . . . . 10.0 110.237 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -88.9 163.71 15.49 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.889 0.329 . . . . 10.0 111.889 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 30.4 mtpt 70.83 38.87 1.12 Allowed 'General case' 0 C--O 1.231 0.096 0 CA-C-N 115.257 -0.883 . . . . 10.0 112.258 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . 0.737 ' HA ' HD11 ' B' ' 84' ' ' ILE . 28.2 p -76.21 2.0 14.37 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.077 -0.511 . . . . 10.0 111.441 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -95.18 -4.58 45.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.458 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 46.7 mt -80.89 139.21 49.87 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.846 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -68.72 -27.81 31.39 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.757 2.305 . . . . 10.0 112.583 -179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 2.1 m -85.07 59.01 5.36 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.388 0.514 . . . . 10.0 112.388 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . 0.664 ' HG3' HD12 ' B' ' 84' ' ' ILE . 36.7 ttm-85 -72.11 100.62 2.57 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.217 -0.66 . . . . 10.0 109.217 178.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.7 m -88.75 -31.54 18.36 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.618 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 25.0 t -102.08 117.59 47.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.051 179.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -79.35 151.34 31.06 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.366 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . 0.493 HG23 ' HE2' ' B' ' 141' ' ' PHE . 6.7 m -56.84 -37.12 70.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.416 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -64.29 -42.24 96.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.86 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -62.04 -47.75 83.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.202 0.525 . . . . 10.0 110.305 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . 0.418 ' HA ' ' CE1' ' B' ' 90' ' ' PHE . . . -62.98 -44.49 95.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.653 -0.703 . . . . 10.0 111.269 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.531 ' HG3' ' HD2' ' B' ' 141' ' ' PHE . 11.0 mt-30 -68.15 -33.1 73.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.539 -0.3 . . . . 10.0 111.427 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.94 -43.0 99.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.392 0.615 . . . . 10.0 109.852 178.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 14.5 tp -67.21 -46.76 72.89 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.476 -0.784 . . . . 10.0 110.014 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.51 -43.06 99.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.833 -0.621 . . . . 10.0 110.844 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -60.59 -34.14 73.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.947 -0.569 . . . . 10.0 110.8 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 20.7 m -73.14 -27.13 61.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.47 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -90.41 -14.52 32.76 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.131 0.491 . . . . 10.0 110.957 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 79.97 32.33 36.49 Favored Glycine 0 N--CA 1.446 -0.661 0 N-CA-C 111.351 -0.699 . . . . 10.0 111.351 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 45.8 pt -127.38 153.98 77.2 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 110.164 -0.31 . . . . 10.0 110.164 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -79.49 157.26 25.33 Favored 'Trans proline' 0 CA--C 1.531 0.351 0 C-N-CA 122.593 2.195 . . . . 10.0 112.408 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.531 ' HD2' ' HG3' ' B' ' 131' ' ' GLN . 36.4 t80 -127.27 126.72 43.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.373 179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 34.4 mm -121.19 124.69 72.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.317 -0.402 . . . . 10.0 110.164 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -86.63 125.44 33.84 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 107.525 -1.287 . . . . 10.0 107.525 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . 0.449 HG22 ' HA3' ' B' ' 151' ' ' GLY . 71.5 p -134.96 173.82 11.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.51 0.93 . . . . 10.0 113.51 -176.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 13.3 t -155.97 108.39 2.62 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.347 -1.297 . . . . 10.0 108.054 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -61.85 -27.07 68.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.275 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -68.69 -41.69 78.82 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.457 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 27.3 p -98.57 -4.83 33.24 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.869 0.322 . . . . 10.0 111.869 -178.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . 0.644 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 26.5 ttt-85 66.33 14.37 9.65 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.904 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.11 116.72 16.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.563 -178.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . 0.449 ' HA3' HG22 ' B' ' 144' ' ' THR . . . 82.53 5.29 89.64 Favored Glycine 0 N--CA 1.452 -0.299 0 N-CA-C 114.517 0.567 . . . . 10.0 114.517 177.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 67.8 t -58.83 -50.71 78.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 117.187 0.494 . . . . 10.0 111.713 -179.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -69.71 -42.33 74.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.789 0.328 . . . . 10.0 110.362 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.52 -45.48 69.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.726 -0.67 . . . . 10.0 112.235 -178.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.84 -50.58 73.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.833 0.349 . . . . 10.0 111.652 -179.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -67.48 -42.49 82.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.264 -0.426 . . . . 10.0 111.609 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -61.99 -40.25 94.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.845 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 46.9 m -66.61 -36.39 82.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.615 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.921 HD22 ' HG ' ' B' ' 79' ' ' LEU . 32.8 tp -60.46 -48.56 81.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.353 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . 0.426 ' HA ' HD12 ' B' ' 163' ' ' ILE . 46.6 t -62.55 -35.83 72.03 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.153 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 22.7 ttm-85 -63.77 -45.32 90.33 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.609 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -63.09 -39.33 94.4 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.997 0.427 . . . . 10.0 110.343 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . 0.452 HG13 ' O ' ' B' ' 159' ' ' LEU . 85.9 mt -61.21 -49.32 85.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.172 179.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -62.51 -46.67 87.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.895 -0.593 . . . . 10.0 111.957 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -59.12 -43.58 91.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.976 0.417 . . . . 10.0 110.937 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 48.5 t-80 -63.92 -40.92 97.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.704 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -66.14 -43.36 87.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.372 -0.376 . . . . 10.0 111.031 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -62.48 -37.3 85.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.034 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 41.4 tttp -65.73 -35.11 79.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.055 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 80.1 mtp -64.81 -23.82 67.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.183 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 1.9 m -75.53 -15.1 60.42 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.376 0.608 . . . . 10.0 109.88 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . 0.434 ' HA ' ' H82' ' A' ' 12' ' ' PCW . 29.1 ttpp -106.92 -54.74 2.42 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.02 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -115.17 109.72 18.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.914 -0.584 . . . . 10.0 109.431 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . -126.84 -112.32 1.77 Allowed Glycine 0 N--CA 1.446 -0.68 0 N-CA-C 111.401 -0.68 . . . . 10.0 111.401 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . 0.535 ' HB3' ' O2 ' ' A' ' 34' ' ' 17F . 27.0 tptt -78.14 111.46 14.09 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -140.37 132.6 28.16 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.458 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -144.49 -176.98 5.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.062 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -60.58 133.08 55.75 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.586 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . 0.71 ' NZ ' HN1A ' A' ' 34' ' ' 17F . 18.2 ptpt -158.1 177.28 11.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.669 -0.696 . . . . 10.0 109.816 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 51.0 tttm 70.78 -73.29 0.1 Allowed 'General case' 0 N--CA 1.467 0.408 0 O-C-N 123.738 0.649 . . . . 10.0 112.232 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 1.5 m -79.39 92.77 5.24 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.966 0.412 . . . . 10.0 110.399 -179.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . 0.537 ' HD2' ' H41' ' A' ' 18' ' ' PCW . 19.7 mttm -66.57 -52.17 48.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.516 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 57.29 39.34 28.61 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.186 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 28.7 mmtp 55.94 80.5 0.14 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.293 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 45.2 m . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.948 -179.465 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.506 0 N-CA-C 112.291 -0.323 . . . . 10.0 112.291 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 809' ' ' THR . . . . . 0.823 HG21 HD11 ' B' ' 36' ' ' ILE . 1.5 p -132.91 164.82 26.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.461 0.172 . . . . 10.0 110.593 -179.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 810' ' ' VAL . . . . . 0.606 HG23 HG22 ' D' ' 824' ' ' VAL . 91.5 t -118.64 123.23 71.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 120.756 0.312 . . . . 10.0 110.488 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 811' ' ' LYS . . . . . 0.737 ' HE3' ' HG3' ' D' ' 819' ' ' ARG . 72.5 tttt -87.95 107.88 18.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.278 -0.419 . . . . 10.0 109.883 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 43.5 t -94.9 129.33 45.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.477 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 813' ' ' TYR . . . . . 0.498 ' CZ ' ' H63' ' A' ' 4' ' ' PCW . 81.0 m-85 -96.3 136.24 37.04 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.61 179.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 58.4 mt -107.32 153.23 41.3 Favored Pre-proline 0 C--N 1.319 -0.73 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.155 -178.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 815' ' ' PRO . . . . . 0.747 ' HD3' ' HB ' ' D' ' 877' ' ' VAL . 72.4 Cg_endo -74.82 56.64 4.2 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.929 2.419 . . . . 10.0 111.111 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 816' ' ' ASN . . . . . 0.411 HD22 ' HA ' ' D' ' 816' ' ' ASN . 0.2 OUTLIER -157.2 32.6 0.29 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.227 -0.897 . . . . 10.0 109.998 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D ' 817' ' ' LYS . . . . . 0.639 ' HA ' ' O2 ' ' A' ' 33' ' ' 17F . 9.8 ttpt 58.29 28.31 16.49 Favored 'General case' 0 CA--C 1.529 0.163 0 O-C-N 123.788 0.68 . . . . 10.0 110.311 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 818' ' ' GLN . . . . . 0.408 ' NE2' ' HB2' ' B' ' 39' ' ' SER . 79.3 mt-30 -138.44 -177.58 4.91 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 114.421 1.267 . . . . 10.0 114.421 -177.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 819' ' ' ARG . . . . . 0.737 ' HG3' ' HE3' ' D' ' 811' ' ' LYS . 0.0 OUTLIER -151.88 171.11 18.28 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.01 -0.996 . . . . 10.0 112.01 -177.634 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 14.6 t -152.22 138.81 18.69 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 107.449 -1.315 . . . . 10.0 107.449 178.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 821' ' ' VAL . . . . . 0.555 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 4.0 t -104.53 114.2 43.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 120.059 -0.656 . . . . 10.0 111.553 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 35.2 m -103.31 162.38 4.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.761 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 5.2 m -96.23 140.4 30.97 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.532 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 824' ' ' VAL . . . . . 0.606 HG22 HG23 ' D' ' 810' ' ' VAL . 6.4 t -68.17 121.65 17.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 110.132 -0.322 . . . . 10.0 110.132 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -126.34 113.01 16.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.451 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -67.27 145.55 55.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.285 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 90.29 -38.99 3.14 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.827 -0.701 . . . . 10.0 112.08 -179.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 57.6 ttm -68.39 144.82 54.6 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.651 0.262 . . . . 10.0 110.702 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 829' ' ' SER . . . . . 0.667 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.0 OUTLIER -99.77 162.8 12.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.556 -0.293 . . . . 10.0 111.279 -179.838 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D ' 830' ' ' VAL . . . . . 0.509 ' O ' ' HB2' ' D' ' 834' ' ' LEU . 86.0 t -55.17 -41.51 60.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.186 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 831' ' ' TYR . . . . . 0.488 ' O ' ' HB2' ' D' ' 835' ' ' ASP . 67.5 t80 -56.35 -32.99 65.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.941 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -75.87 -57.49 3.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.502 -0.317 . . . . 10.0 111.634 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.44 -42.72 99.66 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.688 -179.106 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 834' ' ' LEU . . . . . 0.548 ' HG ' HG21 ' D' ' 850' ' ' VAL . 2.2 mm? -74.24 -17.78 60.83 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 113.089 0.774 . . . . 10.0 113.089 -179.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 835' ' ' ASP . . . . . 0.488 ' HB2' ' O ' ' D' ' 831' ' ' TYR . 28.0 t70 -61.71 -50.12 73.73 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.641 -0.424 . . . . 10.0 109.973 179.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 35.4 tttt -68.46 -26.96 65.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.648 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 837' ' ' ALA . . . . . 0.435 ' HB3' HD13 ' D' ' 834' ' ' LEU . . . -77.22 -22.27 52.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.07 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 838' ' ' LEU . . . . . 0.65 HD21 HG11 ' D' ' 877' ' ' VAL . 37.3 mt -94.52 -43.85 8.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.044 0.449 . . . . 10.0 110.452 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -63.91 -18.39 64.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.857 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 840' ' ' VAL . . . . . 0.659 HG22 ' CE2' ' B' ' 40' ' ' TYR . 3.2 p -52.69 -22.96 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 O-C-N 123.801 0.688 . . . . 10.0 112.321 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 841' ' ' ARG . . . . . . . . . . . . . 15.9 ptp180 -139.15 17.09 2.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.01 0.433 . . . . 10.0 111.809 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 82.05 35.89 19.95 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.955 -0.641 . . . . 10.0 114.592 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 98.7 mt -99.78 149.64 23.15 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 117.427 0.614 . . . . 10.0 110.326 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -119.53 148.55 43.16 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.04 0.448 . . . . 10.0 111.661 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -67.29 -9.1 37.43 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.454 -0.794 . . . . 10.0 112.835 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -94.87 -2.55 50.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.026 0.441 . . . . 10.0 111.901 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 91.3 m -129.17 5.16 5.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.237 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 67.5 m -142.84 147.83 36.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.697 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 12.8 p -130.01 151.05 35.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 850' ' ' VAL . . . . . 0.548 HG21 ' HG ' ' D' ' 834' ' ' LEU . 17.4 t -108.07 134.06 51.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.059 0.456 . . . . 10.0 111.764 -179.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 851' ' ' TYR . . . . . 0.777 ' HE1' ' HB3' ' D' ' 878' ' ' GLU . 91.8 m-85 -109.22 141.97 40.72 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.816 -0.629 . . . . 10.0 109.721 178.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 852' ' ' ARG . . . . . 0.719 ' HD2' HD11 ' D' ' 870' ' ' LEU . 31.7 mtm-85 -98.67 135.12 40.63 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.968 -0.752 . . . . 10.0 108.968 178.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 853' ' ' LEU . . . . . 0.428 ' HG ' HD11 ' D' ' 876' ' ' ILE . 1.7 mt -82.25 81.39 8.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.92 0.39 . . . . 10.0 111.702 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 37.7 mt -88.08 87.78 2.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.549 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 855' ' ' LYS . . . . . 0.464 ' HA ' ' HD3' ' D' ' 855' ' ' LYS . 23.0 mmtt 50.83 55.89 8.84 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.438 0.903 . . . . 10.0 113.438 179.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 86.53 -0.77 87.05 Favored Glycine 0 CA--C 1.518 0.255 0 C-N-CA 120.84 -0.695 . . . . 10.0 114.116 178.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 857' ' ' ARG . . . . . 1.006 HH12 ' H20' ' A' ' 7' ' ' PCW . 29.6 mmt180 -115.11 135.76 53.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 117.406 0.603 . . . . 10.0 111.011 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 858' ' ' LYS . . . . . 0.735 ' HE2' HD13 ' D' ' 876' ' ' ILE . 94.5 mttt -92.92 99.69 12.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.528 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 4.5 m -98.34 134.0 41.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.702 -0.226 . . . . 10.0 110.744 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 43.0 t -66.19 130.5 31.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.643 0.258 . . . . 10.0 110.845 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 861' ' ' THR . . . . . 0.41 ' HB ' ' HG3' ' D' ' 852' ' ' ARG . 1.8 t -108.12 153.05 23.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.857 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 862' ' ' ALA . . . . . 0.463 ' HB3' ' OG1' ' D' ' 865' ' ' THR . . . -88.53 149.84 23.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.155 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 863' ' ' TRP . . . . . 0.505 ' HZ3' ' HB3' ' D' ' 834' ' ' LEU . 99.8 m95 -73.5 -30.06 62.89 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.655 0.613 . . . . 10.0 112.655 -179.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -80.3 -10.65 59.76 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.821 0.675 . . . . 10.0 112.821 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 865' ' ' THR . . . . . 0.463 ' OG1' ' HB3' ' D' ' 862' ' ' ALA . 5.3 m -67.89 143.79 55.55 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.15 -0.315 . . . . 10.0 110.15 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 866' ' ' ALA . . . . . 0.667 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -74.93 149.56 39.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.74 0.305 . . . . 10.0 110.684 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 867' ' ' ILE . . . . . 0.441 ' HA ' HD23 ' D' ' 870' ' ' LEU . 7.9 tp -88.16 2.62 5.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.615 0.721 . . . . 10.0 110.498 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -63.53 -51.54 66.18 Favored Pre-proline 0 CA--C 1.539 0.543 0 N-CA-C 113.162 0.801 . . . . 10.0 113.162 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -76.53 14.44 1.21 Allowed 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.162 1.908 . . . . 10.0 112.961 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 870' ' ' LEU . . . . . 0.719 HD11 ' HD2' ' D' ' 852' ' ' ARG . 3.9 mm? -98.18 33.0 2.28 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.368 0.604 . . . . 10.0 110.761 179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -72.41 116.55 13.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.809 -0.632 . . . . 10.0 111.2 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 73.52 32.0 60.18 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 121.039 -0.6 . . . . 10.0 112.5 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -119.89 152.85 36.72 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.19 -0.3 . . . . 10.0 110.19 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -108.69 135.18 50.36 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.007 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 77.3 mt -113.55 127.47 56.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.55 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 876' ' ' ILE . . . . . 0.735 HD13 ' HE2' ' D' ' 858' ' ' LYS . 6.3 mt -118.4 117.63 55.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.107 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 877' ' ' VAL . . . . . 0.747 ' HB ' ' HD3' ' D' ' 815' ' ' PRO . 12.9 t -87.89 137.69 20.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 109.96 -0.385 . . . . 10.0 109.96 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 878' ' ' GLU . . . . . 0.777 ' HB3' ' HE1' ' D' ' 851' ' ' TYR . 37.5 tt0 -135.0 154.98 51.54 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.371 -0.603 . . . . 10.0 109.371 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 10.3 m -80.56 153.58 4.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 116.537 -0.302 . . . . 10.0 110.291 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 50.8 mt . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.365 -0.826 . . . . 10.0 110.863 -179.85 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PCW . . . . . 0.67 ' H2 ' H18A ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PCW . . . . . 0.713 H331 H421 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PCW . . . . . 0.776 H321 H322 ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PCW . . . . . 0.566 H162 H222 ' A' ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PCW . . . . . 0.633 H211 H152 ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PCW . . . . . 0.616 H351 H341 ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PCW . . . . . 1.006 ' H20' HH12 ' D' ' 857' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PCW . . . . . 0.66 H411 H251 ' A' ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PCW . . . . . 0.659 ' H81' ' O2P' ' A' ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PCW . . . . . 0.501 ' H31' H411 ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PCW . . . . . 0.706 H442 H241 ' A' ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PCW . . . . . 0.589 H151 H372 ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PCW . . . . . 0.574 ' H31' ' H8A' ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PCW . . . . . 0.496 H412 ' H12' ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PCW . . . . . 0.616 H341 H351 ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PCW . . . . . 0.713 H421 H331 ' A' ' 2' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PCW . . . . . 0.776 H322 H321 ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PCW . . . . . 0.594 ' H2 ' ' H81' ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PCW . . . . . 0.539 H361 H122 ' A' ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PCW . . . . . 0.666 H442 H251 ' A' ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PCW . . . . . 0.589 H372 H151 ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PCW . . . . . 0.867 ' H32' ' H63' ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PCW . . . . . 0.523 H271 H261 ' A' ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PCW . . . . . 0.54 H162 H331 ' A' ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PCW . . . . . 0.546 H162 H442 ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PCW . . . . . 0.66 H251 H411 ' A' ' 8' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PCW . . . . . 0.549 ' H2 ' ' H41' ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PCW . . . . . 0.473 ' H2 ' ' H41' ' A' ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PCW . . . . . 0.659 ' O2P' ' H81' ' A' ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PCW . . . . . 0.54 H331 H162 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PCW . . . . . 0.566 H222 H162 ' A' ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' 17F . . . . . 0.639 ' O2 ' ' HA ' ' D' ' 817' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' 17F . . . . . 0.867 ' H63' ' H32' ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' 17F . . . . . 0.67 H18A ' H2 ' ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' 17F . . . . . 0.582 ' H61' H472 ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' 17F . . . . . 0.574 ' H8A' ' H31' ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' 17F . . . . . 0.673 ' H1A' HE22 ' B' ' 43' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' 17F . . . . . 0.545 ' H2 ' ' H82' ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' 17F . . . . . 0.665 ' H71' ' H37' ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PCW . . . . . 0.508 H482 H261 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PCW . . . . . 0.799 ' H39' H451 ' A' ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PCW . . . . . 0.577 H451 H152 ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PCW . . . . . 0.741 H121 ' H6 ' ' A' ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PCW . . . . . 0.637 H371 ' H32' ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PCW . . . . . 0.518 ' O3P' H372 ' A' ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PCW . . . . . 0.492 ' H71' ' O1P' ' A' ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PCW . . . . . 0.745 H321 H131 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PCW . . . . . 0.829 H122 H361 ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PCW . . . . . 0.482 ' H31' ' H4 ' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PCW . . . . . 0.666 H251 H442 ' A' ' 21' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PCW . . . . . 0.623 H181 H122 ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PCW . . . . . 0.692 H421 H481 ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PCW . . . . . 0.745 H131 H321 ' A' ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PCW . . . . . 0.566 ' H63' ' H32' ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PCW . . . . . 0.614 H332 H131 ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PCW . . . . . 0.829 H361 H122 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PCW . . . . . 0.699 H151 H472 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PCW . . . . . 0.684 H231 ' H44' ' A' ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' PCW . . . . . 0.79 H381 H152 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PCW . . . . . 0.699 H472 H151 ' A' ' 58' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PCW . . . . . 0.831 H431 ' H47' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PCW . . . . . 0.706 H241 H442 ' A' ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PCW . . . . . 0.692 H481 H421 ' A' ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PCW . . . . . 0.687 H142 H18A ' A' ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PCW . . . . . 0.635 ' H20' ' H82' ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PCW . . . . . 0.635 ' H82' ' H20' ' A' ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PCW . . . . . 0.584 H371 H242 ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PCW . . . . . 0.799 H451 ' H39' ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PCW . . . . . 0.702 ' H19' ' H63' ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PCW . . . . . 0.518 H372 ' O3P' ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PCW . . . . . 0.674 H322 H361 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' 17F . . . . . 0.602 ' H8A' ' H32' ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' 17F . . . . . 0.577 ' H45' ' H39' ' A' ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' 17F . . . . . 0.577 ' H39' ' H45' ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' 17F . . . . . 0.65 ' H70' ' HB3' ' C' ' 470' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' 17F . . . . . 0.741 ' H6 ' H121 ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' 17F . . . . . 0.831 ' H47' H431 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' 17F . . . . . 0.437 H18A ' H2 ' ' A' ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' 17F . . . . . 0.687 H18A H142 ' A' ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 201' ' ' GNP . . . . . 0.43 H5'2 ' HA ' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 96.2 mt . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.823 0.344 . . . . 10.0 110.649 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . 0.472 ' HB2' ' HZ3' ' A' ' 202' ' ' LYS . 0.0 OUTLIER -66.03 -29.55 69.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.461 0.648 . . . . 10.0 110.13 179.761 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 96.6 mt -75.97 -30.45 58.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.47 -0.786 . . . . 10.0 110.115 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 86.1 mt -66.59 -47.66 72.01 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.078 -0.51 . . . . 10.0 109.835 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.98 -44.55 92.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.068 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . 0.803 HD21 HD21 ' C' ' 569' ' ' LEU . 3.6 m120 -63.0 -40.2 97.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.66 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 1.6 m95 -67.01 -29.12 68.86 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.846 -0.342 . . . . 10.0 110.716 179.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.78 -44.61 85.27 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 108.787 -0.819 . . . . 10.0 108.787 178.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.67 -35.39 77.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.835 178.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 206' ' ' ASN . 82.5 t -69.13 -39.87 79.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 109.341 -0.615 . . . . 10.0 109.341 178.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 45.5 m -62.64 -46.8 86.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.082 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 2.0 p -64.73 -29.81 70.81 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.301 0.572 . . . . 10.0 109.909 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 92.1 m -69.8 -45.16 68.54 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -62.21 -42.17 99.05 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 109.61 -0.515 . . . . 10.0 109.61 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 58.2 m -59.97 -47.8 84.32 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.735 -0.666 . . . . 10.0 109.872 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . 0.415 ' HG2' ' HB ' ' C' ' 557' ' ' THR . 5.5 tptt -64.71 -36.67 85.03 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.43 179.415 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 40.7 mt -62.84 -46.47 87.75 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 109.485 -0.561 . . . . 10.0 109.485 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -62.9 -42.49 99.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.086 0.469 . . . . 10.0 110.209 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.429 ' O ' ' HD2' ' A' ' 223' ' ' PRO . 42.6 mt-10 -63.78 -38.05 89.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.492 -0.776 . . . . 10.0 111.23 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.22 -35.49 48.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.724 178.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . 0.48 ' HA ' ' HB ' ' A' ' 224' ' ' VAL . 25.6 mt -64.09 -27.48 69.12 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.175 -0.466 . . . . 10.0 111.086 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -54.71 -69.04 1.37 Allowed Glycine 0 C--N 1.33 0.238 0 N-CA-C 110.997 -0.841 . . . . 10.0 110.997 178.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . 0.429 ' HD2' ' O ' ' A' ' 219' ' ' GLU . 11.1 Cg_endo -58.27 -33.6 97.79 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.587 2.191 . . . . 10.0 110.91 177.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . 0.512 ' O ' ' HB2' ' A' ' 228' ' ' PHE . 6.0 t -59.37 -45.37 93.46 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.257 0 CA-C-O 120.656 0.265 . . . . 10.0 110.293 179.05 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 24.0 m -64.54 -37.95 89.34 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.626 -0.509 . . . . 10.0 109.626 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -66.84 -48.53 68.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.019 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 79.7 mt-10 -65.33 -42.14 93.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.232 179.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . 0.512 ' HB2' ' O ' ' A' ' 224' ' ' VAL . 0.1 OUTLIER -61.54 -49.28 77.32 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.763 -0.458 . . . . 10.0 109.763 178.665 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . 0.561 ' CE3' ' HA ' ' A' ' 229' ' ' TRP . 0.5 OUTLIER -64.47 -38.78 92.2 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.569 179.263 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -59.78 -50.64 73.02 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.598 -0.519 . . . . 10.0 109.598 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . 0.675 ' HA ' ' HE2' ' A' ' 234' ' ' LYS . 58.6 m-80 -66.01 -40.36 91.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.795 179.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 65.4 mt -66.91 -36.62 82.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.513 -0.312 . . . . 10.0 111.235 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -67.14 -43.6 81.93 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . 0.675 ' HE2' ' HA ' ' A' ' 231' ' ' ASN . 31.7 mtmt -65.92 -37.51 86.26 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.046 -0.724 . . . . 10.0 109.046 178.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 231' ' ' ASN . 2.0 tt0 -63.51 -53.43 52.08 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.404 -0.816 . . . . 10.0 109.33 178.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . 0.48 ' HA ' ' HB2' ' A' ' 239' ' ' LEU . 14.6 p -66.04 -25.83 67.23 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.521 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -64.92 -49.28 71.02 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 107.996 -1.113 . . . . 10.0 107.996 177.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -65.41 -46.84 84.14 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 109.319 -1.513 . . . . 10.0 109.319 177.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . 0.593 ' O ' ' HB2' ' A' ' 243' ' ' MET . 85.5 mt -56.53 -36.03 68.76 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.648 -0.276 . . . . 10.0 111.172 178.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 29.8 mtm180 -70.65 -42.0 71.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.995 0.426 . . . . 10.0 110.818 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -71.04 -32.93 69.8 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.459 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . 0.811 ' HB3' HH21 ' C' ' 532' ' ' ARG . 20.2 mt-10 -80.64 -41.98 22.93 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.712 -0.677 . . . . 10.0 111.011 179.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . 0.593 ' HB2' ' O ' ' A' ' 239' ' ' LEU . 1.6 mmm -63.24 -33.49 75.61 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.62 0.248 . . . . 10.0 111.176 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.8 p -65.36 -41.53 93.75 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.106 -0.701 . . . . 10.0 109.106 178.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -71.44 -43.96 65.72 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.7 -0.852 . . . . 10.0 108.7 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . 0.483 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.2 OUTLIER -53.77 -57.69 9.95 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.419 -0.81 . . . . 10.0 109.564 178.926 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 47.1 mt -60.33 -44.74 95.21 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.738 -0.665 . . . . 10.0 111.459 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -59.78 -52.32 65.97 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.475 0.178 . . . . 10.0 111.319 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -63.1 -45.66 91.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.365 -0.38 . . . . 10.0 110.389 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . 0.705 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 36.1 t -61.92 -44.33 98.73 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.399 0 CA-C-N 116.447 -0.342 . . . . 10.0 111.455 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.451 ' O ' HG12 ' A' ' 254' ' ' VAL . 95.7 mttt -70.54 -48.02 57.52 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.811 0.3 . . . . 10.0 111.811 -179.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -60.52 -40.61 92.06 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.913 0.387 . . . . 10.0 110.829 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt -82.55 -22.33 34.99 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.156 -0.474 . . . . 10.0 111.719 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.705 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -64.91 -26.08 39.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 C-N-CA 121.152 -0.219 . . . . 10.0 110.842 179.904 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . 0.506 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 20.5 mt-30 -63.08 -61.62 7.06 Favored Pre-proline 0 CA--C 1.531 0.225 0 CA-C-N 116.257 -0.429 . . . . 10.0 109.865 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . 0.506 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 18.7 Cg_endo -62.32 -30.56 81.15 Favored 'Trans proline' 0 C--N 1.359 1.092 0 C-N-CA 121.778 1.652 . . . . 10.0 110.96 177.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . 0.422 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 6.8 m-30 -61.74 -54.21 45.62 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.225 0.536 . . . . 10.0 109.7 178.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 79.6 mt -67.95 -46.32 71.75 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 115.397 -0.82 . . . . 10.0 111.207 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -60.18 -39.77 87.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.822 0.344 . . . . 10.0 111.766 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -62.07 -50.63 71.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.112 0.482 . . . . 10.0 110.021 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . 0.405 ' O ' ' HB2' ' A' ' 265' ' ' TRP . 14.3 m-85 -69.71 -30.38 68.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.819 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -66.15 -48.08 71.95 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.582 179.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 11.4 mtmt -59.21 -43.08 92.28 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.206 -0.665 . . . . 10.0 109.206 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.436 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 16.6 mttt -65.64 -46.39 79.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.234 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . 0.405 ' HB2' ' O ' ' A' ' 261' ' ' PHE . 0.0 OUTLIER -60.73 -34.61 74.66 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.535 -0.302 . . . . 10.0 110.404 179.386 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -65.17 -49.3 70.35 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.058 -0.719 . . . . 10.0 109.058 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -61.7 -41.77 98.03 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . 0.518 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 41.3 mt-10 -61.68 -46.63 88.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.767 179.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 5.6 mmt -65.05 -43.87 90.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.652 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . 0.521 ' O ' ' HB2' ' A' ' 274' ' ' GLN . 79.8 mt-10 -62.01 -48.6 79.59 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.738 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 66.3 mt -66.61 -35.1 79.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.667 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . 0.518 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 2.2 t80 -63.43 -52.34 61.9 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 273' ' ' ARG . 46.6 mtt180 -63.12 -39.52 94.94 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . 0.521 ' HB2' ' O ' ' A' ' 270' ' ' GLU . 3.1 tt0 -56.55 -32.93 65.64 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.472 -0.786 . . . . 10.0 110.096 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.615 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 59.0 mttp -90.0 -35.23 15.64 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.478 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . 0.423 ' HB ' ' HA ' ' A' ' 273' ' ' ARG . 7.6 t -54.45 -40.5 49.49 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.168 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . 0.494 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 35.5 mt-10 -57.58 -63.29 3.95 Favored Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 111.966 0.358 . . . . 10.0 111.966 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . 0.554 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 23.6 Cg_endo -63.42 -37.23 50.46 Favored 'Trans proline' 0 C--N 1.357 1.018 0 C-N-CA 121.956 1.77 . . . . 10.0 111.798 178.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.689 HD22 ' HG2' ' C' ' 495' ' ' LYS . 29.4 mt -65.69 -36.55 83.97 Favored 'General case' 0 C--N 1.334 -0.088 0 C-N-CA 121.052 -0.259 . . . . 10.0 110.676 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -71.53 -34.67 70.26 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.124 -1.065 . . . . 10.0 108.124 178.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -63.83 -41.91 97.75 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.38 -0.97 . . . . 10.0 108.38 177.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 35.5 mt-10 -61.22 -46.19 91.45 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.064 -0.717 . . . . 10.0 109.064 177.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 97.0 mt -60.9 -43.62 98.26 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.163 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -63.03 -53.49 52.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.172 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -57.95 -51.12 70.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.287 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -60.53 -46.4 94.47 Favored Glycine 0 N--CA 1.443 -0.837 0 CA-C-N 115.604 -0.726 . . . . 10.0 112.248 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.96 -38.76 89.73 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.644 0.222 . . . . 10.0 110.573 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . 0.685 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 88.0 mtt180 -59.25 -42.97 92.35 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 178.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . 0.448 ' O ' ' HG2' ' A' ' 293' ' ' GLU . 38.9 mt-30 -71.87 -55.6 7.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.614 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . 0.511 ' HE3' ' OE1' ' C' ' 487' ' ' GLN . 34.4 mttt -54.87 -46.6 74.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.922 -0.581 . . . . 10.0 111.957 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . 0.671 HD23 HD12 ' A' ' 294' ' ' LEU . 78.4 mt -70.8 -32.37 69.43 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 121.259 -0.176 . . . . 10.0 111.023 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . 0.685 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 0.3 OUTLIER -65.25 -41.51 94.23 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.82 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 289' ' ' GLN . 21.5 mm-40 -64.44 -35.15 79.99 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.852 -0.796 . . . . 10.0 108.852 178.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . 0.671 HD12 HD23 ' A' ' 291' ' ' LEU . 79.2 mt -68.43 -38.54 81.3 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.585 -0.734 . . . . 10.0 109.923 178.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -63.18 -37.75 88.47 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.217 -0.661 . . . . 10.0 109.217 178.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -72.23 5.65 2.7 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.094 -0.957 . . . . 10.0 111.117 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . 0.52 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 39.9 mttp -125.02 -36.55 2.53 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.254 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . 0.441 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 76.8 mt -60.53 -41.81 95.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.399 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . 0.824 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 19.5 m -81.38 -64.38 0.28 Allowed Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . 0.824 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 53.5 Cg_exo -55.7 -58.35 1.15 Allowed 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 122.306 2.004 . . . . 10.0 112.853 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.52 ' HB2' ' O ' ' A' ' 297' ' ' LYS . 81.3 mt -67.36 -31.16 71.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.699 0.285 . . . . 10.0 110.673 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . 0.441 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -65.95 -44.7 91.21 Favored Glycine 0 N--CA 1.449 -0.479 0 N-CA-C 111.334 -0.706 . . . . 10.0 111.334 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -60.63 -37.79 82.63 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 300' ' ' PRO . 93.7 mt-10 -64.25 -44.9 90.35 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 178.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 5.6 tpt -62.96 -42.97 99.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.222 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 94.6 mtt180 -64.56 -38.13 89.94 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 109.122 -0.696 . . . . 10.0 109.122 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . 0.57 ' HA ' ' CD ' ' A' ' 310' ' ' ARG . 33.2 t70 -66.56 -43.66 84.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.196 179.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . 0.802 ' HG3' HD11 ' C' ' 469' ' ' LEU . 11.3 mmt180 -68.76 -26.75 65.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.736 -0.665 . . . . 10.0 109.361 178.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . 0.551 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -69.97 -32.0 70.0 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 177.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . 0.57 ' CD ' ' HA ' ' A' ' 307' ' ' ASP . 15.6 mtp180 -62.89 -46.4 88.0 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 107.906 -1.146 . . . . 10.0 107.906 178.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -66.85 -41.11 87.91 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.434 -0.803 . . . . 10.0 109.633 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . 0.558 ' HA ' ' HD3' ' C' ' 462' ' ' LYS . 0.7 OUTLIER -56.14 -49.1 74.9 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.123 178.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 97.2 t -73.91 -39.76 52.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 115.762 -0.653 . . . . 10.0 111.419 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . 0.428 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 0.7 OUTLIER -60.87 -42.88 98.76 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.249 0.547 . . . . 10.0 110.232 179.717 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . 0.57 ' O ' ' HB2' ' A' ' 319' ' ' HIS . . . -65.1 -33.39 75.91 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.212 178.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . 0.432 HD11 H281 ' A' ' 27' ' ' PCW . 40.5 mt -71.15 -37.66 72.23 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.712 178.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 81.1 mtt180 -61.02 -53.41 57.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.138 0.494 . . . . 10.0 110.207 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.98 2.69 6.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.337 -0.847 . . . . 10.0 112.245 -179.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . 0.57 ' HB2' ' O ' ' A' ' 315' ' ' ALA . 0.1 OUTLIER -117.42 -51.64 2.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.65 0.262 . . . . 10.0 110.771 179.793 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 91.5 mt -65.04 -35.82 82.4 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.374 -0.375 . . . . 10.0 111.547 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -57.19 -60.4 9.78 Favored Pre-proline 0 CA--C 1.536 0.432 0 C-N-CA 121.138 -0.225 . . . . 10.0 111.316 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -65.0 -33.36 51.51 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 121.603 1.535 . . . . 10.0 111.214 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -62.25 -50.58 71.17 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-N 116.594 -0.276 . . . . 10.0 110.866 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . 0.441 ' HA ' HD12 ' A' ' 327' ' ' LEU . 21.1 p -68.8 -34.25 75.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.356 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -66.03 -41.01 91.5 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . 0.401 ' CD ' ' HZ1' ' C' ' 451' ' ' LYS . 27.4 mt-10 -68.87 -36.0 77.58 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.315 -0.995 . . . . 10.0 108.315 177.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . 0.441 HD12 ' HA ' ' A' ' 324' ' ' SER . 29.3 mt -60.72 -35.05 75.36 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 109.302 -0.629 . . . . 10.0 109.302 178.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 -63.56 -40.81 97.95 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.941 -0.763 . . . . 10.0 108.941 178.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -70.22 -41.98 72.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.027 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . 0.469 ' HA ' ' HE3' ' C' ' 443' ' ' LYS . 13.6 mtp180 -63.89 -45.75 87.95 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.8 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 64.6 mt -65.85 -37.56 86.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.1 179.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.9 -46.73 88.09 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -60.83 -44.98 96.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.956 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 20.5 mtt180 -62.86 -47.73 82.1 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.144 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . 0.491 ' O ' ' HB2' ' A' ' 339' ' ' LYS . 68.1 mt -64.39 -33.82 76.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 10.0 111.432 -179.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -69.81 -44.05 70.81 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.913 -0.403 . . . . 10.0 109.913 178.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.73 -44.33 77.86 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 71.0 mt -66.09 -20.89 66.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.765 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 335' ' ' LEU . 31.0 tttt -75.58 -49.06 19.71 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 178.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -67.59 -39.06 84.83 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . 0.859 HD21 ' HA ' ' C' ' 433' ' ' GLU . 36.3 t-20 -67.22 -42.61 83.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.285 -0.87 . . . . 10.0 108.921 178.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -62.16 -42.94 99.73 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.564 -0.744 . . . . 10.0 111.566 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.93 -40.75 97.28 Favored Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 110.445 -1.062 . . . . 10.0 110.445 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -67.78 -42.85 81.02 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 178.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 23.5 mtt180 -62.86 -43.54 98.54 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.736 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 13.5 mt -65.02 -46.64 80.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.504 -0.317 . . . . 10.0 110.861 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.02 -43.99 97.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.036 0.446 . . . . 10.0 110.105 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . 0.409 ' HB3' ' HE2' ' A' ' 352' ' ' LYS . 17.6 mt-10 -67.09 -47.48 71.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.142 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -62.05 -33.48 74.46 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 121.115 -0.234 . . . . 10.0 110.445 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.22 -40.84 86.46 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.818 -0.808 . . . . 10.0 108.818 178.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . 0.572 ' O ' ' HG2' ' A' ' 355' ' ' GLU . . . -66.13 -46.16 78.49 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.426 178.492 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . 0.409 ' HE2' ' HB3' ' A' ' 348' ' ' GLU . 19.4 mttm -63.3 -29.51 70.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.761 -0.654 . . . . 10.0 109.946 178.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -66.95 -46.37 74.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.988 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.8 -37.17 85.65 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 121.015 0.436 . . . . 10.0 109.891 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' ' 351' ' ' ALA . 20.3 mm-40 -67.74 -41.54 83.25 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -60.63 -48.29 82.45 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 108.841 -0.8 . . . . 10.0 108.841 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 84.3 mt -59.62 -37.81 79.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.986 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 53.9 m -61.87 -56.78 15.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.231 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 17.8 m -63.17 -35.35 79.99 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.41 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 19.7 mt -65.89 -36.4 83.31 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.453 -0.34 . . . . 10.0 110.24 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 70.2 m -65.76 -31.53 72.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.095 0.474 . . . . 10.0 110.524 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -73.93 -8.16 55.05 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 121.377 0.608 . . . . 10.0 109.928 179.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' A' ' 367' ' ' ALA . 44.7 mttm -107.93 -38.31 5.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.104 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.74 -26.01 63.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.564 -0.743 . . . . 10.0 111.897 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.793 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 58.1 mttp -106.46 -74.29 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 112.794 0.664 . . . . 10.0 112.794 179.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.793 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 52.2 Cg_exo -56.91 -53.17 5.36 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 122.115 1.876 . . . . 10.0 113.175 -178.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . 0.459 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -61.56 -43.77 98.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.674 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . 0.485 HD23 ' HA ' ' A' ' 368' ' ' LEU . 6.5 mt -65.57 -36.26 83.26 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.979 -0.288 . . . . 10.0 110.791 179.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . 0.551 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 19.6 mt-10 -63.36 -41.4 98.84 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.188 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.88 -39.84 94.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.352 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . 0.405 HD12 HD23 ' A' ' 368' ' ' LEU . 84.9 mt -65.63 -40.73 92.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.406 178.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -67.28 -40.78 86.17 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.551 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.7 mt-30 -66.2 -26.73 67.53 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.22 -0.9 . . . . 20.0 111.222 178.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -81.67 -40.3 11.03 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 109.261 -1.536 . . . . 10.0 109.261 178.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 14.2 mt -61.55 -31.65 71.69 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.963 0.357 . . . . 10.0 111.963 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . 0.478 ' HB2' ' HD3' ' A' ' 377' ' ' PRO . 38.3 mt -54.55 -64.62 1.81 Allowed Pre-proline 0 CA--C 1.537 0.479 0 O-C-N 122.969 0.168 . . . . 10.0 111.027 179.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' A' ' 376' ' ' LEU . 40.9 Cg_endo -69.26 -32.45 20.64 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.866 1.711 . . . . 10.0 111.364 178.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 3.9 t -59.38 -49.11 84.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.721 -0.218 . . . . 10.0 110.453 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 37.1 mt -63.92 -31.82 73.13 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.179 -0.464 . . . . 10.0 109.92 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . 0.439 ' O ' HG23 ' A' ' 384' ' ' VAL . 11.8 mt-10 -67.41 -50.91 57.46 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 1.2 p -59.99 -34.86 73.9 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 120.952 0.406 . . . . 10.0 110.06 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 5.9 m-30 -69.71 -44.7 69.84 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 115.892 -0.594 . . . . 10.0 110.043 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -61.81 -42.46 99.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.491 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 380' ' ' GLU . 74.7 t -59.58 -43.31 90.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.745 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.4 p -75.04 -37.87 61.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.582 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 14.3 m-30 -66.42 -44.21 83.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.691 0.282 . . . . 10.0 110.489 179.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.485 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 51.5 mt -59.17 -43.07 92.12 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.549 179.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 1.8 p -71.33 -46.63 60.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.229 -0.442 . . . . 10.0 110.769 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -56.66 -41.15 76.74 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.143 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 58.4 mt -59.33 -41.53 89.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.016 0.436 . . . . 10.0 110.378 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 17.8 mt-10 -71.78 -37.91 70.38 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . 0.558 ' HG3' ' HZ3' ' A' ' 396' ' ' LYS . 0.4 OUTLIER -55.78 -46.16 78.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.442 178.831 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -65.59 -44.37 86.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.112 0.482 . . . . 10.0 110.432 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 55.8 m -60.17 -45.14 94.11 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.641 -0.709 . . . . 10.0 111.81 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 30.1 mtmt -69.06 -7.12 32.74 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.678 0.622 . . . . 10.0 112.678 -178.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . 0.558 ' HZ3' ' HG3' ' A' ' 392' ' ' GLU . 42.7 mttp -106.03 -38.74 6.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.793 0.33 . . . . 10.0 111.441 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 83.5 mt -76.6 -22.48 54.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.439 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 45.5 t30 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.688 -179.839 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 96.5 mt . . . . . 0 C--O 1.233 0.227 0 CA-C-O 121.57 0.7 . . . . 10.0 109.325 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -87.88 -16.98 32.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.303 -0.862 . . . . 10.0 109.984 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . 0.427 ' HG ' ' CD1' ' C' ' 405' ' ' TRP . 15.6 tp -55.8 -29.85 60.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.479 -0.782 . . . . 10.0 111.802 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 92.2 mt -61.32 -44.18 97.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.995 0.426 . . . . 10.0 110.078 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -74.87 -38.51 61.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.748 179.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -58.01 -47.0 84.35 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.959 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . 0.427 ' CD1' ' HG ' ' C' ' 401' ' ' LEU . 13.0 m95 -59.59 -36.26 75.92 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.478 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -64.42 -46.9 81.21 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 109.483 -0.562 . . . . 10.0 109.483 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.16 -40.65 90.65 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.862 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.05 -37.93 81.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.74 178.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 63.0 m -64.44 -49.5 71.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.238 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 7.3 m -63.74 -25.39 68.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.911 0.386 . . . . 10.0 111.799 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 18.0 p -92.74 -5.36 51.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.829 0.347 . . . . 10.0 111.029 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -98.37 -37.72 9.51 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.92 -0.77 . . . . 10.0 108.92 178.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 2.5 p -62.58 -47.32 84.35 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 109.151 -0.685 . . . . 10.0 109.151 178.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 23.3 mttm -63.18 -29.25 70.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.551 -0.749 . . . . 10.0 110.33 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 9.0 mt -66.5 -43.3 85.71 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -69.14 -40.67 78.1 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.628 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . 0.587 ' O ' ' HD2' ' C' ' 421' ' ' PRO . 36.9 mt-10 -58.81 -42.8 90.0 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -43.23 74.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.459 -0.791 . . . . 10.0 109.953 178.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 37.7 mt -57.5 -33.14 67.73 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.893 -0.594 . . . . 10.0 112.062 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -53.09 -78.52 0.11 Allowed Glycine 0 CA--C 1.521 0.455 0 C-N-CA 121.34 -0.457 . . . . 10.0 112.079 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . 0.61 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 9.9 Cg_endo -53.42 -38.14 82.5 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 122.941 2.427 . . . . 10.0 111.829 178.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 16.0 t -58.96 -46.86 91.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-N 116.548 -0.297 . . . . 10.0 111.342 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 27.9 p -72.49 -33.5 66.99 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 120.84 -0.344 . . . . 10.0 110.459 179.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -56.51 -54.38 46.5 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.033 0.444 . . . . 10.0 109.825 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . 0.61 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 7.2 pt-20 -71.47 -31.31 67.0 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.43 179.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -62.6 -39.1 92.66 Favored 'General case' 0 N--CA 1.461 0.114 0 N-CA-C 109.433 -0.58 . . . . 10.0 109.433 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 23.2 m95 -67.95 -35.48 78.46 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.021 -0.733 . . . . 10.0 109.021 178.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -67.85 -35.4 78.5 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.454 -0.943 . . . . 10.0 108.454 177.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . 0.687 ' HA ' ' HD2' ' C' ' 432' ' ' LYS . 12.5 t-20 -66.5 -39.96 88.97 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.312 -0.996 . . . . 10.0 108.312 177.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.68 -33.47 75.71 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.689 -0.856 . . . . 10.0 108.689 177.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . 0.414 ' HA ' ' OG1' ' C' ' 434' ' ' THR . 12.7 mt-10 -70.01 -41.01 74.89 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.193 -0.669 . . . . 10.0 109.193 177.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . 0.687 ' HD2' ' HA ' ' C' ' 429' ' ' ASN . 18.0 mttt -61.68 -40.25 94.31 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.325 -0.991 . . . . 10.0 108.325 177.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . 0.859 ' HA ' HD21 ' A' ' 341' ' ' ASN . 31.1 tt0 -68.51 -48.8 63.45 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.94 -1.027 . . . . 10.0 111.022 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . 0.51 ' HB ' ' CZ ' ' C' ' 438' ' ' ARG . 3.3 p -64.01 -47.5 80.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.787 -0.188 . . . . 10.0 111.118 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . 0.408 ' OE1' ' HD2' ' C' ' 438' ' ' ARG . 6.2 mm-40 -61.23 -41.26 96.57 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 110.448 -0.204 . . . . 10.0 110.448 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -66.3 -47.88 68.13 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.481 -1.048 . . . . 10.0 110.481 178.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 20.2 mt -63.89 -28.66 69.99 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 115.734 -0.233 . . . . 10.0 110.603 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . 0.51 ' CZ ' ' HB ' ' C' ' 434' ' ' THR . 37.4 mtt180 -67.98 -33.42 74.6 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 178.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -72.9 -42.79 63.19 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 108.382 -0.97 . . . . 10.0 108.382 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.48 -55.35 16.02 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.159 -0.928 . . . . 10.0 110.957 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 69.5 mmm -58.18 -41.5 84.04 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 113.57 0.952 . . . . 10.0 113.57 -178.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 10.9 p -61.14 -52.54 64.45 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.513 -0.475 . . . . 10.0 109.934 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . 0.469 ' HE3' ' HA ' ' A' ' 330' ' ' ARG . 0.6 OUTLIER -62.99 -41.44 99.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.594 -0.73 . . . . 10.0 109.869 179.069 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . 0.507 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 5.0 t70 -60.08 -50.81 72.23 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.393 -0.821 . . . . 10.0 110.29 179.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . 0.503 ' HA ' HG12 ' C' ' 448' ' ' VAL . 43.5 mt -64.55 -46.29 83.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.941 -0.572 . . . . 10.0 112.153 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -59.5 -47.97 83.44 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.94 -0.304 . . . . 10.0 111.004 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . 0.619 ' O ' ' HB2' ' C' ' 451' ' ' LYS . 73.1 mt-10 -74.9 -17.33 60.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.921 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.5 OUTLIER -86.06 -37.6 11.88 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 C-N-CA 120.899 -0.321 . . . . 10.0 110.715 178.899 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -68.65 -38.35 80.37 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.079 -0.711 . . . . 10.0 109.079 178.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -77.1 -0.87 26.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.526 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . 0.621 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 0.0 OUTLIER -107.0 -35.15 6.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.372 -0.831 . . . . 10.0 109.451 179.451 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . 0.448 HG23 ' O ' ' C' ' 448' ' ' VAL . 41.8 t -67.31 -37.08 78.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.069 179.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . 0.411 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 22.9 mt-30 -56.09 -60.19 9.59 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.788 178.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . 0.411 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 36.6 Cg_endo -68.52 -20.6 41.16 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.572 1.514 . . . . 10.0 111.323 178.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . 0.621 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.1 OUTLIER -70.06 -50.75 38.02 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.983 -0.747 . . . . 10.0 108.983 178.749 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' C' ' 460' ' ' GLN . 57.1 mt -66.45 -39.13 88.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.415 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -62.28 -49.13 76.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.247 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -67.06 -41.41 86.49 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.681 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . 0.504 ' HB2' ' O ' ' C' ' 455' ' ' TYR . 0.1 OUTLIER -62.89 -47.64 82.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 10.0 109.939 179.271 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . 0.573 ' HA ' ' HB2' ' C' ' 463' ' ' TRP . 0.7 OUTLIER -68.36 -26.04 65.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.326 -0.397 . . . . 10.0 111.177 179.747 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . 0.456 ' HB2' ' HE3' ' C' ' 461' ' ' LYS . 20.1 ttmt -67.92 -46.32 71.89 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.121 -1.066 . . . . 10.0 108.121 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . 0.558 ' HD3' ' HA ' ' A' ' 312' ' ' HIS . 20.8 mtmm -71.59 -36.64 70.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.108 -0.951 . . . . 10.0 109.781 178.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . 0.573 ' HB2' ' HA ' ' C' ' 460' ' ' GLN . 1.1 m0 -63.48 -44.0 95.65 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.575 -0.738 . . . . 10.0 109.927 179.05 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -65.7 -40.28 92.13 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 178.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 1.188 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 31.9 tt0 -58.19 -48.37 80.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.489 -0.778 . . . . 10.0 109.697 178.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . 0.637 ' HA ' HD12 ' C' ' 469' ' ' LEU . 16.4 mt-10 -72.51 -36.49 68.37 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.388 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 3.8 mmt -61.66 -51.77 67.08 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 110.285 -0.265 . . . . 10.0 110.285 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.76 -39.08 93.39 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.618 -0.882 . . . . 10.0 108.618 178.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 1.188 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 96.5 mt -57.7 -50.09 74.34 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.369 -0.832 . . . . 20.0 109.602 178.251 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 18.3 m-30 -60.71 -40.04 90.79 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.132 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -64.51 -31.95 73.38 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.541 -0.299 . . . . 10.0 111.211 179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -92.93 -2.03 56.18 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.988 0.366 . . . . 10.0 111.988 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 53.8 mttm -114.28 -45.66 3.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.898 0.38 . . . . 10.0 111.213 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 88.0 t -69.23 -32.44 53.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.519 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . 0.436 ' HB3' ' CD ' ' C' ' 476' ' ' PRO . 35.2 tt0 -59.44 -59.98 12.05 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 121.066 -0.254 . . . . 10.0 110.723 179.089 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . 0.436 ' CD ' ' HB3' ' C' ' 475' ' ' GLU . 18.6 Cg_endo -62.0 -31.95 84.18 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 121.589 1.526 . . . . 10.0 110.458 177.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 8.0 mt -65.7 -37.89 87.71 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -64.81 -41.57 95.67 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 108.577 -0.897 . . . . 10.0 108.577 178.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.57 89.87 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.846 -0.616 . . . . 10.0 109.616 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.18 -41.58 98.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.67 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . 0.488 ' HB3' H281 ' A' ' 65' ' ' PCW . 22.9 mt -69.26 -30.32 68.42 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.993 -0.548 . . . . 10.0 109.837 178.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 -69.64 -60.07 2.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.09 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -62.95 -35.24 79.49 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -66.61 -43.21 92.63 Favored Glycine 0 N--CA 1.446 -0.666 0 N-CA-C 110.949 -0.86 . . . . 10.0 110.949 178.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -70.82 -35.76 72.62 Favored 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 109.308 -0.627 . . . . 10.0 109.308 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 66.1 mtt180 -62.45 -41.48 98.77 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 109.453 -0.573 . . . . 10.0 109.453 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . 0.511 ' OE1' ' HE3' ' A' ' 290' ' ' LYS . 1.3 tt0 -66.44 -46.67 75.66 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.809 -0.812 . . . . 10.0 108.809 178.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -63.47 -37.63 88.02 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.654 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . 0.6 ' O ' ' HG3' ' C' ' 493' ' ' GLN . 37.2 mt -68.46 -43.96 75.9 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 178.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -62.93 -37.6 87.69 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.408 -0.96 . . . . 10.0 108.408 178.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . 0.61 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 28.9 mt-10 -62.04 -50.24 72.8 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 107.711 -1.218 . . . . 10.0 107.711 176.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 48.2 mt -58.01 -33.14 68.62 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 115.424 -0.807 . . . . 10.0 111.152 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . 0.6 ' HG3' ' O ' ' C' ' 489' ' ' LEU . 29.6 mt-30 -65.06 -40.88 95.35 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.936 -0.764 . . . . 10.0 108.936 178.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.54 7.61 16.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.291 179.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.689 ' HG2' HD22 ' A' ' 279' ' ' LEU . 16.1 mttm -116.88 -48.74 2.65 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 178.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 95.4 mt -71.58 -37.26 71.03 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.65 0.611 . . . . 10.0 112.65 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 4.9 m -65.51 -58.86 10.7 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 112.17 0.433 . . . . 10.0 112.17 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -62.93 -45.65 12.52 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 122.113 1.875 . . . . 10.0 111.621 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . 0.579 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 18.7 mt -67.49 -35.01 78.32 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 121.1 -0.24 . . . . 10.0 110.656 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.67 -48.35 62.62 Favored Glycine 0 N--CA 1.451 -0.314 0 N-CA-C 110.317 -1.113 . . . . 10.0 110.317 178.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -61.26 -38.21 85.89 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . 0.688 ' HG2' ' HE ' ' C' ' 506' ' ' ARG . 25.7 tt0 -68.29 -45.57 72.71 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.387 -0.824 . . . . 10.0 109.674 178.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . 0.631 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 78.3 mmm -60.17 -34.43 73.58 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.887 -0.412 . . . . 10.0 109.887 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -66.63 -39.9 88.5 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.56 -0.533 . . . . 10.0 109.56 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -69.01 -42.09 76.91 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.787 -0.82 . . . . 10.0 108.787 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.688 ' HE ' ' HG2' ' C' ' 502' ' ' GLU . 45.0 mtt180 -61.84 -44.7 96.31 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.341 -0.845 . . . . 10.0 108.858 178.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.9 -44.77 94.07 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.063 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' C' ' 508' ' ' ARG . 46.3 mtt85 -62.08 -44.41 96.72 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -69.15 -19.62 64.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.711 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 8.9 m170 -94.23 -57.81 2.4 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.94 0.4 . . . . 10.0 111.225 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 25.8 t -66.37 -43.36 91.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.985 -0.552 . . . . 10.0 112.375 -178.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.764 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 3.0 t70 -66.17 -33.0 74.77 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 120.194 -0.602 . . . . 10.0 109.919 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.65 -37.5 84.93 Favored 'General case' 0 C--O 1.222 -0.344 0 N-CA-C 107.606 -1.257 . . . . 10.0 107.606 177.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 84.6 mt -67.73 -27.93 67.22 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.566 178.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . 0.764 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 86.0 mtt180 -70.56 -33.53 71.22 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.564 -0.532 . . . . 10.0 109.564 178.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.32 3.78 54.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.817 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 62.7 m170 -119.61 -49.72 2.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.844 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 79.7 mt -77.48 -36.34 52.82 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.46 0.541 . . . . 10.0 112.46 -179.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -57.37 -57.17 26.89 Favored Pre-proline 0 C--N 1.331 -0.211 0 C-N-CA 120.747 -0.381 . . . . 10.0 110.973 179.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -62.96 -34.36 71.33 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.21 1.273 . . . . 10.0 110.166 177.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . 0.502 ' HA ' ' OE1' ' C' ' 524' ' ' GLU . 35.2 t80 -61.55 -45.81 92.59 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.767 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . 0.49 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 12.1 p -63.86 -34.75 78.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.969 0.414 . . . . 10.0 110.392 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . 0.424 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 2.6 t0 -70.79 -40.22 72.68 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.455 -0.572 . . . . 10.0 109.455 178.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . 0.502 ' OE1' ' HA ' ' C' ' 521' ' ' TYR . 69.0 mt-10 -64.26 -40.3 95.7 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 108.451 -0.944 . . . . 10.0 108.451 178.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 35.6 mt -62.89 -38.53 91.27 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 115.3 -0.864 . . . . 10.0 109.655 178.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . 0.49 ' HG3' ' O ' ' C' ' 522' ' ' SER . 78.6 mtt180 -58.3 -40.2 81.38 Favored 'General case' 0 C--O 1.226 -0.174 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.322 178.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -64.94 -49.35 70.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.979 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 44.4 mtt180 -64.25 -39.95 95.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.109 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 60.0 mt -70.22 -30.34 67.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.055 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -61.89 -48.09 82.04 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.78 -40.69 92.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.422 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . 0.811 HH21 ' HB3' ' A' ' 242' ' ' GLU . 8.5 ttm180 -59.44 -46.76 87.84 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.669 -0.696 . . . . 10.0 109.94 178.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 65.1 mt -66.15 -39.77 90.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.813 -0.631 . . . . 10.0 110.125 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -62.57 -39.41 93.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 10.0 109.935 178.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.41 -42.72 92.26 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.669 -0.863 . . . . 10.0 108.669 177.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.5 -24.45 67.14 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.1 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -79.18 -45.63 19.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.843 178.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -63.22 -52.17 63.3 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . 0.523 ' OD1' ' HE3' ' A' ' 234' ' ' LYS . 54.2 m-20 -68.34 -30.71 69.73 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.569 -0.741 . . . . 10.0 109.519 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . 0.483 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -65.79 -51.91 42.61 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.21 -0.756 . . . . 10.0 111.21 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -60.48 -38.25 94.55 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 110.734 -0.947 . . . . 10.0 110.734 178.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -63.42 -54.28 39.04 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.845 -0.798 . . . . 10.0 108.845 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' C' ' 543' ' ' ARG . 50.0 mtt180 -55.14 -41.76 72.16 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.61 179.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 55.8 mt -56.57 -50.43 71.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.667 0.27 . . . . 10.0 110.808 179.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.85 -47.53 68.69 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.023 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -60.72 -44.52 96.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.879 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -69.85 -37.89 76.3 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.015 -0.365 . . . . 10.0 110.015 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.4 m170 -63.5 -46.64 85.15 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.864 -0.421 . . . . 10.0 109.864 179.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . 0.501 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -63.1 -45.6 91.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.978 -0.556 . . . . 10.0 109.527 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . 0.449 ' HA ' ' HD3' ' C' ' 550' ' ' LYS . 0.1 OUTLIER -63.12 -35.57 80.71 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.772 179.304 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -67.57 -36.8 81.63 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.28 -0.637 . . . . 10.0 109.28 178.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 18.1 m -63.06 -48.19 79.71 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 108.174 -1.047 . . . . 10.0 108.174 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . 0.501 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 39.8 mt-10 -59.47 -43.49 93.24 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.023 178.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . 0.504 ' O ' ' HB2' ' C' ' 558' ' ' LEU . 39.6 t-80 -63.87 -31.79 73.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.63 -0.714 . . . . 10.0 111.397 179.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 60.4 mt -73.72 -49.02 27.71 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.167 -0.308 . . . . 10.0 110.167 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 5.5 m -62.12 -33.73 75.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.033 0.444 . . . . 10.0 110.629 179.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . 0.415 ' HB ' ' HG2' ' A' ' 216' ' ' LYS . 33.2 p -83.45 -9.7 58.83 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.107 0.479 . . . . 10.0 110.944 179.456 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . 0.504 ' HB2' ' O ' ' C' ' 554' ' ' HIS . 0.2 OUTLIER -86.51 -47.75 8.98 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.459 -1.311 . . . . 10.0 107.459 177.806 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . 0.706 ' HB2' ' HE2' ' C' ' 563' ' ' LYS . 1.7 p -67.83 -23.22 65.14 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.442 -0.947 . . . . 10.0 108.442 177.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -57.92 -25.69 61.22 Favored 'General case' 0 CA--C 1.524 -0.045 0 CA-C-N 114.907 -1.042 . . . . 10.0 109.505 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . 0.443 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 47.4 mttp -112.4 -33.94 6.03 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.571 -0.741 . . . . 10.0 110.35 179.306 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . 0.612 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -61.16 -11.47 9.12 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.948 0.404 . . . . 10.0 111.896 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . 0.706 ' HE2' ' HB2' ' C' ' 559' ' ' SER . 62.9 mttm -98.09 -67.07 0.06 OUTLIER Pre-proline 0 C--N 1.325 -0.496 0 C-N-CA 120.913 -0.315 . . . . 10.0 111.316 178.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . 0.572 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 55.8 Cg_endo -69.92 -40.92 4.53 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 121.887 1.725 . . . . 10.0 113.467 -179.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . 0.443 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -68.07 -42.78 79.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.496 0.189 . . . . 10.0 110.702 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' C' ' 562' ' ' ALA . 8.0 mt -64.01 -39.44 94.11 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.723 -0.391 . . . . 10.0 109.958 178.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -68.96 -33.32 73.51 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.855 -0.424 . . . . 10.0 109.855 178.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.04 -44.93 91.0 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.341 -0.985 . . . . 10.0 108.341 178.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . 0.803 HD21 HD21 ' A' ' 206' ' ' ASN . 83.2 mt -67.19 -38.17 84.89 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.131 -0.94 . . . . 10.0 110.356 178.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -64.25 -38.18 90.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.452 0.644 . . . . 10.0 109.605 178.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -81.69 -10.31 59.42 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.408 -0.815 . . . . 20.0 111.285 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -92.23 -47.96 3.18 Favored Glycine 0 CA--C 1.521 0.432 0 N-CA-C 108.993 -1.643 . . . . 10.0 108.993 178.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . 0.434 ' HA ' ' HB ' ' C' ' 576' ' ' VAL . 75.0 mt -61.54 -25.03 67.03 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.572 -0.314 . . . . 10.0 111.45 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 4.7 mt -60.07 -66.34 1.55 Allowed Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 121.191 -0.204 . . . . 10.0 111.038 178.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.98 -28.73 57.76 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 121.711 1.607 . . . . 10.0 111.094 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . 0.434 ' HB ' ' HA ' ' C' ' 573' ' ' LEU . 5.7 t -64.39 -47.07 91.05 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 178.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 34.0 mt -67.38 -34.93 78.3 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.919 -0.4 . . . . 10.0 109.919 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -62.9 -47.85 81.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.315 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 4.2 p -71.21 -36.57 71.92 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.917 -0.401 . . . . 10.0 109.917 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.7 -43.65 98.44 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 178.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -62.06 -44.99 95.49 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 178.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 50.8 t -59.29 -44.24 91.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.204 0.526 . . . . 10.0 109.624 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 15.2 m -65.98 -45.18 82.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.706 -0.679 . . . . 10.0 111.05 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -69.68 -40.91 76.09 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.375 0.509 . . . . 10.0 112.375 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 52.7 mt -61.29 -40.27 93.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.865 0.364 . . . . 10.0 110.049 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . 0.478 ' O ' ' HG3' ' C' ' 590' ' ' GLU . 19.1 m -73.47 -37.43 65.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.078 -0.712 . . . . 10.0 109.078 178.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . 0.547 ' HA ' ' HE3' ' A' ' 396' ' ' LYS . . . -58.89 -50.52 73.71 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.674 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.9 mt -62.82 -37.61 87.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.29 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . 0.409 ' HG2' ' HE3' ' C' ' 593' ' ' LYS . 3.5 tt0 -62.64 -46.5 87.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.337 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' C' ' 586' ' ' SER . 55.2 mt-10 -63.81 -40.99 97.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.78 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . 0.552 ' CZ ' ' HE2' ' A' ' 396' ' ' LYS . 11.7 m-85 -64.54 -42.99 95.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.879 -179.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 1.6 p -69.49 -21.93 63.65 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.562 0.579 . . . . 10.0 112.562 -179.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . 0.409 ' HE3' ' HG2' ' C' ' 589' ' ' GLU . 90.5 mttt -84.94 -14.86 46.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.306 0.574 . . . . 10.0 110.586 179.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.19 -48.98 4.22 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.76 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 89.2 mt -94.2 48.94 1.27 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.143 0.497 . . . . 10.0 110.478 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 . . . . . 0 C--O 1.251 1.146 0 CA-C-O 118.652 -0.69 . . . . 10.0 110.825 -179.067 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.521 ' SD ' ' H72' ' A' ' 30' ' ' PCW . 33.5 ttp . . . . . 0 C--O 1.233 0.221 0 CA-C-O 121.205 0.526 . . . . 10.0 110.586 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 22.2 m -153.74 -78.49 0.1 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.749 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.728 ' HG2' ' HB2' ' B' ' 52' ' ' LEU . 0.0 OUTLIER -145.63 138.84 26.21 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.878 -0.786 . . . . 10.0 108.878 -179.423 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -140.16 127.28 20.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.061 0.457 . . . . 10.0 111.91 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.72 ' NZ ' ' HN1' ' A' ' 40' ' ' 17F . 14.3 mptt -93.22 117.9 30.61 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.846 -0.798 . . . . 10.0 108.846 178.538 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 68.8 mt -110.69 118.24 35.64 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.206 0.527 . . . . 10.0 111.663 -178.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.402 HG13 HD23 ' B' ' 56' ' ' LEU . 39.6 t -95.71 112.05 27.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.437 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 38.6 t -94.32 116.0 34.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 109.596 -0.52 . . . . 10.0 109.596 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 21.2 m -105.33 167.54 2.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.425 -0.352 . . . . 10.0 111.336 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 150.56 165.69 12.92 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 111.458 -0.657 . . . . 10.0 111.458 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.26 169.06 14.15 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.726 0.298 . . . . 10.0 111.025 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -77.75 61.32 3.67 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.298 -0.477 . . . . 10.0 112.373 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -153.83 -32.06 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 111.027 -0.829 . . . . 10.0 111.027 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 21.4 m -77.2 166.68 2.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 110.205 -0.294 . . . . 10.0 110.205 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . 0.409 ' HA3' ' N7 ' ' B' ' 201' ' ' GNP . . . -83.77 54.96 5.0 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.756 -0.735 . . . . 10.0 113.498 -179.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 18.5 mtmt -60.62 -61.99 2.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.989 0.423 . . . . 10.0 111.204 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . 0.415 ' O ' HG13 ' B' ' 21' ' ' ILE . 1.8 p -63.99 -36.27 83.41 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.82 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.58 -50.0 75.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.113 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 63.8 mt -61.31 -42.68 99.07 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.831 0.348 . . . . 10.0 110.767 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 13.7 m -61.24 -49.21 78.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.953 -0.567 . . . . 10.0 111.002 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . 0.415 HG13 ' O ' ' B' ' 17' ' ' SER . 67.4 mt -67.39 -32.49 57.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.79 0.328 . . . . 10.0 110.591 179.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.527 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 5.5 tp-100 -67.68 -18.61 65.0 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.121 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.8 tp -99.11 -37.88 9.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.208 0.528 . . . . 10.0 110.656 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 45.8 mm -76.04 -68.92 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.408 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.556 ' NE2' ' HA ' ' D' ' 840' ' ' VAL . 39.6 mt-30 -85.89 -21.55 27.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.061 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.527 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 27.9 m-80 66.97 34.53 5.17 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.971 -178.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -127.45 126.97 43.29 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.252 -0.886 . . . . 10.0 109.277 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . 0.443 ' HB2' HE22 ' B' ' 22' ' ' GLN . 52.9 t80 -78.19 133.44 37.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.93 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 3.4 m -107.62 123.71 63.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.762 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -89.08 -29.32 19.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.589 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -68.31 135.01 51.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.463 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.579 ' CD2' H5'1 ' B' ' 201' ' ' GNP . 34.8 t80 -87.33 94.42 9.67 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.979 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 2.0 t70 -98.11 130.68 28.0 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 109.486 -0.561 . . . . 10.0 109.486 179.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 31.0 Cg_exo -64.14 178.08 1.69 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.97 2.447 . . . . 10.0 112.454 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.2 m -163.69 141.73 7.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.225 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.794 HD11 HG21 ' D' ' 809' ' ' THR . 5.3 mt -118.7 -65.19 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 108.654 -0.869 . . . . 10.0 108.654 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.48 ' O ' HG23 ' D' ' 821' ' ' VAL . 14.1 tt0 -148.77 93.45 2.12 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.093 -0.706 . . . . 10.0 109.093 179.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . 0.718 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 56.6 m-20 -114.13 160.95 18.38 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.654 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . 0.406 ' HB2' ' HB3' ' D' ' 818' ' ' GLN . 4.5 m -146.53 140.41 26.14 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.971 0.415 . . . . 10.0 112.021 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . 0.592 ' CE2' HG22 ' D' ' 840' ' ' VAL . 2.8 m-85 -129.67 152.43 49.19 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 109.336 -0.616 . . . . 10.0 109.336 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . 0.602 HH12 ' HD3' ' D' ' 817' ' ' LYS . 11.7 ttp180 -141.47 137.25 31.99 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 122.076 -0.39 . . . . 10.0 110.826 -178.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -155.92 147.51 22.87 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -102.16 125.62 48.9 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.782 -0.451 . . . . 10.0 109.782 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 15.6 m -136.97 158.26 36.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.847 0.356 . . . . 10.0 111.074 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.613 ' HA ' ' HA ' ' B' ' 50' ' ' THR . 24.7 t -95.63 101.71 12.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 109.179 -0.674 . . . . 10.0 109.179 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . 0.528 HD11 HD11 ' B' ' 53' ' ' LEU . 54.5 mt -92.26 105.28 16.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.453 -178.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 57.25 36.63 27.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.5 -0.773 . . . . 10.0 111.728 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.1 -15.32 62.67 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.772 -0.728 . . . . 10.0 113.611 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -106.13 109.05 20.86 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.874 0.337 . . . . 10.0 111.07 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.613 ' HA ' ' HA ' ' B' ' 45' ' ' VAL . 11.1 t -76.04 143.52 41.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.561 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 1.4 p -165.0 162.41 20.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.378 -179.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.728 ' HB2' ' HG2' ' B' ' 3' ' ' GLU . 17.6 mt -95.06 129.49 42.13 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 179.053 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.528 HD11 HD11 ' B' ' 46' ' ' ILE . 89.6 mt -110.03 122.09 46.77 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.958 -0.297 . . . . 10.0 111.552 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.453 ' HB3' ' HG3' ' B' ' 5' ' ' LYS . 7.8 t70 -99.25 100.9 12.05 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.067 -1.086 . . . . 10.0 108.067 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 32.1 mt -88.86 126.02 41.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.346 -178.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.402 HD23 HG13 ' B' ' 7' ' ' VAL . 33.0 tp -101.1 116.31 32.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.778 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.718 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 9.1 t0 -92.48 98.94 11.78 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 40.1 p -77.92 164.92 24.7 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 113.004 0.742 . . . . 10.0 113.004 -178.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.63 163.59 23.41 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.219 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.63 -32.04 47.77 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.73 -0.747 . . . . 10.0 112.675 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -150.28 131.85 14.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.823 0.344 . . . . 20.0 111.218 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.429 ' OE2' ' HD2' ' B' ' 68' ' ' ARG . 36.6 mt-10 -133.46 158.35 43.32 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.527 -0.546 . . . . 10.0 109.527 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -92.68 -74.38 0.52 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.127 0.489 . . . . 10.0 109.722 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -162.99 61.01 0.19 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.364 -0.834 . . . . 10.0 109.096 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.49 126.82 31.58 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.415 -0.812 . . . . 10.0 111.486 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.07 -37.44 87.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.255 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 7.9 tmm? -63.11 -34.32 77.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.287 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.685 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 32.3 ttt85 -61.86 -46.7 88.31 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.396 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.61 -24.65 67.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.633 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -78.54 -44.4 24.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.767 -0.651 . . . . 10.0 111.115 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . 0.685 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 1.4 p90 -70.95 -29.27 65.24 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 120.363 -0.535 . . . . 10.0 112.183 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 76.5 mtp -79.42 -15.22 58.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 10.0 109.996 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . 0.789 ' HD3' ' HB ' ' B' ' 103' ' ' VAL . 2.9 tpp180 -74.01 -27.01 60.75 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.18 -179.262 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 m -82.8 -33.2 27.32 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.689 0.625 . . . . 10.0 112.689 -178.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -57.29 148.28 33.7 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 114.445 0.538 . . . . 10.0 114.445 -178.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . 0.491 ' O ' ' HD2' ' B' ' 110' ' ' PRO . 13.6 tt0 -111.21 -39.71 4.65 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-O 121.112 0.482 . . . . 10.0 109.8 178.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -118.51 138.11 13.47 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 110.998 -0.841 . . . . 10.0 110.998 179.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.403 ' O ' ' HA ' ' B' ' 111' ' ' MET . 85.5 m-85 -129.58 143.08 50.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.051 0.453 . . . . 10.0 111.949 -178.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.746 ' HG ' HD22 ' B' ' 159' ' ' LEU . 58.7 mt -99.85 122.21 42.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.144 179.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . 0.428 ' HB2' ' HA ' ' B' ' 113' ' ' LEU . 6.7 m -88.87 78.88 7.49 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.533 ' HA ' ' HB ' ' B' ' 114' ' ' VAL . 21.5 t -82.91 118.66 30.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.547 -178.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.824 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 18.8 p90 -134.75 158.93 42.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.855 -0.612 . . . . 10.0 109.712 178.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -97.29 130.69 44.45 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.668 HD11 ' HA ' ' B' ' 118' ' ' CYS . 27.7 pt -73.31 -5.25 6.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.015 0.436 . . . . 10.0 111.372 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.08 3.5 28.19 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.027 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -126.62 116.81 21.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.915 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.41 -32.36 71.29 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.283 0.475 . . . . 10.0 112.283 -178.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -60.97 -46.19 91.73 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 111.654 0.242 . . . . 10.0 111.654 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . 0.824 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.8 OUTLIER -59.73 -26.32 65.55 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.43 0.53 . . . . 10.0 112.43 -179.643 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -70.54 -34.01 71.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.041 0.448 . . . . 10.0 110.138 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -85.71 -26.99 25.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.738 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . 0.467 ' HB2' ' HA ' ' B' ' 89' ' ' SER . 0.3 OUTLIER -66.71 -17.07 64.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.439 179.752 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . 0.632 HD11 ' HB3' ' B' ' 82' ' ' PHE . 43.6 mm -60.69 -45.82 96.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -67.71 -37.13 81.83 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 8.7 t-160 -61.42 -39.32 90.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.396 -0.82 . . . . 10.0 110.195 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -74.83 -46.72 34.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.526 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.97 -40.76 85.75 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.673 0.273 . . . . 10.0 111.27 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -65.32 -34.41 78.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.758 0.313 . . . . 10.0 111.144 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -69.25 -46.23 67.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.224 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . 0.502 ' HA ' HG22 ' B' ' 103' ' ' VAL . 41.8 mt -68.29 -33.96 63.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.115 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . 0.419 ' HD2' ' HG3' ' B' ' 107' ' ' GLU . 29.2 ttpt -60.43 -31.41 70.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.984 0.421 . . . . 10.0 110.642 179.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 44.9 ttp85 -78.21 -34.05 49.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.009 -0.542 . . . . 10.0 111.852 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.789 ' HB ' ' HD3' ' B' ' 73' ' ' ARG . 19.9 m -77.39 -32.11 18.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 112.405 0.52 . . . . 10.0 112.405 -179.157 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -95.92 -14.66 22.93 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.682 -0.407 . . . . 10.0 111.379 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . 0.479 ' OD1' ' H62' ' A' ' 16' ' ' PCW . 26.2 t0 58.85 48.15 11.6 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.496 0.665 . . . . 10.0 110.995 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 32.5 t -178.23 153.59 0.78 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.445 -0.798 . . . . 10.0 110.336 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . 0.419 ' HG3' ' HD2' ' B' ' 101' ' ' LYS . 17.1 mp0 -91.82 -8.17 47.39 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 108.715 -0.846 . . . . 10.0 108.715 178.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -83.82 64.02 7.82 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 114.969 -1.014 . . . . 10.0 110.568 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 50.5 t -121.15 116.95 30.88 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.226 -0.897 . . . . 10.0 109.797 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . 0.491 ' HD2' ' O ' ' B' ' 76' ' ' GLU . 51.4 Cg_exo -55.77 113.14 1.29 Allowed 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.927 2.418 . . . . 10.0 111.555 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . 0.403 ' HA ' ' O ' ' B' ' 78' ' ' PHE . 65.3 mtt -133.28 150.95 51.89 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.293 -179.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.481 ' HB ' HD23 ' B' ' 79' ' ' LEU . 95.1 t -132.0 124.96 54.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 179.2 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . 0.428 ' HA ' ' HB2' ' B' ' 80' ' ' CYS . 15.0 tp -75.6 121.09 21.91 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.8 -0.815 . . . . 10.0 108.8 179.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . 0.533 ' HB ' ' HA ' ' B' ' 81' ' ' VAL . 60.8 t -114.8 111.5 36.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 112.026 0.38 . . . . 10.0 112.026 -178.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -89.38 100.12 2.63 Favored Glycine 0 N--CA 1.449 -0.486 0 N-CA-C 109.746 -1.341 . . . . 10.0 109.746 178.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -86.67 153.13 21.99 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 112.544 0.572 . . . . 10.0 112.544 -177.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 77.4 mttt 70.38 46.39 0.58 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 114.919 -1.037 . . . . 10.0 113.442 178.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . 0.668 ' HA ' HD11 ' B' ' 84' ' ' ILE . 15.5 p -78.78 -2.53 39.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.986 0.422 . . . . 10.0 111.404 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -92.67 0.56 57.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.967 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 17.7 mt -97.13 127.08 39.82 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.838 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.68 -26.59 68.7 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.999 2.466 . . . . 10.0 111.286 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.35 70.4 4.7 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.589 -0.732 . . . . 10.0 110.001 179.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 24.6 ttt180 -101.41 122.46 43.79 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.579 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.21 -49.43 4.48 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.361 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 62.1 t -78.67 116.51 22.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.665 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -73.3 153.48 40.54 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.028 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . 0.404 HG22 HE21 ' B' ' 131' ' ' GLN . 2.3 m -60.15 -37.41 80.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.229 179.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 16.4 tttm -68.25 -36.93 80.21 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 121.174 -0.211 . . . . 10.0 111.092 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -60.26 -39.65 87.55 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.058 0.456 . . . . 10.0 110.188 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -71.93 -41.22 68.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.114 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.404 HE21 HG22 ' B' ' 127' ' ' THR . 76.9 mt-30 -61.64 -37.09 82.71 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.895 179.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.89 -46.76 80.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.149 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 32.8 tp -64.36 -42.13 96.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.451 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.76 -44.56 95.89 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.967 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.59 -27.53 69.01 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.071 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.9 m -71.21 -25.73 62.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.074 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . 0.431 ' HB2' HG12 ' B' ' 139' ' ' ILE . 21.8 m-85 -99.8 -20.0 16.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.975 0.416 . . . . 10.0 110.376 179.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.89 21.49 52.82 Favored Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 111.018 -0.833 . . . . 10.0 111.018 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . 0.431 HG12 ' HB2' ' B' ' 137' ' ' TYR . 49.1 pt -109.58 155.78 40.76 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.732 -0.234 . . . . 10.0 110.654 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -79.9 158.01 24.16 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.341 2.027 . . . . 10.0 111.97 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -120.76 122.95 41.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.553 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 24.0 mm -122.0 116.52 49.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.715 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . 0.6 ' HG2' ' HB3' ' B' ' 118' ' ' CYS . 6.8 tt0 -83.19 128.13 34.22 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.74 -0.837 . . . . 10.0 108.74 178.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 81.4 p -135.66 167.82 20.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.884 0.85 . . . . 10.0 112.987 -177.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . 0.409 ' HB3' ' OG1' ' B' ' 148' ' ' THR . 5.6 t -157.55 131.81 8.32 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.471 -1.24 . . . . 10.0 108.173 178.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -76.71 -14.56 59.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.842 0.353 . . . . 10.0 110.639 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -85.48 -44.43 12.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.954 -0.566 . . . . 10.0 111.111 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . 0.409 ' OG1' ' HB3' ' B' ' 145' ' ' SER . 48.9 p -86.05 -25.83 25.68 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.992 0.425 . . . . 10.0 110.368 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 14.2 ttt-85 66.07 27.55 10.55 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.435 -0.802 . . . . 10.0 110.682 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -91.9 127.53 37.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.262 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.35 7.22 67.49 Favored Glycine 0 C--O 1.228 -0.268 0 CA-C-N 115.977 -0.556 . . . . 10.0 113.939 178.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 95.3 t -66.57 -55.36 18.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.72 0.295 . . . . 10.0 111.63 -179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.46 -42.46 98.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.672 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -65.05 -31.77 73.16 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.319 0.489 . . . . 10.0 112.319 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.91 -46.67 89.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.107 0.48 . . . . 10.0 109.868 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -70.94 -40.03 72.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.384 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -62.92 -44.36 96.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.228 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.767 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 70.7 m -63.91 -33.68 76.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.859 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.746 HD22 ' HG ' ' B' ' 79' ' ' LEU . 58.1 tp -60.9 -42.82 98.76 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . 0.419 HG21 HD13 ' B' ' 46' ' ' ILE . 47.8 t -69.76 -32.96 54.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.74 178.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . 0.767 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 72.8 mtt180 -63.4 -41.19 98.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.557 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -64.65 -38.17 90.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . 0.547 HG22 ' HE2' ' B' ' 167' ' ' LYS . 97.1 mt -67.02 -40.12 84.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.477 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 30.1 ttm180 -58.17 -46.52 85.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.584 -0.735 . . . . 10.0 109.701 179.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -70.39 -33.32 71.25 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.291 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -59.93 -41.79 92.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.756 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . 0.547 ' HE2' HG22 ' B' ' 163' ' ' ILE . 67.6 mttm -68.22 -43.66 77.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.691 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . 0.429 ' HG2' ' HE3' ' B' ' 172' ' ' LYS . 23.7 tt0 -67.83 -33.52 74.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.078 0.466 . . . . 10.0 110.201 179.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -67.78 -28.92 68.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.704 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 54.8 ttp -62.01 -38.01 87.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.95 0.405 . . . . 10.0 111.233 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . 0.472 ' O ' ' H52' ' A' ' 14' ' ' PCW . 49.9 m -73.54 -15.53 61.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.191 0.519 . . . . 10.0 111.077 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . 0.429 ' HE3' ' HG2' ' B' ' 168' ' ' GLU . 85.8 mttt -105.53 2.48 28.46 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . 0.446 ' OD1' ' H83' ' A' ' 11' ' ' PCW . 28.0 t70 56.72 -92.27 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 114.773 -1.103 . . . . 10.0 113.426 179.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 115.11 89.62 1.64 Allowed Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 110.913 -0.875 . . . . 10.0 110.913 -178.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 55.5 mmtt -69.01 -50.8 45.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.747 0.308 . . . . 10.0 111.249 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 45.0 tptt -169.99 131.95 1.07 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . 0.402 ' HE3' ' HB2' ' B' ' 177' ' ' LYS . 15.6 ptmt -129.74 154.38 47.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.949 0.404 . . . . 10.0 111.348 179.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -130.85 -170.04 2.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.575 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 65.7 tttt -83.06 -42.95 16.85 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.897 0.38 . . . . 10.0 110.015 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -83.41 127.52 33.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.481 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 2.5 m -81.04 130.54 35.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.422 -0.354 . . . . 10.0 110.548 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . 0.427 ' H ' ' HG2' ' B' ' 182' ' ' LYS . 5.3 ptmm? -92.96 153.22 18.89 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.913 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.69 -12.88 58.47 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.587 0.588 . . . . 10.0 112.587 -178.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -118.7 148.55 42.65 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 6.8 t . . . . . 0 C--O 1.236 0.385 0 CA-C-N 115.895 -0.593 . . . . 10.0 111.185 179.929 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.134 -0.386 . . . . 10.0 112.134 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' D' D ' 809' ' ' THR . . . . . 0.794 HG21 HD11 ' B' ' 36' ' ' ILE . 11.8 p -122.7 145.83 48.04 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.667 0.27 . . . . 10.0 110.562 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 51.0 t -121.88 136.19 59.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.639 -0.255 . . . . 10.0 110.359 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 811' ' ' LYS . . . . . 0.533 ' HG2' HG22 ' D' ' 821' ' ' VAL . 80.2 mttt -86.55 120.79 28.24 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.19 0.519 . . . . 10.0 110.862 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 44.7 t -105.65 123.55 60.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.493 179.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 813' ' ' TYR . . . . . 0.809 ' HB2' HG12 ' D' ' 876' ' ' ILE . 80.1 m-85 -91.15 137.26 32.5 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.038 0.447 . . . . 10.0 110.785 -179.396 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 814' ' ' LEU . . . . . 0.772 HD13 ' HD2' ' D' ' 841' ' ' ARG . 13.3 mt -105.46 153.22 39.91 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.388 -178.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 815' ' ' PRO . . . . . 0.531 ' HA ' ' H61' ' A' ' 2' ' ' PCW . 34.3 Cg_endo -65.01 -13.71 41.29 Favored 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 123.263 2.642 . . . . 10.0 113.428 -179.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -90.27 37.92 0.92 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.967 -0.383 . . . . 10.0 109.967 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 817' ' ' LYS . . . . . 0.602 ' HD3' HH12 ' B' ' 41' ' ' ARG . 30.0 mtpp 51.94 39.43 26.03 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.207 -0.906 . . . . 10.0 111.646 -179.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 818' ' ' GLN . . . . . 0.496 HE22 ' C ' ' B' ' 40' ' ' TYR . 84.1 mt-30 -136.63 -169.51 2.48 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 114.515 1.302 . . . . 10.0 114.515 -177.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 819' ' ' ARG . . . . . 0.46 ' NH1' ' HA ' ' D' ' 818' ' ' GLN . 0.0 OUTLIER -151.85 167.73 27.36 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.123 -0.944 . . . . 10.0 111.539 -178.363 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 14.7 t -154.03 139.12 17.36 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.949 -1.13 . . . . 10.0 107.949 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 821' ' ' VAL . . . . . 0.553 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 3.2 t -107.87 112.79 41.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 C-N-CA 120.443 -0.503 . . . . 10.0 111.202 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 5.6 t -110.22 148.91 13.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.54 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 2.6 m -88.68 108.33 19.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.115 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 61.5 t -77.7 121.18 29.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.942 0.401 . . . . 10.0 110.636 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 21.6 mtp85 -122.41 156.14 34.63 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.186 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -73.54 139.4 45.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.811 0.338 . . . . 10.0 110.766 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 110.82 -36.91 3.98 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.781 -0.724 . . . . 10.0 112.252 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 12.0 ptm -81.42 149.74 28.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.741 0.305 . . . . 10.0 110.61 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 829' ' ' SER . . . . . . . . . . . . . 97.9 p -100.03 176.3 5.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.952 0.406 . . . . 10.0 110.657 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 16.1 t -63.2 -36.82 77.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.193 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 831' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -62.47 -44.87 95.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.484 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -65.21 -47.52 76.58 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.048 0.452 . . . . 10.0 111.072 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 3.1 m -64.89 -43.0 94.33 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.769 -0.651 . . . . 10.0 112.416 -178.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.87 -16.63 56.8 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.31 0.856 . . . . 10.0 113.31 -178.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -59.23 -50.78 72.68 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.031 0.443 . . . . 10.0 111.01 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 5.5 mmmm -66.3 -25.92 67.08 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.387 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -80.11 -18.02 51.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.533 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 838' ' ' LEU . . . . . 0.563 HD21 HG11 ' D' ' 877' ' ' VAL . 78.2 mt -100.68 -48.66 4.43 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.236 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -58.26 -33.16 69.08 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.983 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 840' ' ' VAL . . . . . 0.755 HG13 ' HG3' ' D' ' 841' ' ' ARG . 9.6 p -56.03 -22.63 13.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 115.805 -0.634 . . . . 10.0 112.096 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 841' ' ' ARG . . . . . 0.772 ' HD2' HD13 ' D' ' 814' ' ' LEU . 0.9 OUTLIER -119.53 13.23 12.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.586 -179.381 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 75.95 19.33 78.87 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.68 -0.771 . . . . 10.0 112.526 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 58.5 mt -92.65 175.51 6.79 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.935 -0.394 . . . . 10.0 109.935 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -152.22 155.15 37.19 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.382 -0.229 . . . . 10.0 110.382 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 845' ' ' GLN . . . . . 0.47 ' HG3' HD12 ' D' ' 838' ' ' LEU . 22.4 mp0 -75.6 71.01 2.48 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.995 0.426 . . . . 10.0 111.054 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -129.4 -70.45 0.65 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.669 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -104.62 15.31 28.26 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.395 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 16.0 m -111.5 129.74 55.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.198 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 6.1 p -121.69 153.12 25.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.486 -0.324 . . . . 10.0 110.517 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 850' ' ' VAL . . . . . . . . . . . . . 20.1 t -100.16 136.28 32.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.132 0.492 . . . . 10.0 111.523 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 851' ' ' TYR . . . . . 0.51 ' CE2' HG22 ' D' ' 860' ' ' VAL . 86.9 m-85 -112.83 135.01 54.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.687 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 852' ' ' ARG . . . . . 0.494 ' HG3' ' HB ' ' D' ' 861' ' ' THR . 61.1 mtp180 -78.97 131.4 36.32 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 178.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 853' ' ' LEU . . . . . 0.796 HD22 ' H73' ' A' ' 5' ' ' PCW . 0.4 OUTLIER -106.73 114.12 28.03 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.121 0.486 . . . . 10.0 111.746 -179.315 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' D' D ' 854' ' ' ILE . . . . . 0.417 ' HA ' ' H71' ' A' ' 5' ' ' PCW . 2.4 pt -150.75 141.21 16.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 108.39 -0.967 . . . . 10.0 108.39 179.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt 68.47 -53.29 0.55 Allowed 'General case' 0 N--CA 1.472 0.631 0 O-C-N 123.653 0.596 . . . . 10.0 112.567 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 167.09 -30.56 0.19 Allowed Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 111.21 -0.756 . . . . 10.0 111.21 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 857' ' ' ARG . . . . . 0.637 ' HE ' ' H19' ' A' ' 2' ' ' PCW . 11.9 mmt180 -83.68 150.64 25.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.749 0.309 . . . . 10.0 110.629 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 858' ' ' LYS . . . . . 0.722 ' HE3' HD21 ' D' ' 853' ' ' LEU . 7.6 mptt -108.71 114.67 28.67 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.26 -0.427 . . . . 10.0 109.927 179.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.02 138.75 42.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.574 0.226 . . . . 10.0 111.212 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 860' ' ' VAL . . . . . 0.51 HG22 ' CE2' ' D' ' 851' ' ' TYR . 1.6 t -62.99 146.9 12.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.95 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 861' ' ' THR . . . . . 0.494 ' HB ' ' HG3' ' D' ' 852' ' ' ARG . 1.8 t -134.2 160.59 37.39 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.165 179.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -99.35 157.62 16.28 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.502 -0.317 . . . . 10.0 110.417 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -78.79 -29.6 45.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.931 0.395 . . . . 10.0 111.127 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -89.25 50.03 1.86 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.992 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 1.3 m -123.91 153.1 41.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.823 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 866' ' ' ALA . . . . . . . . . . . . . . . -67.59 141.49 56.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.83 0.348 . . . . 10.0 110.811 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 9.9 tp -91.86 -14.4 8.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.183 0.516 . . . . 10.0 111.08 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 868' ' ' ALA . . . . . 0.453 ' N ' ' HD2' ' D' ' 869' ' ' PRO . . . -55.28 -49.37 92.79 Favored Pre-proline 0 CA--C 1.541 0.62 0 N-CA-C 113.795 1.035 . . . . 10.0 113.795 -179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 869' ' ' PRO . . . . . 0.453 ' HD2' ' N ' ' D' ' 868' ' ' ALA . 50.9 Cg_endo -68.89 -13.35 36.58 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 122.143 1.895 . . . . 10.0 113.058 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 870' ' ' LEU . . . . . . . . . . . . . 8.8 mp -85.94 81.93 8.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.257 0.551 . . . . 10.0 110.557 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -139.52 123.4 17.63 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.107 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 87.68 15.6 61.36 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.911 -0.662 . . . . 10.0 112.02 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -127.09 159.44 34.2 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 122.871 -0.194 . . . . 10.0 110.613 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 874' ' ' GLU . . . . . 0.417 ' HB2' ' HB3' ' D' ' 853' ' ' LEU . 2.2 mp0 -102.47 174.07 6.07 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.092 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 93.1 mt -136.56 131.41 33.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.71 -0.223 . . . . 10.0 110.568 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 876' ' ' ILE . . . . . 0.809 HG12 ' HB2' ' D' ' 813' ' ' TYR . 6.5 mt -117.11 129.09 74.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.585 -0.279 . . . . 10.0 110.301 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 877' ' ' VAL . . . . . 0.563 HG11 HD21 ' D' ' 838' ' ' LEU . 24.3 t -102.64 126.92 56.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -140.79 179.22 6.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.95 0.405 . . . . 10.0 111.112 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 20.1 m -81.39 148.11 5.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.55 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 15.3 mt . . . . . 0 C--O 1.254 1.335 0 CA-C-O 118.402 -0.809 . . . . 10.0 111.063 -179.984 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PCW . . . . . 0.788 ' H82' HN1A ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PCW . . . . . 0.637 ' H19' ' HE ' ' D' ' 857' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PCW . . . . . 0.769 ' H61' ' H2 ' ' A' ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PCW . . . . . 0.589 H381 H242 ' A' ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PCW . . . . . 0.796 ' H73' HD22 ' D' ' 853' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PCW . . . . . 0.528 H242 H462 ' A' ' 24' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PCW . . . . . 0.589 H242 H381 ' A' ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PCW . . . . . 0.518 ' H83' ' O2P' ' A' ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PCW . . . . . 0.584 H121 H122 ' A' ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PCW . . . . . 0.819 ' H83' HN1A ' A' ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PCW . . . . . 0.693 H351 ' H40' ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PCW . . . . . 0.666 H232 H452 ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PCW . . . . . 0.814 ' H31' H151 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PCW . . . . . 0.814 H151 ' H31' ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PCW . . . . . 0.46 H151 H182 ' A' ' 15' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PCW . . . . . 0.544 H252 ' H65' ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PCW . . . . . 0.775 ' H41' H322 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PCW . . . . . 0.61 H162 H141 ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PCW . . . . . 0.769 ' H2 ' ' H61' ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PCW . . . . . 0.772 H332 H131 ' A' ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PCW . . . . . 0.753 ' H72' ' H1 ' ' A' ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PCW . . . . . 0.558 ' H2 ' ' H51' ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PCW . . . . . 0.68 H361 H321 ' A' ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PCW . . . . . 0.528 H462 H242 ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PCW . . . . . 0.603 ' H31' ' H72' ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PCW . . . . . 0.75 H441 ' H44' ' A' ' 33' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PCW . . . . . 0.756 H371 H422 ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PCW . . . . . 0.693 ' H40' H351 ' A' ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PCW . . . . . 0.533 H382 H452 ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PCW . . . . . 0.521 ' H73' ' O11' ' A' ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PCW . . . . . 0.429 ' H83' ' O31' ' A' ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PCW . . . . . 0.751 H371 ' H32' ' A' ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' 17F . . . . . 0.75 ' H44' H441 ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' 17F . . . . . 0.611 ' H1A' ' H42' ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' 17F . . . . . 0.788 HN1A ' H82' ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' 17F . . . . . 0.819 HN1A ' H83' ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' 17F . . . . . 0.424 ' H69' H382 ' A' ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' 17F . . . . . 0.751 ' H32' H371 ' A' ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' 17F . . . . . 0.544 ' H65' H252 ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' 17F . . . . . 0.72 ' HN1' ' NZ ' ' B' ' 5' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PCW . . . . . 0.707 H322 H372 ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PCW . . . . . 0.649 H211 H342 ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PCW . . . . . 0.651 H371 ' H10' ' A' ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PCW . . . . . 0.74 ' H12' ' H83' ' A' ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PCW . . . . . 0.859 H132 H331 ' A' ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PCW . . . . . 0.701 H321 H372 ' A' ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PCW . . . . . 0.44 ' H72' ' H42' ' A' ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PCW . . . . . 0.669 H332 H152 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PCW . . . . . 0.575 H211 ' H39' ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PCW . . . . . 0.481 ' H31' ' H4A' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PCW . . . . . 0.452 H471 H281 ' A' ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PCW . . . . . 0.707 H372 H322 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PCW . . . . . 0.663 H151 H362 ' A' ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PCW . . . . . 0.669 H152 H332 ' A' ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PCW . . . . . 0.657 H221 H482 ' A' ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PCW . . . . . 0.575 ' H39' H211 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PCW . . . . . 0.511 ' O11' ' H63' ' A' ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PCW . . . . . 0.634 H162 ' H34' ' A' ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' PCW . . . . . 0.523 H411 H231 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PCW . . . . . 0.607 ' O31' ' H41' ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PCW . . . . . 0.617 H422 H172 ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PCW . . . . . 0.632 H272 H451 ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PCW . . . . . 0.568 H152 H152 ' A' ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PCW . . . . . 0.52 H461 H242 ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PCW . . . . . 0.474 H342 ' H18' ' A' ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PCW . . . . . 0.642 ' H39' ' H66' ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PCW . . . . . 0.513 ' O31' ' H73' ' A' ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PCW . . . . . 0.74 ' H83' ' H12' ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PCW . . . . . 0.623 ' H41' ' O31' ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PCW . . . . . 0.701 H372 H321 ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PCW . . . . . 0.617 H172 H422 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' 17F . . . . . 0.8 ' H57' ' H30' ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' 17F . . . . . 0.642 ' H66' ' H39' ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' 17F . . . . . 0.651 ' H10' H371 ' A' ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' 17F . . . . . 0.458 ' H40' H251 ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' 17F . . . . . 0.634 ' H34' H162 ' A' ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' 17F . . . . . 0.561 ' H52' H461 ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' 17F . . . . . 0.698 ' H49' H261 ' A' ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' 17F . . . . . 0.524 ' H52' H211 ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 201' ' ' GNP . . . . . 0.579 H5'1 ' CD2' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.558 ' HA ' HD13 ' A' ' 204' ' ' LEU . 81.9 mt . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.939 0.4 . . . . 10.0 110.656 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . 0.448 ' NZ ' HG21 ' C' ' 576' ' ' VAL . 17.5 mttm -57.89 -37.21 73.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.452 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 93.6 mt -66.23 -40.27 90.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.67 -0.696 . . . . 10.0 110.253 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . 0.558 HD13 ' HA ' ' A' ' 201' ' ' LEU . 6.5 mp -65.36 -44.92 86.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.494 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -62.48 -38.68 90.82 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.268 0.556 . . . . 10.0 110.107 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . 0.422 ' O ' HG23 ' A' ' 210' ' ' VAL . 25.1 t-20 -68.29 -50.61 52.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.596 -0.729 . . . . 10.0 110.176 179.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 36.2 m0 -60.31 -35.47 75.67 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.084 -0.507 . . . . 10.0 111.891 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -63.29 -43.96 96.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.027 0.441 . . . . 10.0 110.124 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 17.5 m -68.66 -26.16 65.18 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.483 -0.781 . . . . 10.0 110.451 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 206' ' ' ASN . 70.7 t -78.47 -44.01 26.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.052 178.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.35 -40.94 98.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.622 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 3.3 p -64.16 -36.44 84.06 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 121.202 0.525 . . . . 10.0 109.918 179.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 69.8 m -68.38 -41.37 80.68 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.797 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -64.61 -40.53 95.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.35 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 2.5 p -67.0 -41.76 86.16 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 178.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . 0.426 ' HA ' ' HD3' ' A' ' 216' ' ' LYS . 27.8 mmtp -64.98 -38.6 91.49 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.617 -0.512 . . . . 10.0 109.617 178.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 39.2 mt -63.58 -44.72 93.23 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 86.9 mtt180 -65.84 -32.57 74.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.759 179.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -69.28 -20.26 63.91 Favored 'General case' 0 N--CA 1.461 0.107 0 CA-C-O 121.133 0.492 . . . . 10.0 109.983 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.29 -40.02 10.65 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.768 -0.827 . . . . 10.0 108.768 177.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . 0.591 ' HA ' ' HB ' ' A' ' 224' ' ' VAL . 76.2 mt -63.62 -30.07 71.23 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.245 179.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -54.16 -67.27 2.25 Favored Glycine 0 C--N 1.331 0.277 0 N-CA-C 110.82 -0.912 . . . . 10.0 110.82 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -62.47 -34.56 75.59 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.053 1.835 . . . . 10.0 110.94 177.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . 0.591 ' HB ' ' HA ' ' A' ' 221' ' ' LEU . 2.6 t -54.81 -46.86 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-N 116.563 -0.289 . . . . 10.0 111.777 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.515 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 1.5 p -64.32 -34.19 77.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.836 0.351 . . . . 10.0 110.727 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -73.2 -48.66 33.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.164 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -62.36 -43.68 98.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.629 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -65.7 -38.57 89.61 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.777 -0.453 . . . . 10.0 109.777 179.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . 0.515 ' HB2' ' O ' ' A' ' 225' ' ' THR . 0.9 OUTLIER -68.02 -41.02 82.81 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.366 179.211 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -61.94 -37.19 83.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.596 0.712 . . . . 10.0 109.402 178.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 10.5 m-80 -68.85 -43.9 74.49 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.742 -0.836 . . . . 10.0 108.742 177.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 48.8 mt -63.0 -28.73 70.3 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 115.32 -0.855 . . . . 10.0 110.384 178.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 229' ' ' TRP . 57.7 mm-40 -63.84 -40.73 97.27 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.373 179.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . 0.447 ' HD2' ' OD1' ' C' ' 539' ' ' ASN . 42.2 mttp -71.96 -35.29 69.52 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.839 -0.8 . . . . 10.0 108.839 178.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.92 -52.33 60.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.278 -0.873 . . . . 10.0 109.213 178.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 17.8 p -66.58 -32.15 73.3 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.603 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -65.12 -47.56 76.71 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 108.4 -0.963 . . . . 10.0 108.4 178.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -62.03 -45.19 96.62 Favored Glycine 0 N--CA 1.441 -1.016 0 N-CA-C 109.603 -1.399 . . . . 10.0 109.603 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . 0.605 ' HA ' ' HB2' ' A' ' 242' ' ' GLU . 75.2 mt -63.79 -30.54 71.62 Favored 'General case' 0 C--O 1.227 -0.131 0 O-C-N 123.608 0.24 . . . . 10.0 111.153 179.307 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 54.2 mtm-85 -65.35 -50.03 67.14 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.648 -0.871 . . . . 10.0 108.648 178.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -64.73 -40.62 95.63 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.53 -0.915 . . . . 10.0 108.53 178.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . 0.605 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 41.9 mm-40 -58.94 -51.9 68.05 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.202 -0.908 . . . . 10.0 110.715 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 62.3 mtm -63.84 -28.0 69.56 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.795 0.331 . . . . 10.0 110.818 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 56.6 m -70.78 -13.46 62.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.296 178.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 41.8 mttm -109.43 -53.31 2.67 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 108.64 -0.874 . . . . 10.0 108.64 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . 0.472 ' O ' HG23 ' A' ' 250' ' ' VAL . 7.3 t70 -52.14 -64.5 0.79 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.078 -0.965 . . . . 10.0 111.395 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 95.8 mt -57.98 -39.61 78.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.977 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -65.72 -44.45 86.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.682 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -64.85 -40.53 95.31 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.518 -0.549 . . . . 10.0 109.518 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . 0.692 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 54.2 t -62.08 -51.36 73.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.451 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.016 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.457 ' O ' HG12 ' A' ' 254' ' ' VAL . 84.0 mttt -66.16 -46.6 76.86 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.593 0.59 . . . . 10.0 112.593 -179.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.12 -43.87 97.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.187 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -80.32 -24.78 39.7 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.302 0.482 . . . . 10.0 112.302 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.692 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.4 OUTLIER -62.64 -27.52 43.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.924 -0.31 . . . . 10.0 110.728 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . 0.489 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 23.2 mt-30 -61.31 -62.0 6.8 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-N 116.526 -0.306 . . . . 10.0 110.591 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . 0.49 ' O ' ' HB2' ' A' ' 260' ' ' ASP . 32.4 Cg_endo -67.56 -28.51 38.04 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 121.73 1.62 . . . . 10.0 111.569 178.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -66.1 -50.37 64.29 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 109.524 -0.547 . . . . 10.0 109.524 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . 0.414 ' HG ' HG22 ' A' ' 254' ' ' VAL . 41.7 mt -68.92 -37.75 79.13 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.009 -0.542 . . . . 10.0 110.058 179.043 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -61.48 -44.55 96.88 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.497 -0.557 . . . . 10.0 109.497 178.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . 0.49 ' HB2' ' O ' ' A' ' 256' ' ' PRO . 9.4 t0 -58.57 -49.08 78.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.506 179.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -65.39 -46.39 80.26 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 115.466 -0.788 . . . . 10.0 110.934 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -58.93 -52.47 65.61 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 111.888 0.329 . . . . 10.0 111.888 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -57.05 -46.39 82.47 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 120.782 0.325 . . . . 10.0 111.289 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 0.1 OUTLIER -70.08 -38.28 75.68 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.639 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 15.3 t90 -66.43 -36.58 83.17 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 179.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . 0.444 ' O ' ' HB2' ' A' ' 270' ' ' GLU . 28.0 mt-30 -63.23 -42.21 99.21 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.465 -0.939 . . . . 10.0 108.465 178.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -66.56 -39.78 88.69 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.855 -0.795 . . . . 10.0 108.855 178.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . 0.45 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 22.9 mt-10 -60.21 -49.65 76.77 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.818 178.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 79.4 mmm -65.29 -44.67 87.22 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.703 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . 0.466 ' HG3' HH12 ' A' ' 273' ' ' ARG . 0.4 OUTLIER -60.91 -49.74 76.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.917 179.6 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . 0.467 ' O ' ' HG2' ' A' ' 275' ' ' LYS . 59.4 mt -64.2 -44.03 93.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.298 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . 0.49 ' O ' HG23 ' A' ' 276' ' ' VAL . 26.6 t80 -60.67 -47.35 86.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.222 -0.444 . . . . 10.0 109.979 179.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . 0.466 HH12 ' HG3' ' A' ' 270' ' ' GLU . 32.1 ttm105 -65.14 -37.34 87.11 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.125 0.488 . . . . 10.0 110.083 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . 0.418 ' HB2' ' O ' ' A' ' 270' ' ' GLU . 0.0 OUTLIER -63.08 -35.81 81.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.403 -0.817 . . . . 10.0 109.559 178.885 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.567 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 25.9 mmtp -80.84 -34.57 33.74 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.138 178.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 272' ' ' TYR . 12.0 t -51.78 -44.92 37.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 N-CA-C 112.112 0.412 . . . . 10.0 112.112 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . 0.44 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 54.0 mt-10 -50.6 -64.05 1.52 Allowed Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 112.613 0.597 . . . . 10.0 112.613 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . 0.519 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 50.2 Cg_endo -70.89 -35.93 8.57 Favored 'Trans proline' 0 C--N 1.355 0.91 0 C-N-CA 121.846 1.698 . . . . 10.0 113.031 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.641 HD22 ' HG2' ' C' ' 495' ' ' LYS . 28.5 mt -63.71 -39.78 95.15 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 121.031 -0.268 . . . . 10.0 111.0 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -73.86 -29.72 62.27 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.952 -0.759 . . . . 10.0 108.952 178.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . 0.422 ' O ' ' HG3' ' A' ' 285' ' ' GLU . . . -64.45 -44.52 90.85 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.89 -0.782 . . . . 10.0 108.89 178.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 65.7 mt-10 -58.9 -42.27 89.16 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 108.711 -0.848 . . . . 10.0 108.711 178.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 95.0 mt -63.36 -46.16 87.81 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.244 -0.889 . . . . 10.0 110.431 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . 0.406 HE21 ' HB3' ' A' ' 284' ' ' GLN . 16.6 mt-30 -62.27 -54.1 45.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.897 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 281' ' ' ALA . 21.7 mt-10 -60.82 -44.74 96.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.08 0.467 . . . . 10.0 110.504 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.02 -44.07 97.91 Favored Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.689 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.83 -39.39 93.49 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 109.919 -0.4 . . . . 10.0 109.919 179.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . 0.57 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 96.8 mtt180 -60.07 -42.57 94.83 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.476 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 14.1 tm0? -67.07 -49.69 64.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.176 -0.466 . . . . 10.0 109.999 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 33.6 mttp -59.42 -47.1 86.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.501 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 77.8 mt -66.31 -35.42 80.34 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.455 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . 0.57 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 20.5 t60 -60.41 -50.17 74.64 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 297' ' ' LYS . 0.4 OUTLIER -64.12 -36.47 84.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.854 179.497 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 83.0 mt -71.51 -38.64 71.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.995 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -66.83 -41.93 86.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.473 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -77.72 2.37 17.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.268 0.556 . . . . 10.0 110.24 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . 1.034 ' HE2' ' HG ' ' C' ' 477' ' ' LEU . 29.3 tttp -105.25 -37.45 6.88 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.859 -0.793 . . . . 10.0 108.859 178.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 13.7 mt -68.45 -24.57 64.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.359 -0.837 . . . . 10.0 111.053 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -62.59 1.71 Allowed Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.495 -0.32 . . . . 10.0 111.851 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -68.06 -51.55 0.61 Allowed 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 122.055 1.837 . . . . 10.0 112.445 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.812 HD13 ' HG2' ' C' ' 473' ' ' LYS . 60.2 mt -66.98 -26.65 66.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.704 0.287 . . . . 10.0 111.171 -179.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -75.81 -40.11 31.98 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 109.35 -1.5 . . . . 10.0 109.35 177.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -64.65 -43.86 92.3 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.767 -0.827 . . . . 10.0 108.767 178.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -62.62 -40.15 96.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.441 -0.799 . . . . 10.0 108.909 178.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 14.7 tpt -61.75 -41.82 98.17 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 115.693 -0.685 . . . . 10.0 109.368 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 -64.78 -42.88 94.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.473 . . . . 10.0 109.963 178.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -63.44 -46.84 84.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.251 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . 0.672 ' HG3' HD21 ' C' ' 469' ' ' LEU . 16.5 mmt180 -68.19 -33.67 74.87 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.406 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . 0.401 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -65.5 -39.34 91.77 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 178.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' A' ' 314' ' ' ASP . 44.8 mtt85 -60.22 -47.22 86.91 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.031 -0.729 . . . . 10.0 109.031 178.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -64.68 -43.09 94.68 Favored 'General case' 0 C--O 1.226 -0.184 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 178.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . 0.709 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 0.4 OUTLIER -53.45 -54.42 37.3 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.424 -0.807 . . . . 10.0 110.331 179.052 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 39.9 t -73.84 -38.68 50.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.396 -0.82 . . . . 10.0 112.053 -178.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . 0.531 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 1.3 m-20 -63.51 -40.95 98.41 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.889 0.376 . . . . 10.0 110.632 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -66.76 -28.99 68.85 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 177.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 19.2 mt -74.28 -40.65 62.17 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.191 -0.913 . . . . 10.0 109.131 178.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -62.19 -47.1 85.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.975 0.416 . . . . 10.0 110.345 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 1.4 p -66.9 -15.24 63.52 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.618 -0.719 . . . . 10.0 111.664 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -103.27 -38.19 7.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.087 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . 0.44 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 39.9 mt -64.82 -34.72 79.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.387 -0.369 . . . . 10.0 111.19 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.94 -60.82 8.37 Favored Pre-proline 0 CA--C 1.535 0.395 0 O-C-N 123.213 0.32 . . . . 10.0 110.541 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -65.16 -30.06 55.51 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 121.524 1.482 . . . . 10.0 111.08 177.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . 0.44 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 4.2 m-30 -61.8 -56.42 19.67 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 110.249 -0.278 . . . . 10.0 110.249 178.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . 0.405 ' HA ' ' HB2' ' A' ' 327' ' ' LEU . 17.0 p -66.72 -36.55 82.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.924 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -63.07 -48.61 77.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.3 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -71.57 -22.53 61.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.889 0.376 . . . . 10.0 110.009 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . 0.506 HD23 ' HG3' ' A' ' 330' ' ' ARG . 14.2 mt -69.98 -28.09 65.24 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 177.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -65.0 -39.73 93.9 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 107.323 -1.362 . . . . 10.0 107.323 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -64.93 -39.56 93.69 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.007 -0.997 . . . . 10.0 108.729 177.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . 0.69 ' O ' ' HG2' ' A' ' 334' ' ' ARG . 10.5 mmt180 -62.19 -53.4 55.84 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 108.658 -0.867 . . . . 10.0 108.658 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . 0.421 ' O ' ' HB2' ' A' ' 335' ' ' LEU . 95.6 mt -54.59 -44.01 72.65 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.454 -0.793 . . . . 10.0 110.366 179.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . 0.409 ' O ' ' HG3' ' A' ' 336' ' ' GLU . . . -62.97 -48.55 78.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.412 -0.358 . . . . 10.0 110.522 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.18 -45.64 90.5 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.592 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . 0.69 ' HG2' ' O ' ' A' ' 330' ' ' ARG . 4.0 mmt85 -66.68 -46.2 76.41 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.942 179.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 331' ' ' LEU . 5.2 mt -60.43 -41.37 93.85 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.797 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 332' ' ' ALA . 89.0 mt-10 -58.72 -44.53 90.42 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.901 -0.407 . . . . 10.0 109.901 178.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -68.77 -42.53 77.31 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.662 -0.496 . . . . 10.0 109.662 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . 0.491 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 71.6 mt -65.49 -24.38 67.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.398 179.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -89.5 -38.28 14.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.883 0.373 . . . . 10.0 110.841 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -72.94 -53.78 10.38 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.128 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -71.06 -32.52 69.23 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.509 -0.922 . . . . 10.0 108.509 178.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . 0.491 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -63.46 -46.37 92.71 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.344 -0.844 . . . . 10.0 111.121 179.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.72 -41.2 98.92 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 109.975 -1.25 . . . . 10.0 109.975 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.62 -44.18 91.36 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . 0.496 ' HD3' ' OE2' ' C' ' 433' ' ' GLU . 22.5 mtm180 -58.57 -45.07 89.81 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.397 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 87.4 mt -63.09 -51.25 67.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.816 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.24 -44.64 95.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.155 0.502 . . . . 10.0 110.373 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . 0.626 ' HB3' ' HZ1' ' A' ' 352' ' ' LYS . 27.8 mt-10 -65.5 -43.34 90.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.88 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -62.48 -36.22 81.79 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -64.86 -46.94 79.72 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.548 -0.538 . . . . 10.0 109.548 178.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -65.1 -41.46 94.95 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.246 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . 0.717 ' HZ2' ' HB3' ' C' ' 425' ' ' GLU . 16.1 mtmm -71.82 -16.91 62.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.481 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -86.67 -42.43 13.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.55 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.63 -40.29 96.52 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.948 -0.39 . . . . 10.0 109.948 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . 0.436 ' HA ' ' OG ' ' A' ' 358' ' ' SER . 5.4 mm-40 -71.14 -27.79 63.81 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.419 0.628 . . . . 10.0 109.461 178.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . 0.515 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 0.1 OUTLIER -73.75 -33.75 64.44 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.467 -0.938 . . . . 10.0 108.467 178.309 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 82.4 mt -78.68 -38.23 39.8 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.136 -0.938 . . . . 10.0 111.747 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . 0.436 ' OG ' ' HA ' ' A' ' 355' ' ' GLU . 1.9 p -63.11 -45.89 89.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.923 0.392 . . . . 10.0 109.967 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . 0.592 ' HA ' ' OE1' ' A' ' 362' ' ' GLU . 17.6 p -71.96 -15.98 62.08 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.473 0.654 . . . . 10.0 109.256 178.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 356' ' ' HIS . 18.6 tp -84.32 -28.87 26.78 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.396 -0.82 . . . . 10.0 109.118 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 3.1 m -64.71 -34.27 77.92 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.107 -1.071 . . . . 10.0 108.107 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . 0.592 ' OE1' ' HA ' ' A' ' 359' ' ' THR . 32.5 mt-10 -73.55 -0.08 14.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.703 -1.135 . . . . 10.0 110.538 178.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.658 ' HG2' HG22 ' C' ' 411' ' ' THR . 55.4 mttp -115.38 -37.06 4.13 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.548 -0.908 . . . . 10.0 108.548 177.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -75.29 -14.78 60.53 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.591 -0.731 . . . . 10.0 111.72 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.93 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 94.0 mttt -110.64 -71.19 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 120.73 -0.388 . . . . 10.0 112.028 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.93 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 40.7 Cg_exo -59.4 -52.22 5.11 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.06 1.84 . . . . 10.0 112.322 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . 0.587 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -62.82 -40.24 96.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.561 0.22 . . . . 10.0 111.468 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.75 -43.21 94.06 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.975 -0.38 . . . . 10.0 109.975 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . 0.599 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 16.0 mt-10 -65.34 -34.82 79.22 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 109.744 -0.465 . . . . 10.0 109.744 178.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -44.7 91.96 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 178.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 82.5 mt -62.29 -40.71 97.16 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.333 178.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.574 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 65.0 mtt180 -62.91 -43.68 98.14 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.249 -0.648 . . . . 10.0 109.249 178.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.599 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.3 mt-30 -62.33 -26.61 68.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.257 -0.883 . . . . 20.0 112.564 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -89.23 -38.63 6.67 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 109.684 -1.366 . . . . 10.0 109.684 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 31.9 mt -58.1 -35.88 72.08 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.706 0.262 . . . . 10.0 111.706 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 35.3 mt -55.96 -65.38 1.56 Allowed Pre-proline 0 CA--C 1.538 0.507 0 N-CA-C 111.612 0.227 . . . . 10.0 111.612 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.545 ' HD3' ' HB2' ' A' ' 376' ' ' LEU . 37.9 Cg_endo -66.9 -30.53 39.86 Favored 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 122.069 1.846 . . . . 10.0 111.783 179.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 4.3 t -64.89 -48.91 82.35 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 CA-C-O 120.514 0.197 . . . . 10.0 110.567 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 41.6 mt -64.22 -35.61 81.39 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . 0.442 ' HG3' ' O ' ' A' ' 376' ' ' LEU . 19.4 mt-10 -66.25 -53.7 33.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.799 178.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 5.5 p -60.54 -38.05 83.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.861 0.362 . . . . 10.0 110.464 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -63.12 -49.32 74.89 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.923 -0.58 . . . . 10.0 109.835 178.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -62.89 -42.22 99.69 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 116.483 -0.326 . . . . 10.0 110.863 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 48.0 t -58.43 -47.3 88.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 12.7 m -69.42 -38.96 78.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.148 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . 0.469 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 3.3 m-85 -67.36 -49.46 63.89 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.688 0.255 . . . . 10.0 111.688 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 92.1 mt -59.82 -41.34 91.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.49 -0.323 . . . . 10.0 111.233 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . 0.429 ' HA ' ' OE1' ' A' ' 391' ' ' GLU . 22.6 p -72.23 -31.45 65.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.112 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -73.39 -33.89 65.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.904 0.383 . . . . 10.0 110.087 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 83.4 mt -60.2 -28.35 67.9 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.331 0.586 . . . . 10.0 109.913 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . 0.429 ' OE1' ' HA ' ' A' ' 388' ' ' SER . 39.0 mt-10 -65.78 -40.19 91.73 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.365 -0.834 . . . . 10.0 109.688 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . 0.548 ' HA ' ' HE3' ' A' ' 395' ' ' LYS . 0.7 OUTLIER -62.37 -47.4 84.34 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 120.86 0.362 . . . . 10.0 110.43 179.413 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -58.1 -46.32 85.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.465 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 10.5 m -65.21 -41.85 94.08 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.224 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . 0.548 ' HE3' ' HA ' ' A' ' 392' ' ' GLU . 50.5 mtmt -64.9 -41.34 95.68 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.631 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . 0.519 ' HE3' ' HB2' ' C' ' 587' ' ' ALA . 0.1 OUTLIER -82.87 -12.49 57.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.633 0.605 . . . . 10.0 112.633 -178.606 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . 0.85 ' O ' ' HB2' ' A' ' 398' ' ' ASN . 8.5 mt -76.69 -19.57 57.57 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.259 0.552 . . . . 10.0 110.415 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . 0.85 ' HB2' ' O ' ' A' ' 397' ' ' LEU . 98.9 m-20 . . . . . 0 C--N 1.326 -0.417 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.281 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 46.8 mt . . . . . 0 C--O 1.235 0.335 0 CA-C-O 121.18 0.514 . . . . 10.0 110.385 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -69.88 -39.55 76.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.503 -0.771 . . . . 10.0 110.079 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 82.1 mt -68.08 -37.02 80.75 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.24 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 81.5 mt -66.04 -42.81 89.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.699 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -46.46 85.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.453 0.644 . . . . 10.0 109.857 179.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . 0.447 ' O ' HG23 ' C' ' 408' ' ' VAL . 11.0 t-20 -62.92 -48.19 80.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.969 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 16.4 t90 -58.08 -37.74 75.05 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.104 -0.498 . . . . 10.0 112.173 -179.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -60.47 -41.39 94.09 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.071 0.462 . . . . 10.0 110.378 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 6.1 m -73.69 -19.93 60.68 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.595 -0.729 . . . . 10.0 110.623 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . 0.447 HG23 ' O ' ' C' ' 404' ' ' ASN . 54.6 t -74.19 -34.12 36.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.262 -0.644 . . . . 10.0 109.262 178.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.83 -39.37 83.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.188 178.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -44.46 84.3 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.176 -0.465 . . . . 10.0 109.949 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . 0.658 HG22 ' HG2' ' A' ' 363' ' ' LYS . 2.2 p -66.49 -32.45 73.82 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.168 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.37 -39.32 92.13 Favored 'General case' 0 CA--C 1.521 -0.172 0 N-CA-C 108.494 -0.928 . . . . 10.0 108.494 177.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . 0.437 ' C ' ' H ' ' C' ' 415' ' ' LEU . 73.5 m -64.9 -38.13 89.93 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 177.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -72.97 10.42 0.91 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.801 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . 0.437 ' H ' ' C ' ' C' ' 413' ' ' SER . 69.3 mt -124.78 -48.74 1.77 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.335 -0.987 . . . . 10.0 108.335 178.009 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -65.9 -49.69 67.14 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.231 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -69.14 -22.7 63.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.272 0.558 . . . . 10.0 109.883 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.93 -36.77 30.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.61 -0.723 . . . . 10.0 109.654 179.386 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 22.9 mt -60.69 -29.61 69.42 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.96 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -51.48 -73.85 0.34 Allowed Glycine 0 CA--C 1.519 0.332 0 C-N-CA 121.272 -0.49 . . . . 10.0 112.145 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.91 -36.06 98.85 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.629 2.219 . . . . 10.0 111.738 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 38.8 t -60.61 -49.8 82.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.795 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 23.9 p -70.89 -36.28 72.68 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.405 0.145 . . . . 10.0 110.728 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -55.94 -50.14 71.56 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.785 -0.821 . . . . 10.0 108.785 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . 0.717 ' HB3' ' HZ2' ' A' ' 352' ' ' LYS . 63.0 mt-10 -69.0 -40.76 78.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.18 -0.918 . . . . 10.0 109.93 178.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -58.54 -44.09 89.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.096 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . 0.483 ' O ' ' HG3' ' C' ' 431' ' ' GLU . 62.9 m95 -64.81 -38.93 92.63 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 178.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -63.53 -41.49 98.47 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.756 -0.831 . . . . 10.0 108.756 178.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . 0.675 ' HA ' ' HD2' ' C' ' 432' ' ' LYS . 23.6 t-20 -64.82 -43.66 92.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.337 -0.847 . . . . 10.0 109.463 178.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 33.4 mt -60.22 -35.06 74.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.052 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' C' ' 427' ' ' TRP . 51.2 mt-10 -65.94 -45.3 82.34 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 178.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . 0.675 ' HD2' ' HA ' ' C' ' 429' ' ' ASN . 32.0 mttt -57.35 -46.33 83.44 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 108.57 -0.9 . . . . 10.0 108.57 178.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . 0.496 ' OE2' ' HD3' ' A' ' 345' ' ' ARG . 5.9 mm-40 -60.11 -49.06 79.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.025 -0.988 . . . . 10.0 110.652 179.046 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 27.0 m -61.36 -44.75 96.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.438 -0.346 . . . . 10.0 111.002 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -64.79 -40.8 95.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.909 0.385 . . . . 10.0 110.215 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.94 -47.36 83.56 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.045 -1.222 . . . . 10.0 110.045 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 71.0 mt -60.71 -33.0 72.23 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -64.65 -48.79 73.53 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -62.99 -37.68 88.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.183 0.516 . . . . 10.0 110.08 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . 0.648 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 48.3 mt-10 -67.66 -55.75 12.04 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.685 -0.688 . . . . 10.0 110.38 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 71.6 mtm -68.13 -28.37 67.26 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 114.555 1.317 . . . . 10.0 114.555 -177.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.8 p -62.48 -43.6 98.41 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.013 -0.675 . . . . 10.0 109.642 179.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -78.22 -42.28 31.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.165 178.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . 0.466 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 2.9 t70 -57.62 -58.1 9.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.206 -0.906 . . . . 10.0 111.448 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . 0.433 ' O ' ' HG3' ' C' ' 449' ' ' LYS . 93.0 mt -64.39 -41.58 96.59 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.077 0.399 . . . . 10.0 112.077 -178.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -62.57 -48.17 80.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.027 0.441 . . . . 10.0 110.021 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -68.61 -25.17 64.73 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 179.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . 0.432 ' HB ' ' HA ' ' C' ' 445' ' ' LEU . 1.1 t -64.75 -42.84 96.08 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 N-CA-C 108.842 -0.799 . . . . 10.0 108.842 177.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' C' ' 445' ' ' LEU . 88.4 mttt -65.91 -34.53 78.33 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.225 -0.657 . . . . 10.0 109.225 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -81.0 0.21 36.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.4 -0.818 . . . . 10.0 111.265 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . 0.487 ' C ' ' HD2' ' C' ' 454' ' ' PRO . 56.7 mttm -117.47 -37.66 3.46 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.625 179.019 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 25.2 t -62.76 -41.41 92.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.28 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . 0.6 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 41.0 mt-30 -57.93 -58.52 18.01 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 116.665 -0.243 . . . . 10.0 110.701 178.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . 0.6 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 52.9 Cg_exo -60.32 -36.44 87.5 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 122.199 1.932 . . . . 10.0 110.931 178.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -60.9 -49.38 77.71 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.876 179.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 53.8 mt -70.54 -37.78 74.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.985 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -63.66 -47.61 80.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.096 0.474 . . . . 10.0 109.97 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . 0.75 ' HA ' ' HE3' ' C' ' 461' ' ' LYS . 28.5 t0 -68.73 -32.91 73.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.688 179.102 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -66.13 -42.75 88.69 Favored 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 108.446 -0.946 . . . . 10.0 108.446 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -62.74 -46.17 89.3 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.039 -0.726 . . . . 10.0 109.039 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . 0.75 ' HE3' ' HA ' ' C' ' 458' ' ' ASP . 12.9 mtmt -57.13 -42.42 80.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.604 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 13.7 mtmm -72.57 -40.55 66.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.358 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -22.3 65.01 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.882 179.401 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . 0.507 ' OE1' ' HA ' ' C' ' 461' ' ' LYS . 64.3 mt-30 -69.92 -44.2 70.12 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 107.949 -1.13 . . . . 10.0 107.949 177.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 1.262 ' O ' ' CG ' ' C' ' 469' ' ' LEU . 26.0 mt-10 -68.72 -32.07 71.59 Favored 'General case' 0 C--O 1.226 -0.165 0 N-CA-C 108.895 -0.78 . . . . 10.0 108.895 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -69.78 -55.27 10.31 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.564 -0.743 . . . . 10.0 109.989 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 45.1 tpp -61.26 -56.95 14.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.628 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -63.63 -40.69 97.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.642 0.258 . . . . 10.0 110.478 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 1.262 ' CG ' ' O ' ' C' ' 465' ' ' GLU . 96.4 mt -59.04 -47.4 85.35 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 115.836 -0.62 . . . . 20.0 110.438 179.087 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -68.02 -34.58 76.76 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.493 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -65.89 -43.61 87.78 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.21 -0.663 . . . . 10.0 109.21 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -69.24 -8.77 48.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.076 179.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . 0.812 ' HG2' HD13 ' A' ' 301' ' ' LEU . 92.5 mttt -101.99 -51.76 3.33 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.048 178.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 69.3 t -67.16 -39.87 84.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.599 -0.728 . . . . 10.0 112.876 -178.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -54.4 -58.88 11.92 Favored Pre-proline 0 N--CA 1.464 0.264 0 C-N-CA 120.916 -0.314 . . . . 10.0 111.693 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -68.64 -28.01 31.67 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 121.378 1.385 . . . . 10.0 110.555 178.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . 1.034 ' HG ' ' HE2' ' A' ' 297' ' ' LYS . 0.6 OUTLIER -65.76 -40.83 92.46 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.631 -0.507 . . . . 10.0 109.631 179.372 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . 0.644 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 17.7 ttm180 -62.95 -34.67 77.99 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.02 -0.733 . . . . 10.0 109.02 179.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -70.12 -49.55 49.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.004 -0.543 . . . . 10.0 109.948 178.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . 0.536 ' CD ' ' HZ3' ' A' ' 297' ' ' LYS . 23.8 mt-10 -62.83 -46.49 87.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.235 179.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 31.9 mt -66.08 -32.68 74.28 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.951 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . 0.644 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 4.2 tt0 -68.59 -41.46 79.59 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -70.43 -38.36 74.55 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 178.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -67.12 -32.89 81.63 Favored Glycine 0 N--CA 1.442 -0.909 0 N-CA-C 109.757 -1.337 . . . . 10.0 109.757 177.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . 0.59 ' HA ' ' HG2' ' C' ' 488' ' ' LYS . . . -73.09 -43.47 61.74 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 178.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 64.5 mtt180 -63.28 -38.65 91.99 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.847 -0.797 . . . . 10.0 108.847 178.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -50.41 64.24 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.49 177.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . 0.59 ' HG2' ' HA ' ' C' ' 485' ' ' ALA . 52.8 pttt -62.83 -32.7 73.96 Favored 'General case' 0 C--O 1.225 -0.193 0 O-C-N 123.292 0.37 . . . . 10.0 110.252 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 30.9 mt -69.56 -38.39 77.42 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -68.12 -41.97 80.91 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.204 -1.036 . . . . 10.0 108.204 177.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . 0.448 ' O ' ' HG3' ' C' ' 495' ' ' LYS . 36.6 mt-10 -61.27 -47.17 87.24 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.134 -0.939 . . . . 10.0 108.63 178.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 43.1 mt -65.79 -40.56 92.07 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.918 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -60.4 -45.5 93.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.013 0.435 . . . . 10.0 110.467 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -80.25 10.9 3.94 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.882 -179.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.641 ' HG2' HD22 ' A' ' 279' ' ' LEU . 12.5 mttm -120.13 -46.06 2.43 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.525 -0.761 . . . . 10.0 108.979 177.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 94.1 mt -69.67 -34.82 74.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.701 -0.681 . . . . 10.0 111.719 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 13.3 m -65.3 -58.25 12.75 Favored Pre-proline 0 CA--C 1.537 0.467 0 C-N-CA 120.682 -0.407 . . . . 10.0 111.297 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.56 -47.44 11.49 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 121.727 1.618 . . . . 10.0 111.588 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . 0.404 ' HA ' ' HB2' ' C' ' 502' ' ' GLU . 73.3 mt -66.63 -31.51 72.23 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-O 120.679 0.276 . . . . 10.0 111.213 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.29 -48.77 61.68 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 110.038 -1.225 . . . . 10.0 110.038 178.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -65.92 -39.88 90.94 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.244 -0.65 . . . . 10.0 109.244 178.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . 0.416 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 10.8 mt-10 -60.31 -52.79 63.77 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.602 178.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . 0.658 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 42.8 mmm -57.95 -36.45 72.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.679 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 74.4 mtt180 -66.46 -43.48 85.39 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.898 -0.408 . . . . 10.0 109.898 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . 0.589 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 0.9 OUTLIER -66.73 -41.16 88.31 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 178.687 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.658 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 41.1 mtt180 -62.01 -42.98 99.74 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 178.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -63.79 -36.45 83.92 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.409 -0.814 . . . . 10.0 110.114 178.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . 0.589 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 67.5 mtt180 -62.58 -42.59 99.65 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.878 -0.786 . . . . 10.0 108.878 178.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -86.5 19.52 2.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.962 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -131.15 -53.43 1.04 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.996 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 86.5 t -68.12 -47.61 77.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.164 -0.471 . . . . 10.0 109.999 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.44 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 0.5 OUTLIER -66.23 -33.44 75.76 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 108.874 -0.788 . . . . 10.0 108.874 178.895 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -64.86 -50.07 68.06 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 107.671 -1.233 . . . . 10.0 107.671 177.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 21.2 mt -59.26 -35.52 73.85 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.736 178.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . 0.44 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 89.3 mtt180 -59.34 -53.75 54.6 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.779 -0.823 . . . . 10.0 108.779 177.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.59 14.56 0.99 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.608 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . 0.478 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 4.6 m-70 -126.43 -38.03 2.14 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 122.136 -0.353 . . . . 10.0 110.363 179.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 84.6 mt -87.69 -33.97 18.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.56 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -58.28 -57.88 22.99 Favored Pre-proline 0 C--N 1.33 -0.272 0 C-N-CA 121.174 -0.211 . . . . 10.0 111.499 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.61 -36.52 63.75 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 121.444 1.429 . . . . 10.0 110.613 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . 0.478 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 22.1 t80 -61.46 -46.46 89.95 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.895 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . 0.424 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 6.3 p -67.6 -31.1 70.9 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.969 -0.382 . . . . 10.0 109.969 179.225 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -67.76 -41.92 82.58 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.884 -0.784 . . . . 10.0 108.884 178.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . 0.431 ' O ' ' HG3' ' C' ' 528' ' ' ARG . 4.3 mt-10 -67.12 -37.8 84.49 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 177.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . 0.472 HD23 ' HD2' ' C' ' 528' ' ' ARG . 21.3 mt -62.58 -32.26 73.22 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.401 -0.818 . . . . 10.0 109.809 178.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . 0.424 ' HG3' ' O ' ' C' ' 522' ' ' SER . 71.4 mtt180 -65.74 -37.99 87.89 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.386 -0.598 . . . . 10.0 109.386 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -68.64 -43.59 75.98 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.593 -0.891 . . . . 10.0 108.593 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . 0.472 ' HD2' HD23 ' C' ' 525' ' ' LEU . 80.8 mtt180 -61.54 -43.95 97.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.808 -1.087 . . . . 10.0 109.466 178.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 30.2 mt -65.16 -35.99 82.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.719 -0.673 . . . . 10.0 109.793 178.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.86 -46.65 86.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.095 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.66 -44.65 77.35 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.53 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 10.2 mtt180 -62.14 -46.0 90.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.672 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 47.9 mt -67.52 -32.69 73.66 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.505 -0.316 . . . . 10.0 110.537 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -64.68 -44.62 89.77 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.224 -0.658 . . . . 10.0 109.224 178.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.59 -41.53 96.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.428 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 83.9 mt -65.49 -28.97 69.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.67 178.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -77.57 -43.89 30.29 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.86 -0.422 . . . . 10.0 109.86 178.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -62.33 -48.58 79.19 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.714 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . 0.447 ' OD1' ' HD2' ' A' ' 234' ' ' LYS . 95.7 m-20 -71.21 -35.3 71.48 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 115.479 -0.782 . . . . 10.0 109.458 178.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . 0.41 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -60.27 -45.98 95.11 Favored Glycine 0 N--CA 1.445 -0.737 0 N-CA-C 111.279 -0.728 . . . . 10.0 111.279 178.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.85 99.69 Favored Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 111.048 -0.821 . . . . 10.0 111.048 179.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.81 -45.26 82.98 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' C' ' 543' ' ' ARG . 53.4 mtt180 -61.5 -39.7 91.9 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.715 179.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 75.4 mt -60.1 -42.26 94.29 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 178.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -68.51 -45.36 72.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.754 -0.657 . . . . 10.0 109.323 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.03 -51.88 67.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.522 -0.763 . . . . 10.0 110.208 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -60.45 -38.8 85.31 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.162 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -67.66 -41.72 83.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.054 0.454 . . . . 10.0 110.703 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.62 -50.54 64.66 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' C' ' 554' ' ' HIS . 0.0 OUTLIER -63.01 -32.96 74.44 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.885 179.567 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.21 -43.15 92.45 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.647 -0.501 . . . . 10.0 109.647 178.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 25.3 m -63.52 -45.0 92.62 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.489 -0.56 . . . . 10.0 109.489 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -64.41 -39.62 94.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.46 178.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . 0.456 ' HB2' ' O ' ' C' ' 550' ' ' LYS . 16.5 t-80 -64.3 -41.55 96.79 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.616 -0.72 . . . . 10.0 110.124 178.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 79.7 mt -68.6 -38.23 80.44 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.483 -0.326 . . . . 10.0 110.429 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 19.3 m -66.91 -39.05 87.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.396 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 3.2 p -73.95 -25.37 59.91 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.36 179.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' C' ' 554' ' ' HIS . 32.8 mt -75.84 -41.27 52.99 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 108.738 -0.838 . . . . 10.0 108.738 177.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . 0.58 ' HA ' ' HB3' ' C' ' 562' ' ' ALA . 47.0 m -61.53 -25.95 67.62 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.526 -0.761 . . . . 10.0 110.819 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -61.29 -21.94 64.4 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.839 -0.619 . . . . 10.0 110.51 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -117.43 -21.72 8.52 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.886 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . 0.58 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -66.42 -21.72 66.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.87 179.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . 0.936 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 86.7 mttt -109.89 -67.59 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.596 178.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . 0.936 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 31.2 Cg_exo -61.25 -54.56 1.7 Allowed 'Trans proline' 0 C--N 1.357 0.982 0 C-N-CA 122.164 1.91 . . . . 10.0 113.098 -179.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . 0.422 ' O ' ' HG ' ' C' ' 569' ' ' LEU . . . -63.04 -44.64 95.32 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.925 -0.31 . . . . 10.0 111.685 -179.274 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . 0.451 HD23 ' HA ' ' C' ' 566' ' ' LEU . 4.1 mt -60.63 -40.94 93.81 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-O 120.756 0.312 . . . . 10.0 110.356 178.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . 0.712 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 20.0 mm-40 -64.79 -37.62 88.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.306 178.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.29 -39.96 78.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.942 178.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' C' ' 565' ' ' ALA . 78.2 mt -61.6 -44.7 96.52 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.25 -0.648 . . . . 10.0 109.25 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -65.0 -38.6 91.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.514 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . 0.712 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.3 mt-30 -70.05 -18.24 63.28 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.745 -0.661 . . . . 20.0 112.584 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -94.2 -35.55 5.99 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 108.961 -1.656 . . . . 10.0 108.961 178.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . 0.632 ' HA ' HG12 ' C' ' 576' ' ' VAL . 63.5 mt -67.51 -40.92 85.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.366 -0.417 . . . . 10.0 111.82 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 94.5 mt -53.79 -60.75 6.48 Favored Pre-proline 0 CA--C 1.534 0.364 0 N-CA-C 112.418 0.525 . . . . 10.0 112.418 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -66.34 -36.41 27.64 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 121.744 1.629 . . . . 10.0 112.401 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . 0.632 HG12 ' HA ' ' C' ' 573' ' ' LEU . 1.9 p -67.3 -37.43 79.05 Favored 'Isoleucine or valine' 0 C--N 1.34 0.165 0 C-N-CA 120.434 -0.506 . . . . 10.0 111.411 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . 0.489 ' O ' ' HG3' ' C' ' 581' ' ' LYS . 6.2 mt -63.31 -41.14 98.92 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.178 -0.675 . . . . 10.0 109.178 178.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . 0.473 ' O ' HG23 ' C' ' 582' ' ' VAL . 43.0 mt-10 -64.5 -45.45 87.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.515 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 3.9 p -67.28 -31.15 71.28 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 121.165 0.507 . . . . 10.0 110.14 178.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.06 -35.98 74.65 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.764 -0.828 . . . . 10.0 108.764 178.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' C' ' 577' ' ' LEU . 87.8 mttt -63.97 -37.92 89.19 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.383 178.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . 0.473 HG23 ' O ' ' C' ' 578' ' ' GLU . 58.4 t -62.59 -43.26 98.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 N-CA-C 108.895 -0.78 . . . . 10.0 108.895 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 8.6 m -66.07 -40.01 90.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.407 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -69.36 -48.61 60.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.109 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . 0.484 ' O ' ' HG3' ' C' ' 589' ' ' GLU . 76.9 mt -57.63 -47.79 81.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.626 -0.261 . . . . 10.0 110.706 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 25.9 p -61.45 -42.39 98.68 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . 0.519 ' HB2' ' HE3' ' A' ' 396' ' ' LYS . . . -62.31 -44.0 97.53 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.235 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 91.5 mt -57.63 -44.98 85.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.471 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . 0.525 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 45.5 mt-10 -67.08 -53.14 33.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.977 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -58.09 -47.03 84.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.208 -0.451 . . . . 10.0 112.075 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -63.03 -43.68 98.05 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.355 0.502 . . . . 10.0 112.355 -179.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 10.2 p -65.11 -29.28 70.13 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.807 -0.357 . . . . 10.0 111.427 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . 0.525 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 89.6 mttt -68.67 -22.45 64.38 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.082 0.467 . . . . 10.0 110.371 178.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.06 -4.65 31.93 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.491 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 86.2 mt -95.68 -40.98 9.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.395 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 . . . . . 0 C--O 1.252 1.224 0 CA-C-O 118.411 -0.804 . . . . 10.0 110.468 -179.865 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 72.6 mtp . . . . . 0 C--O 1.233 0.234 0 CA-C-O 121.204 0.526 . . . . 10.0 110.576 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 5.5 t -160.3 152.86 20.94 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.602 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.685 ' HB2' ' H73' ' A' ' 30' ' ' PCW . 38.0 tt0 -86.97 118.96 26.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.236 179.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -108.58 120.02 41.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.021 0.438 . . . . 10.0 111.811 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.637 ' NZ ' HN1A ' A' ' 40' ' ' 17F . 2.8 mtmt -109.59 116.2 31.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.53 179.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.539 HD22 HD23 ' B' ' 159' ' ' LEU . 45.3 mt -110.73 117.98 34.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.44 -0.345 . . . . 10.0 111.197 -178.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 47.6 t -104.69 118.19 51.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.026 0.441 . . . . 10.0 110.686 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 23.4 t -92.21 116.64 33.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 17.2 m -108.47 170.09 2.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.909 0.385 . . . . 10.0 111.256 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 150.39 170.95 18.2 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.901 -0.666 . . . . 10.0 111.581 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.454 ' O ' HG22 ' B' ' 14' ' ' VAL . . . -87.9 -174.24 4.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.878 0.371 . . . . 10.0 111.371 -179.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.38 141.58 21.43 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.004 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 108.6 -21.52 28.01 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.647 -0.787 . . . . 10.0 112.18 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.51 HG23 ' HG3' ' B' ' 16' ' ' LYS . 21.9 m -80.04 162.4 3.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 120.938 0.399 . . . . 10.0 110.854 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . 0.507 ' HA2' ' O1A' ' B' ' 201' ' ' GNP . . . -90.2 52.14 3.47 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.809 -0.71 . . . . 10.0 113.451 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.51 ' HG3' HG23 ' B' ' 14' ' ' VAL . 42.1 mtmt -60.73 -58.71 7.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.12 0.486 . . . . 10.0 110.34 179.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -65.93 -32.04 73.32 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.266 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.02 -50.21 69.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.908 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 86.0 mt -59.54 -42.27 91.94 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 121.03 0.443 . . . . 10.0 110.076 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . 0.478 ' O ' HG12 ' B' ' 24' ' ' ILE . 14.4 m -61.37 -53.68 53.54 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.569 -0.741 . . . . 10.0 111.423 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 96.3 mt -61.43 -32.69 54.04 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-O 120.759 0.314 . . . . 10.0 111.115 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.67 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 7.4 tp-100 -67.09 -27.84 67.69 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.142 0.496 . . . . 10.0 110.62 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 23.6 tp -88.58 -33.32 17.73 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.827 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . 0.478 HG12 ' O ' ' B' ' 20' ' ' THR . 42.5 mm -81.1 -69.48 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.935 -179.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -84.17 -14.19 50.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.77 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.67 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 53.6 m-80 68.18 29.09 6.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.588 0.709 . . . . 10.0 109.129 -178.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 74.9 t60 -124.97 144.64 50.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.987 -1.006 . . . . 10.0 110.165 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -103.09 131.71 49.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.657 0.265 . . . . 10.0 110.899 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 4.3 m -91.84 125.76 44.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.144 178.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.35 -11.25 26.07 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.281 0.562 . . . . 10.0 110.689 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -87.5 146.13 25.95 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.877 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.581 ' HD1' " H4'" ' B' ' 201' ' ' GNP . 26.6 t80 -88.5 64.83 7.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.963 0.411 . . . . 10.0 110.224 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.14 140.0 76.39 Favored Pre-proline 0 C--O 1.237 0.432 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.065 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -71.57 -179.51 3.77 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 122.777 2.318 . . . . 10.0 113.007 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . 0.424 HG22 ' HA ' ' B' ' 59' ' ' ALA . 1.0 OUTLIER -166.9 136.0 2.85 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.846 179.745 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.784 HD11 HG21 ' D' ' 809' ' ' THR . 3.5 mt -117.21 -66.3 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.523 ' O ' HG23 ' D' ' 821' ' ' VAL . 2.8 tm-20 -147.79 94.92 2.42 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 179.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . 0.457 ' O ' HD12 ' B' ' 56' ' ' LEU . 25.1 m-20 -118.89 150.21 40.25 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.094 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.19 141.02 46.9 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.883 -0.327 . . . . 10.0 111.397 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . 0.673 ' CE2' HG22 ' D' ' 840' ' ' VAL . 30.1 m-85 -124.29 147.26 48.25 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.53 -0.304 . . . . 10.0 111.811 -178.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . 0.661 ' NH1' ' HB2' ' D' ' 817' ' ' LYS . 0.0 OUTLIER -125.11 136.44 53.64 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 112.891 0.7 . . . . 10.0 112.891 -178.856 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . 0.47 ' HD2' HD13 ' B' ' 24' ' ' ILE . 28.8 tttm -158.72 157.89 32.62 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.226 -0.897 . . . . 10.0 109.626 178.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -133.86 123.31 24.53 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.142 -0.318 . . . . 10.0 110.142 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 10.0 m -138.36 165.65 24.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.847 0.356 . . . . 10.0 111.101 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.729 HG22 ' HB ' ' B' ' 50' ' ' THR . 16.0 t -90.32 97.06 6.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.667 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . 0.575 HD11 HD11 ' B' ' 53' ' ' LEU . 46.1 mt -86.45 120.13 35.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.674 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 51.7 m-20 68.53 -67.26 0.21 Allowed 'General case' 0 N--CA 1.465 0.293 0 O-C-N 123.766 0.667 . . . . 10.0 111.291 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . -155.12 -12.25 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 121.039 -0.6 . . . . 10.0 112.871 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -121.81 132.99 54.9 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 117.145 0.472 . . . . 10.0 111.769 -179.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.729 ' HB ' HG22 ' B' ' 45' ' ' VAL . 9.9 t -79.83 130.76 35.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.993 -0.548 . . . . 10.0 110.605 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -142.45 150.79 41.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.888 0.375 . . . . 10.0 111.602 -179.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 26.6 tp -79.86 129.29 34.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.158 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.575 HD11 HD11 ' B' ' 46' ' ' ILE . 82.6 mt -111.99 123.03 49.38 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.939 -179.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -103.04 103.16 13.23 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.027 -1.101 . . . . 10.0 108.027 177.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.475 HD12 HD11 ' B' ' 24' ' ' ILE . 26.9 mt -92.94 138.86 19.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.959 -0.564 . . . . 10.0 111.502 -177.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.457 HD12 ' O ' ' B' ' 38' ' ' ASP . 37.2 tp -114.01 121.14 42.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.882 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.436 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 6.5 t70 -98.72 96.22 7.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.433 -0.803 . . . . 10.0 108.888 179.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 47.5 p -80.64 163.52 23.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.721 -0.672 . . . . 10.0 112.689 -178.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.424 ' HA ' HG22 ' B' ' 35' ' ' THR . . . -66.73 158.37 30.39 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.734 -0.666 . . . . 10.0 111.102 179.402 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -83.62 -53.58 3.35 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.8 -0.714 . . . . 10.0 111.776 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -113.31 135.51 53.77 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.054 -0.35 . . . . 20.0 110.054 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -158.66 -178.26 7.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.687 0.279 . . . . 10.0 110.843 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -113.94 -91.77 0.5 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.153 0.501 . . . . 10.0 109.968 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -159.85 78.99 0.7 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.652 -0.704 . . . . 10.0 109.915 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 48.6 m -91.46 130.86 37.24 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.586 -0.734 . . . . 10.0 111.056 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.36 -34.5 73.96 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 121.245 0.545 . . . . 10.0 109.834 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 83.9 mmm -62.7 -40.29 96.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.412 -0.813 . . . . 10.0 109.81 178.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.65 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 0.4 OUTLIER -66.18 -44.97 82.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.436 -0.802 . . . . 10.0 110.437 179.793 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -58.4 -32.24 68.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.811 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.483 ' HG3' ' H12' ' A' ' 17' ' ' PCW . 1.6 tt0 -61.67 -58.36 8.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.998 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . 0.65 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 21.0 p90 -70.61 -11.95 61.26 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 113.146 0.795 . . . . 10.0 113.146 -178.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 66.3 mmm -75.6 -16.52 60.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.27 -0.423 . . . . 10.0 109.992 178.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . 0.718 ' HG2' ' HB ' ' B' ' 103' ' ' VAL . 20.0 mtt180 -95.18 -17.5 21.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.44 . . . . 10.0 111.245 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -87.18 13.33 9.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.319 -0.4 . . . . 10.0 111.68 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -104.73 138.25 14.06 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.61 -0.805 . . . . 10.0 111.656 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -91.38 -37.4 13.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.268 0.556 . . . . 10.0 110.74 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -132.09 143.55 15.14 Favored Glycine 0 N--CA 1.444 -0.782 0 N-CA-C 110.82 -0.912 . . . . 10.0 110.82 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -124.62 123.35 39.86 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.242 0.544 . . . . 10.0 112.111 -178.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.627 ' HG ' HD22 ' B' ' 159' ' ' LEU . 97.5 mt -92.18 115.77 28.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.602 -0.726 . . . . 10.0 109.666 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . 0.426 ' HB3' HD12 ' B' ' 93' ' ' ILE . 9.8 m -86.37 85.59 7.33 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.783 -0.451 . . . . 10.0 109.783 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 39.6 t -82.93 119.36 32.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.005 -0.543 . . . . 10.0 112.099 -178.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.795 ' HB3' HD11 ' B' ' 93' ' ' ILE . 19.3 p90 -133.81 135.34 43.75 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.047 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -79.07 128.46 33.3 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.652 -0.249 . . . . 10.0 110.437 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.678 HD11 ' HA ' ' B' ' 118' ' ' CYS . 34.0 pt -70.89 -13.26 16.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.815 0.34 . . . . 10.0 111.899 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . 0.51 ' OD1' ' HD2' ' B' ' 117' ' ' LYS . 3.7 p-10 -94.17 -2.76 52.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.05 0.453 . . . . 10.0 110.023 179.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -126.25 102.51 7.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.034 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.29 -37.39 69.81 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.094 -0.503 . . . . 10.0 112.331 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 23.5 tptp -57.87 -34.94 70.3 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 111.928 0.344 . . . . 10.0 111.928 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 62.1 m -66.56 -35.63 80.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.652 -0.249 . . . . 10.0 111.015 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -68.22 -39.18 82.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.246 0.546 . . . . 10.0 109.971 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -73.55 -34.42 65.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.922 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.84 -14.02 62.62 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.959 -0.564 . . . . 10.0 111.965 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . 0.795 HD11 ' HB3' ' B' ' 82' ' ' PHE . 32.9 mm -58.6 -42.48 84.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.903 0.382 . . . . 10.0 110.322 179.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -66.7 -32.49 73.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.252 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -66.98 -38.14 85.51 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.193 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -80.41 -32.27 37.51 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.123 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -56.96 -48.03 79.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.766 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -65.78 -35.74 81.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.224 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -62.05 -44.55 96.45 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.476 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 53.0 mt -66.86 -39.21 83.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.277 0.561 . . . . 10.0 110.337 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . 0.672 ' HE3' ' HG2' ' B' ' 107' ' ' GLU . 45.2 mtpt -68.54 -20.95 64.58 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.465 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 1.6 ttp-105 -84.48 -38.94 19.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.607 -0.27 . . . . 10.0 111.589 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.718 ' HB ' ' HG2' ' B' ' 73' ' ' ARG . 34.7 m -71.79 -26.02 25.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 112.391 0.515 . . . . 10.0 112.391 -179.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.444 ' HG2' HG23 ' B' ' 103' ' ' VAL . 66.5 mmtt -107.27 -9.6 16.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.447 179.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . 0.478 ' OD2' ' H71' ' A' ' 32' ' ' PCW . 5.8 t70 54.06 38.15 28.4 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.514 -0.766 . . . . 10.0 112.351 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 22.7 t -156.49 156.66 34.1 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.421 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . 0.672 ' HG2' ' HE3' ' B' ' 101' ' ' LYS . 24.9 mt-10 -95.42 -17.17 21.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.051 -0.522 . . . . 10.0 109.647 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . 0.43 ' OD1' ' HE2' ' B' ' 169' ' ' LYS . 12.8 t70 -85.71 74.78 10.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.352 -0.84 . . . . 10.0 110.298 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 44.4 t -129.37 132.82 24.52 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.795 -0.639 . . . . 10.0 109.903 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -64.04 103.3 0.41 Allowed 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.935 2.424 . . . . 10.0 112.241 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . 0.402 ' HB2' HG21 ' B' ' 139' ' ' ILE . 38.3 mtt -126.29 153.27 45.03 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.305 -0.628 . . . . 10.0 109.305 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.458 ' HB ' HD23 ' B' ' 79' ' ' LEU . 96.9 t -135.5 130.56 50.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 18.2 tp -80.75 114.42 19.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.496 -0.927 . . . . 10.0 108.496 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 19.4 t -111.66 110.83 33.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.073 0.463 . . . . 10.0 112.185 -177.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -82.75 136.19 15.0 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 109.011 -1.635 . . . . 10.0 109.011 177.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -121.55 153.52 37.89 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 117.557 0.679 . . . . 10.0 112.366 -178.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . 0.51 ' HD2' ' OD1' ' B' ' 85' ' ' ASN . 90.4 mttt 69.65 44.19 0.91 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.256 -0.884 . . . . 10.0 112.615 178.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . 0.678 ' HA ' HD11 ' B' ' 84' ' ' ILE . 18.7 p -79.58 -4.12 50.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.376 0.608 . . . . 10.0 110.172 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -93.39 1.31 56.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.342 -0.845 . . . . 10.0 110.19 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.412 HD12 ' HB3' ' B' ' 117' ' ' LYS . 40.5 mt -99.92 141.5 22.88 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.172 -0.467 . . . . 10.0 109.741 178.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -81.19 7.99 4.63 Favored 'Trans proline' 0 CA--C 1.529 0.25 0 C-N-CA 122.701 2.267 . . . . 10.0 112.284 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.49 35.43 1.64 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.943 0.402 . . . . 10.0 111.042 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 4.7 ttt180 -60.92 105.28 0.45 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.136 0.493 . . . . 10.0 112.296 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.1 m -94.56 -41.62 9.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.902 -0.59 . . . . 10.0 109.617 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 38.3 t -93.93 111.24 24.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.695 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.16 158.08 36.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.055 0.455 . . . . 10.0 111.272 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . 0.503 ' O ' ' HG3' ' B' ' 131' ' ' GLN . 0.2 OUTLIER -56.93 -40.11 75.74 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.768 -0.651 . . . . 10.0 112.381 -179.373 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 19.8 tptt -59.85 -46.41 89.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.497 0.189 . . . . 10.0 111.239 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . 0.433 HE21 ' HB3' ' B' ' 129' ' ' GLN . 15.9 mt-30 -55.67 -43.12 76.05 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.205 0.526 . . . . 10.0 110.438 178.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.48 -44.32 83.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.545 -0.752 . . . . 10.0 111.539 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.503 ' HG3' ' O ' ' B' ' 127' ' ' THR . 22.4 mt-30 -64.61 -35.13 79.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.802 0.334 . . . . 10.0 110.992 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -61.05 -49.72 76.23 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.74 -0.663 . . . . 10.0 110.656 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 13.7 tp -67.24 -42.2 84.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.766 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.23 74.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.673 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 21.5 tpt180 -60.3 -38.24 83.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.354 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 38.2 m -70.79 -24.57 62.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.655 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -93.72 -7.97 42.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.019 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 72.25 26.78 71.32 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.825 -0.625 . . . . 10.0 111.697 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . 0.402 HG21 ' HB2' ' B' ' 111' ' ' MET . 47.7 pt -122.83 149.76 57.11 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.668 0.27 . . . . 10.0 110.672 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -77.34 151.81 29.94 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.629 2.219 . . . . 10.0 111.602 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -111.78 126.83 55.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.367 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 41.3 mm -126.22 126.18 68.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.061 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . 0.537 ' HG2' ' HB3' ' B' ' 118' ' ' CYS . 4.0 tt0 -90.46 125.3 35.53 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . 0.638 ' HA ' ' O ' ' B' ' 150' ' ' GLN . 74.0 p -132.29 160.26 36.73 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.662 0.986 . . . . 10.0 113.662 -177.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -155.36 123.68 5.9 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.224 -1.353 . . . . 10.0 107.98 178.096 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -74.28 -30.39 62.08 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.344 0.498 . . . . 10.0 112.344 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 33.1 tttp -64.93 -45.92 83.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.485 -0.325 . . . . 10.0 111.458 -179.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.75 -0.93 36.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.956 -179.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' B' ' 149' ' ' ARG . 16.9 ttt85 57.28 47.49 16.71 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.426 0.631 . . . . 10.0 110.924 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . 0.638 ' O ' ' HA ' ' B' ' 144' ' ' THR . 33.8 tp60 -83.53 106.52 15.33 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.054 -179.297 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 59.05 22.13 54.6 Favored Glycine 0 CA--C 1.52 0.377 0 N-CA-C 114.742 0.657 . . . . 10.0 114.742 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 60.9 t -64.69 -48.28 85.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 117.273 0.536 . . . . 10.0 110.23 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -64.49 -46.36 83.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.186 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -63.61 -31.23 72.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.57 -0.741 . . . . 10.0 112.525 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.68 -44.12 85.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.069 0.462 . . . . 10.0 110.444 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -72.02 -37.31 69.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.55 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -64.47 -40.44 95.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.969 0.414 . . . . 10.0 110.782 179.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 46.9 m -61.54 -40.56 95.14 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.004 179.055 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.627 HD22 ' HG ' ' B' ' 79' ' ' LEU . 30.9 tp -62.17 -45.57 92.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.396 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . 0.485 HG21 HD13 ' B' ' 46' ' ' ILE . 89.7 t -60.21 -41.97 88.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.308 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 67.6 mtm-85 -62.66 -37.92 88.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.108 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -67.71 -39.09 84.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.914 0.388 . . . . 10.0 110.284 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . 0.534 HG22 ' HE2' ' B' ' 167' ' ' LYS . 71.7 mt -66.75 -39.57 83.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 178.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -61.99 -42.74 99.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.183 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 21.9 mtmm -67.68 -32.68 73.51 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.123 179.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 -61.99 -45.61 92.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.355 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . 0.534 ' HE2' HG22 ' B' ' 163' ' ' ILE . 59.1 mttm -63.8 -36.14 82.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.479 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -63.24 -41.83 99.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.781 -0.645 . . . . 10.0 109.397 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . 0.43 ' HE2' ' OD1' ' B' ' 108' ' ' ASP . 56.7 tttp -68.34 -39.71 81.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.965 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 97.2 mtp -65.15 -20.81 66.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.969 0.414 . . . . 10.0 111.524 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . 0.606 ' HB3' ' H83' ' A' ' 11' ' ' PCW . 13.5 m -98.25 12.56 34.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.735 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -129.67 -40.18 1.41 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.97 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.51 163.69 18.06 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.903 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 159.89 -137.27 4.99 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.783 -0.723 . . . . 10.0 112.22 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . 0.412 ' HD2' ' HA ' ' B' ' 175' ' ' LYS . 20.7 tptm -79.22 69.1 5.37 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.219 0.533 . . . . 10.0 111.179 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 53.7 tttt -131.17 89.77 2.78 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.982 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -116.07 130.36 56.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.185 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -80.0 -52.85 7.32 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.129 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -87.33 105.6 17.36 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.455 0.645 . . . . 10.0 110.386 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 25.0 mtmm -102.88 54.11 0.77 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.807 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 1.3 m -78.28 161.9 26.92 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.917 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . 0.686 ' HA ' ' H61' ' A' ' 4' ' ' PCW . 39.4 tttm -97.5 -16.45 20.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.038 0.447 . . . . 10.0 110.437 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 13.9 t -139.56 -173.48 3.63 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.811 -0.632 . . . . 10.0 110.172 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -85.4 160.69 19.7 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.852 0.358 . . . . 10.0 110.428 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 57.7 m . . . . . 0 C--N 1.322 -0.59 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.621 179.543 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.248 0 N-CA-C 112.031 -0.427 . . . . 10.0 112.031 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D ' 809' ' ' THR . . . . . 0.784 HG21 HD11 ' B' ' 36' ' ' ILE . 9.6 p -136.97 146.73 45.74 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.707 0.289 . . . . 10.0 110.958 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 810' ' ' VAL . . . . . 0.424 HG23 HG22 ' D' ' 824' ' ' VAL . 92.5 t -106.74 133.15 52.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.283 -0.417 . . . . 10.0 109.888 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 811' ' ' LYS . . . . . 0.417 ' HB2' ' HG3' ' D' ' 874' ' ' GLU . 7.2 mtmp? -85.98 106.87 17.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.285 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 46.9 t -95.84 124.21 48.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.334 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -101.56 130.93 47.96 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.969 -0.382 . . . . 10.0 109.969 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 45.2 mt -103.42 155.98 36.08 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.555 -178.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 815' ' ' PRO . . . . . 0.499 ' HB3' ' HA ' ' D' ' 878' ' ' GLU . 74.4 Cg_endo -74.58 53.38 3.13 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 123.424 2.75 . . . . 10.0 112.036 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -152.63 31.86 0.51 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 817' ' ' LYS . . . . . 0.791 ' HZ2' ' HN1' ' A' ' 37' ' ' 17F . 88.4 mttt 53.96 32.54 15.56 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 114.675 -1.148 . . . . 10.0 111.439 -179.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 818' ' ' GLN . . . . . 0.409 HE22 ' C ' ' B' ' 40' ' ' TYR . 73.5 mt-30 -136.99 -179.2 5.56 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 114.13 1.159 . . . . 10.0 114.13 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.02 171.44 15.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.16 -0.927 . . . . 10.0 112.178 -178.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 45.2 m -155.01 131.52 10.51 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.623 -1.251 . . . . 10.0 107.623 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 821' ' ' VAL . . . . . 0.684 HG12 ' HB ' ' D' ' 809' ' ' THR . 4.0 t -97.28 113.26 31.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 120.562 -0.455 . . . . 10.0 111.081 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 26.1 t -105.61 137.82 33.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.883 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 823' ' ' THR . . . . . 0.743 ' HA ' HG22 ' D' ' 809' ' ' THR . 1.2 m -72.95 144.62 47.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.766 179.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 824' ' ' VAL . . . . . 0.424 HG22 HG23 ' D' ' 810' ' ' VAL . 45.2 t -76.19 119.47 24.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.552 -0.295 . . . . 10.0 110.403 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -114.08 130.42 56.57 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.917 0.389 . . . . 10.0 111.063 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -75.28 129.86 38.13 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.979 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 82.88 2.2 90.65 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.971 -0.558 . . . . 10.0 112.582 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 7.1 ttt -89.44 126.97 35.78 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 122.726 -0.279 . . . . 10.0 110.39 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 829' ' ' SER . . . . . 0.644 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 1.0 OUTLIER -82.11 150.68 27.36 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.391 -0.226 . . . . 10.0 110.391 179.592 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 92.9 t -54.05 -38.85 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 O-C-N 123.228 0.33 . . . . 10.0 110.885 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 831' ' ' TYR . . . . . 0.614 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 80.8 t80 -57.13 -31.05 64.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.319 -0.4 . . . . 10.0 111.396 179.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -82.98 -45.67 13.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.509 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.33 -42.68 78.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.031 0.443 . . . . 10.0 111.352 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 834' ' ' LEU . . . . . 0.482 HD13 ' HB3' ' D' ' 837' ' ' ALA . 1.3 mm? -80.28 -8.57 59.53 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.855 -179.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 835' ' ' ASP . . . . . 0.608 ' O ' ' HG2' ' D' ' 839' ' ' LYS . 29.7 t70 -61.45 -61.19 2.71 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 110.051 -0.352 . . . . 10.0 110.051 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 39.3 mttt -62.77 -29.81 70.98 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.885 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 837' ' ' ALA . . . . . 0.482 ' HB3' HD13 ' D' ' 834' ' ' LEU . . . -69.05 -25.77 64.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.942 0.401 . . . . 10.0 110.762 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 838' ' ' LEU . . . . . 0.579 HD12 ' HG3' ' D' ' 845' ' ' GLN . 40.0 mt -93.07 -44.3 8.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.149 179.307 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 839' ' ' LYS . . . . . 0.608 ' HG2' ' O ' ' D' ' 835' ' ' ASP . 10.5 mmtt -61.27 -23.63 65.81 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.668 179.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 840' ' ' VAL . . . . . 0.673 HG22 ' CE2' ' B' ' 40' ' ' TYR . 1.4 p -49.66 -20.88 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 N-CA-C 112.916 0.71 . . . . 10.0 112.916 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 841' ' ' ARG . . . . . 0.43 ' HG3' ' HG ' ' D' ' 843' ' ' LEU . 13.9 ptp180 -140.59 23.17 2.31 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.368 0.604 . . . . 10.0 111.721 177.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 75.59 28.41 61.4 Favored Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 115.601 -0.727 . . . . 10.0 114.654 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 843' ' ' LEU . . . . . 0.43 ' HG ' ' HG3' ' D' ' 841' ' ' ARG . 96.6 mt -92.4 154.26 18.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 117.598 0.699 . . . . 10.0 110.215 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -121.68 143.28 49.44 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.815 0.341 . . . . 10.0 111.602 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 845' ' ' GLN . . . . . 0.579 ' HG3' HD12 ' D' ' 838' ' ' LEU . 21.5 mp0 -60.64 -28.69 68.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.813 -0.63 . . . . 10.0 111.822 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -76.81 -4.34 43.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.468 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 2.2 t -131.95 18.16 4.61 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 120.966 0.412 . . . . 10.0 110.972 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 79.6 m -142.65 153.29 43.3 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.485 -0.325 . . . . 10.0 110.472 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 14.6 p -130.6 141.81 45.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.42 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 850' ' ' VAL . . . . . 0.449 HG21 ' HG ' ' D' ' 834' ' ' LEU . 26.0 t -109.75 122.96 65.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.351 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 851' ' ' TYR . . . . . 0.602 ' HE1' HG22 ' D' ' 860' ' ' VAL . 48.9 m-85 -103.8 142.85 33.66 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.953 179.662 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 852' ' ' ARG . . . . . . . . . . . . . 42.3 mmm-85 -82.89 164.78 20.27 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.333 -0.849 . . . . 10.0 109.819 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 853' ' ' LEU . . . . . 0.566 HD13 HD11 ' D' ' 876' ' ' ILE . 16.2 tp -124.52 62.07 1.13 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.469 0.652 . . . . 10.0 110.551 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 44.3 mt -84.4 102.25 10.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.28 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp 61.44 17.07 8.07 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.431 -0.804 . . . . 10.0 112.194 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 105.05 -18.32 42.99 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.94 -0.648 . . . . 10.0 112.412 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 857' ' ' ARG . . . . . 0.461 HH11 H161 ' A' ' 10' ' ' PCW . 10.0 mmm180 -81.35 138.45 35.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.968 0.413 . . . . 10.0 110.897 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 858' ' ' LYS . . . . . 0.447 ' HE3' ' CD1' ' D' ' 876' ' ' ILE . 12.5 mptt -88.34 122.36 31.77 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.466 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 3.7 m -122.53 136.1 54.8 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.037 -0.529 . . . . 10.0 109.787 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 860' ' ' VAL . . . . . 0.602 HG22 ' HE1' ' D' ' 851' ' ' TYR . 6.4 t -75.74 123.91 32.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 110.391 -0.225 . . . . 10.0 110.391 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 3.2 t -104.6 160.7 14.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.544 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -99.1 149.63 22.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.569 -0.287 . . . . 10.0 110.914 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 863' ' ' TRP . . . . . 0.614 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 99.4 m95 -70.55 -27.42 64.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.924 -179.142 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.16 1.61 39.63 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.532 0.567 . . . . 10.0 112.532 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 23.5 m -84.98 148.2 26.32 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 179.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 866' ' ' ALA . . . . . 0.644 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -82.48 150.33 27.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.026 0.441 . . . . 10.0 111.622 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 867' ' ' ILE . . . . . 0.475 HD12 HD13 ' D' ' 870' ' ' LEU . 8.8 tp -84.7 -10.32 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.845 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 868' ' ' ALA . . . . . 0.618 ' HB3' ' HD3' ' D' ' 869' ' ' PRO . . . -58.11 -55.6 43.64 Favored Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 113.024 0.75 . . . . 10.0 113.024 -179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 869' ' ' PRO . . . . . 0.618 ' HD3' ' HB3' ' D' ' 868' ' ' ALA . 3.4 Cg_exo -77.81 13.21 1.74 Allowed 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 122.345 2.03 . . . . 10.0 112.161 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 870' ' ' LEU . . . . . 0.475 HD13 HD12 ' D' ' 867' ' ' ILE . 0.2 OUTLIER -103.83 -8.0 20.1 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.094 -0.503 . . . . 10.0 109.983 179.785 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -58.01 127.28 31.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.78 -0.646 . . . . 10.0 111.285 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 121.85 -16.43 8.87 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.479 -0.867 . . . . 10.0 113.402 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -126.95 -170.58 2.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.11 0.455 . . . . 10.0 112.115 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 874' ' ' GLU . . . . . 0.417 ' HG3' ' HB2' ' D' ' 811' ' ' LYS . 4.4 mp0 -113.26 170.24 8.37 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.991 -0.549 . . . . 10.0 110.784 -178.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 36.8 mt -130.83 129.74 42.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.671 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 876' ' ' ILE . . . . . 0.756 HG23 ' H62' ' A' ' 10' ' ' PCW . 17.5 mt -114.38 112.73 41.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.312 -179.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 877' ' ' VAL . . . . . 0.516 HG11 HD21 ' D' ' 838' ' ' LEU . 24.4 t -97.74 137.08 26.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 120.728 0.299 . . . . 10.0 110.615 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 878' ' ' GLU . . . . . 0.57 ' OE2' ' H62' ' A' ' 8' ' ' PCW . 0.0 OUTLIER -140.55 171.05 14.66 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.091 -0.504 . . . . 10.0 109.909 179.233 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' D' D ' 879' ' ' VAL . . . . . 0.641 ' O ' ' H51' ' A' ' 8' ' ' PCW . 5.8 m -105.11 149.15 8.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.076 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 92.3 mt . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.739 -0.648 . . . . 10.0 111.495 -179.197 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PCW . . . . . 0.667 H121 ' H32' ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PCW . . . . . 0.702 H321 H351 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PCW . . . . . 0.854 H322 ' H51' ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PCW . . . . . 0.686 ' H61' ' HA ' ' B' ' 182' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PCW . . . . . 0.552 H421 H162 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PCW . . . . . 0.953 H341 H152 ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PCW . . . . . 0.763 H122 ' H32' ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PCW . . . . . 0.641 ' H51' ' O ' ' D' ' 879' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PCW . . . . . 0.719 ' H2 ' ' H32' ' A' ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PCW . . . . . 0.756 ' H62' HG23 ' D' ' 876' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PCW . . . . . 0.719 ' H32' ' H2 ' ' A' ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PCW . . . . . 0.511 H432 H242 ' A' ' 30' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PCW . . . . . 0.62 H442 ' H73' ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PCW . . . . . 0.638 H352 ' H59' ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PCW . . . . . 0.594 ' H71' ' O2 ' ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PCW . . . . . 0.763 ' H32' H122 ' A' ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PCW . . . . . 0.702 H351 H321 ' A' ' 2' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PCW . . . . . 0.616 ' O1P' H321 ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PCW . . . . . 0.599 H141 H142 ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PCW . . . . . 0.777 H361 H122 ' A' ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PCW . . . . . 0.452 ' H63' ' O ' ' D' ' 853' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PCW . . . . . 0.552 ' O3P' ' H81' ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PCW . . . . . 0.509 H162 H122 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PCW . . . . . 0.474 ' H61' ' O2P' ' A' ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PCW . . . . . 0.659 ' H40' H231 ' A' ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PCW . . . . . 0.615 H131 H151 ' A' ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PCW . . . . . 0.43 ' O31' ' H12' ' A' ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PCW . . . . . 0.953 H152 H341 ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PCW . . . . . 0.659 H231 ' H40' ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PCW . . . . . 0.685 ' H73' ' HB2' ' B' ' 3' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PCW . . . . . 0.648 H122 H432 ' A' ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PCW . . . . . 0.536 ' H20' H283 ' A' ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' 17F . . . . . 0.628 HN1A ' H83' ' A' ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' 17F . . . . . 0.638 ' H59' H352 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' 17F . . . . . 0.667 ' H32' H121 ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' 17F . . . . . 0.483 H20A ' H39' ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' 17F . . . . . 0.791 ' HN1' ' HZ2' ' D' ' 817' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' 17F . . . . . 0.535 ' H75' H482 ' A' ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' 17F . . . . . 0.662 ' H8 ' ' H33' ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' 17F . . . . . 0.637 HN1A ' NZ ' ' B' ' 5' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PCW . . . . . 0.716 H351 ' H39' ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PCW . . . . . 0.655 H262 H241 ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PCW . . . . . 0.434 ' H11' ' C12' ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PCW . . . . . 0.569 H362 ' H39' ' A' ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PCW . . . . . 0.401 H411 H382 ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PCW . . . . . 0.714 H122 H181 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PCW . . . . . 0.639 H371 H431 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PCW . . . . . 0.714 H181 H122 ' A' ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PCW . . . . . 0.558 H462 H482 ' A' ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PCW . . . . . 0.546 H341 ' H2 ' ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PCW . . . . . 0.716 ' H39' H351 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PCW . . . . . 0.49 H261 H231 ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PCW . . . . . 0.639 H431 H371 ' A' ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PCW . . . . . 0.535 H482 ' H75' ' A' ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PCW . . . . . 0.546 ' H2 ' H341 ' A' ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PCW . . . . . 0.586 H321 H161 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PCW . . . . . 0.599 ' H41' ' H12' ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PCW . . . . . 0.761 H121 ' H11' ' A' ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' PCW . . . . . 0.711 H461 ' H40' ' A' ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PCW . . . . . 0.664 H152 H212 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PCW . . . . . 0.511 H131 ' O31' ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PCW . . . . . 0.711 ' H40' H461 ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PCW . . . . . 0.546 H331 H182 ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PCW . . . . . 0.489 H131 ' H73' ' A' ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PCW . . . . . 0.608 H151 H19A ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PCW . . . . . 0.418 H452 H252 ' A' ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PCW . . . . . 0.569 ' H39' H362 ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PCW . . . . . 0.511 H331 H332 ' A' ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PCW . . . . . 0.522 H141 ' H32' ' A' ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PCW . . . . . 0.522 H411 H362 ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PCW . . . . . 0.488 ' H20' H352 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' 17F . . . . . 0.41 ' H57' H19A ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' 17F . . . . . 0.5 ' H38' ' H68' ' A' ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' 17F . . . . . 0.504 ' H6 ' ' H12' ' A' ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' 17F . . . . . 0.761 ' H11' H121 ' A' ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' 17F . . . . . 0.608 H19A H151 ' A' ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' 17F . . . . . 0.58 ' H76' H361 ' A' ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 201' ' ' GNP . . . . . 0.581 " H4'" ' HD1' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 88.4 mt . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 121.047 0.451 . . . . 10.0 110.432 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . 0.425 ' HE2' HG22 ' C' ' 576' ' ' VAL . 93.8 mttt -59.23 -44.33 92.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.575 -0.739 . . . . 10.0 111.202 -179.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 71.4 mt -75.28 -36.83 61.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.785 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 73.1 mt -60.33 -50.71 72.52 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.118 0.485 . . . . 10.0 111.045 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.16 -35.69 81.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.012 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -68.99 -41.75 77.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.512 179.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 17.5 m0 -62.51 -33.55 75.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.309 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -66.73 -33.37 75.49 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.233 0.54 . . . . 10.0 109.926 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 19.2 m -73.05 -26.3 61.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.815 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 95.3 t -78.99 -44.89 24.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.514 178.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.11 -37.5 87.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.27 -0.423 . . . . 10.0 111.507 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . 0.518 ' O ' ' HG2' ' A' ' 216' ' ' LYS . 2.9 p -64.84 -36.15 83.41 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 178.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 40.6 m -71.96 -38.14 69.82 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 109.351 -0.611 . . . . 10.0 109.351 178.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -60.49 -45.87 92.18 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.421 178.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.95 -42.35 99.79 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.357 -0.383 . . . . 10.0 110.281 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 212' ' ' SER . 31.8 mmtt -64.32 -35.24 80.23 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.034 0.445 . . . . 10.0 109.91 178.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 55.8 mt -67.67 -46.19 73.08 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 86.3 mtt180 -61.97 -45.12 95.04 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.223 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -56.2 -42.38 77.09 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.583 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -79.26 -30.0 42.89 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.708 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . 0.457 HD11 H181 ' A' ' 15' ' ' PCW . 17.5 mt -61.93 -30.81 71.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.538 -0.301 . . . . 10.0 111.068 179.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -56.12 -67.0 2.44 Favored Glycine 0 C--N 1.331 0.268 0 N-CA-C 111.421 -0.671 . . . . 10.0 111.421 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -60.66 -37.11 81.85 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 121.955 1.77 . . . . 10.0 111.438 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 8.0 t -56.05 -47.18 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 O-C-N 123.172 0.295 . . . . 10.0 111.591 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 1.4 p -65.78 -39.16 90.72 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.517 -0.473 . . . . 10.0 110.03 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -61.29 -47.72 84.7 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 109.476 -0.565 . . . . 10.0 109.476 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -64.09 -41.3 97.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.364 179.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -62.36 -48.36 80.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.026 179.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . 0.478 ' HA ' ' HE3' ' A' ' 229' ' ' TRP . 2.2 m95 -67.02 -40.7 87.29 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.5 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -56.07 -52.47 64.15 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.13 0.491 . . . . 10.0 110.037 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 54.0 m-80 -64.98 -42.99 94.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.413 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 7.1 mt -63.53 -33.49 75.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.248 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' A' ' 237' ' ' GLU . 3.5 mm-40 -66.96 -34.77 78.48 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.781 0.324 . . . . 10.0 110.403 179.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 16.3 mttp -72.96 -38.52 66.71 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.283 -1.006 . . . . 10.0 108.283 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.42 -53.84 49.04 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 114.97 -1.014 . . . . 10.0 109.732 178.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 6.5 p -64.12 -36.41 83.94 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.193 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . 0.472 ' HA ' ' HD2' ' A' ' 240' ' ' ARG . 36.7 tt0 -59.05 -46.28 88.63 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 109.086 -0.709 . . . . 10.0 109.086 178.259 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -63.41 -44.69 96.4 Favored Glycine 0 N--CA 1.442 -0.906 0 N-CA-C 109.582 -1.407 . . . . 10.0 109.582 178.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . 0.5 ' HA ' ' HB2' ' A' ' 242' ' ' GLU . 94.3 mt -63.09 -31.96 73.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.762 -0.219 . . . . 10.0 111.167 179.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . 0.472 ' HD2' ' HA ' ' A' ' 237' ' ' GLU . 49.2 mtt180 -66.18 -41.13 90.7 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.484 -0.562 . . . . 10.0 109.484 178.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -78.52 -25.01 45.46 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.259 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . 0.5 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 8.1 mt-10 -76.68 -62.62 1.57 Allowed 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.473 -0.785 . . . . 10.0 110.199 178.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . 0.593 ' HA ' ' HB3' ' A' ' 246' ' ' ASP . 93.1 mmm -56.79 -30.56 63.8 Favored 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 113.25 0.833 . . . . 10.0 113.25 -178.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 3.1 p -63.38 -50.97 67.82 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.404 -0.518 . . . . 10.0 109.761 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -74.98 -33.1 61.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.044 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . 0.593 ' HB3' ' HA ' ' A' ' 243' ' ' MET . 11.6 t70 -59.74 -59.38 5.53 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.125 178.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.25 -35.42 78.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.878 -0.601 . . . . 10.0 111.114 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -61.89 -45.82 92.09 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 120.67 0.271 . . . . 10.0 110.585 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -72.19 -38.36 69.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.05 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . 0.645 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 41.3 t -61.81 -39.33 83.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.92 -0.4 . . . . 10.0 109.92 178.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -75.29 -46.61 32.4 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.869 0.366 . . . . 10.0 110.769 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.33 74.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.526 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -90.2 -20.08 23.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.327 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.645 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -62.23 -29.9 47.67 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.206 0 N-CA-C 109.997 -0.371 . . . . 10.0 109.997 179.317 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -64.2 3.36 Favored Pre-proline 0 C--O 1.219 -0.513 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.147 178.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -59.87 -31.76 94.29 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 121.73 1.62 . . . . 10.0 111.548 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -61.21 -57.7 11.35 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.008 0.432 . . . . 10.0 109.895 178.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 96.3 mt -73.1 -38.56 66.3 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.822 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -58.42 -49.18 78.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.761 0.315 . . . . 10.0 110.448 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.48 -45.53 92.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.839 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . 0.403 ' HD1' ' HA ' ' A' ' 261' ' ' PHE . 6.1 m-85 -63.72 -37.56 87.83 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 116.059 -0.518 . . . . 10.0 111.106 179.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -69.6 -39.94 76.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.682 0.277 . . . . 10.0 110.266 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 48.7 mttp -64.27 -42.88 96.24 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 177.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.479 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 14.1 mptt -65.05 -44.5 88.8 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 178.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 6.7 t90 -60.6 -36.62 79.01 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.685 -0.689 . . . . 10.0 110.24 179.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -61.99 -49.89 74.27 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.733 -0.84 . . . . 10.0 108.733 178.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -59.85 -43.79 94.45 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.753 -0.658 . . . . 10.0 109.344 178.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . 0.479 ' HG3' ' O ' ' A' ' 264' ' ' LYS . 27.4 mt-10 -61.09 -47.24 87.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.596 -0.729 . . . . 10.0 111.258 179.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 95.6 mmm -71.43 -43.66 66.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.811 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -61.61 -48.16 82.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.903 0.382 . . . . 10.0 110.248 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 69.4 mt -67.23 -23.59 65.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.5 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . 0.455 ' O ' HG23 ' A' ' 276' ' ' VAL . 0.1 OUTLIER -74.75 -51.51 13.98 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 177.971 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 45.0 mtt85 -60.4 -41.28 93.54 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.668 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.05 -20.54 58.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.611 -0.722 . . . . 10.0 111.063 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.666 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 47.5 mttp -103.19 -41.09 6.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.643 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . 0.568 ' O ' ' HB2' ' A' ' 280' ' ' ARG . 38.5 t -47.11 -43.18 7.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 112.432 0.531 . . . . 10.0 112.432 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 63.9 mt-10 -64.3 -63.78 3.45 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 112.755 0.65 . . . . 10.0 112.755 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.37 -36.15 88.27 Favored 'Trans proline' 0 C--N 1.357 0.982 0 C-N-CA 121.807 1.671 . . . . 10.0 111.998 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.681 HD22 ' HE2' ' C' ' 495' ' ' LYS . 23.1 mt -67.63 -31.57 71.68 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 110.005 -0.368 . . . . 10.0 110.005 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . 0.568 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 5.9 mtt180 -72.89 -35.85 67.19 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -58.96 -46.66 87.5 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.5 -0.555 . . . . 10.0 109.5 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -65.0 -40.63 95.23 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 178.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -43.41 97.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.42 -0.809 . . . . 10.0 109.696 179.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 280' ' ' ARG . 28.8 mt-30 -69.6 -44.93 69.74 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.536 179.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -60.79 -49.73 76.3 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 110.177 -0.305 . . . . 10.0 110.177 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -59.47 -42.43 97.58 Favored Glycine 0 N--CA 1.443 -0.843 0 N-CA-C 110.863 -0.895 . . . . 10.0 110.863 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -66.1 -44.58 83.94 Favored 'General case' 0 C--O 1.223 -0.334 0 O-C-N 123.539 0.199 . . . . 10.0 110.814 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 37.1 mtt180 -58.89 -46.74 87.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.906 0.384 . . . . 10.0 110.194 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -61.72 -47.55 84.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.525 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . 0.518 ' HE3' ' HA2' ' C' ' 484' ' ' GLY . 0.1 OUTLIER -59.97 -44.06 94.71 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.266 179.306 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . 0.478 ' O ' ' HG3' ' A' ' 295' ' ' GLN . 77.0 mt -60.25 -40.23 89.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.275 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -64.62 -47.68 77.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.015 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -64.52 -31.0 72.03 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.072 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 39.6 mt -72.2 -40.97 67.48 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.881 -0.6 . . . . 10.0 109.575 178.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . 0.478 ' HG3' ' O ' ' A' ' 291' ' ' LEU . 21.6 mt-30 -60.55 -36.18 77.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.234 0.54 . . . . 10.0 109.666 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -72.4 3.77 4.44 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.667 179.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . 0.6 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 45.2 mttp -126.24 -24.69 3.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.567 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 82.6 mt -76.54 -33.08 58.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.631 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . 0.778 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 4.5 m -89.66 -61.6 0.22 Allowed Pre-proline 0 CA--C 1.538 0.513 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.815 179.128 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . 0.778 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 52.7 Cg_exo -59.05 -63.86 0.12 Allowed 'Trans proline' 0 C--N 1.357 0.986 0 C-N-CA 122.4 2.067 . . . . 10.0 112.244 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.6 ' HB2' ' O ' ' A' ' 297' ' ' LYS . 88.4 mt -63.17 -25.86 68.54 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.414 179.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -68.17 -49.03 49.43 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 110.1 -1.2 . . . . 10.0 110.1 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -63.44 -35.75 81.47 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.912 -0.403 . . . . 10.0 109.912 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -64.3 -45.12 89.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.095 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.7 ttt -67.47 -33.77 75.79 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.094 -0.706 . . . . 10.0 109.094 178.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . 0.471 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 95.3 mtt180 -64.19 -44.2 92.72 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.165 -0.68 . . . . 10.0 109.165 178.038 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . 0.428 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 18.4 t70 -65.58 -42.42 91.78 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.269 179.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . 1.103 ' HG3' HD21 ' C' ' 469' ' ' LEU . 11.4 mmt180 -62.6 -37.57 86.76 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 178.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . 0.533 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -67.22 -35.99 80.76 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 115.844 -0.616 . . . . 10.0 109.713 178.101 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . 0.471 ' HG3' ' O ' ' A' ' 306' ' ' ARG . 54.5 mtt180 -60.92 -50.86 71.71 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.72 -0.844 . . . . 10.0 108.72 178.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.33 -37.51 87.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.741 178.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . 0.681 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 0.3 OUTLIER -57.85 -55.29 36.81 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.202 178.758 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 87.5 t -71.28 -40.04 73.34 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.264 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.608 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . 0.639 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 36.7 t70 -60.57 -47.82 84.5 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.978 -0.289 . . . . 10.0 110.366 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -64.95 -28.32 69.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.358 0.599 . . . . 10.0 109.398 178.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . 0.537 ' HG ' ' HE3' ' C' ' 462' ' ' LYS . 8.9 mt -71.2 -39.88 71.52 Favored 'General case' 0 C--O 1.216 -0.698 0 N-CA-C 108.744 -0.836 . . . . 10.0 108.744 177.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.639 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 81.5 mtt180 -61.45 -43.92 98.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.356 -0.383 . . . . 10.0 110.398 179.524 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -15.66 63.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.847 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -106.17 -39.08 6.07 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.504 -0.317 . . . . 10.0 111.756 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 50.2 mt -60.15 -36.25 77.11 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 122.251 0.22 . . . . 10.0 111.132 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . 0.401 ' HB3' ' CD ' ' A' ' 322' ' ' PRO . . . -60.75 -62.06 6.72 Favored Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.657 179.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.401 ' CD ' ' HB3' ' A' ' 321' ' ' ALA . 15.7 Cg_endo -60.78 -33.83 92.41 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.709 1.606 . . . . 10.0 110.899 178.028 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . 0.473 ' O ' ' HG ' ' A' ' 327' ' ' LEU . 6.7 m-30 -60.33 -49.77 76.26 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 178.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 32.6 m -66.59 -37.77 85.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.172 179.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . 0.525 ' O ' ' HG3' ' A' ' 329' ' ' GLN . 0.8 OUTLIER -65.41 -41.26 93.78 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.919 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . 0.483 ' HB3' ' OE1' ' C' ' 447' ' ' GLU . 56.5 mt-10 -66.0 -37.38 85.79 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.778 -0.823 . . . . 10.0 108.778 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 323' ' ' TYR . 51.4 mt -61.77 -37.08 82.98 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.03 178.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -64.32 -40.79 96.61 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . 0.525 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 14.1 mt-30 -62.16 -42.67 99.48 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 178.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . 0.645 ' O ' ' HG2' ' A' ' 334' ' ' ARG . 59.8 mtt180 -65.48 -50.6 64.74 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 115.512 -0.767 . . . . 10.0 109.671 178.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 331' ' ' LEU . 1.9 mm? -55.87 -40.5 73.02 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.923 -0.581 . . . . 10.0 110.587 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.24 -45.46 94.42 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -64.42 -45.83 85.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.267 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . 0.694 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 7.6 mmt85 -61.35 -46.19 91.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.54 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . 0.435 ' O ' ' HG3' ' A' ' 339' ' ' LYS . 64.5 mt -62.18 -41.99 98.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.962 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -61.08 -42.38 98.4 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 178.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -67.26 -40.39 86.2 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . 0.584 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 78.2 mt -67.75 -20.72 65.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.125 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 335' ' ' LEU . 71.4 mttt -87.35 -47.68 8.6 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 178.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -67.97 -62.33 1.45 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.958 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -68.76 -39.09 80.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.285 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . 0.584 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -60.5 -43.63 98.61 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.934 -0.65 . . . . 10.0 111.74 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -64.79 -43.36 96.31 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 110.415 -1.074 . . . . 10.0 110.415 178.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -62.93 -40.43 97.6 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.413 -0.588 . . . . 10.0 109.413 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . 0.732 ' HA ' HD21 ' C' ' 429' ' ' ASN . 29.7 ttm180 -60.21 -44.48 95.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.073 -0.967 . . . . 10.0 109.863 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 73.7 mt -64.68 -40.48 95.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.121 179.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -63.31 -45.81 89.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.73 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.02 -42.74 97.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.934 -0.576 . . . . 10.0 109.837 178.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -62.43 -41.67 98.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.114 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -65.37 -41.66 93.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.382 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -61.89 -48.46 80.37 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.642 -0.503 . . . . 10.0 109.642 178.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . 0.683 ' NZ ' ' HB2' ' C' ' 425' ' ' GLU . 47.6 mttm -62.43 -41.51 98.76 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.494 -0.775 . . . . 10.0 110.295 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . 0.406 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -62.78 -45.76 91.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.196 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 28.8 m -61.38 -45.51 94.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.892 -0.594 . . . . 10.0 110.67 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . 0.519 ' HA ' ' OE1' ' A' ' 355' ' ' GLU . 7.2 mm-40 -71.53 -31.19 66.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.003 0.43 . . . . 10.0 111.366 179.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . 0.427 ' HA ' ' OG1' ' A' ' 359' ' ' THR . 38.5 t-80 -72.39 -25.39 61.48 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 40.9 mt -71.88 -39.84 69.35 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.252 -0.648 . . . . 10.0 109.252 178.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -44.12 88.03 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 178.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . 0.427 ' OG1' ' HA ' ' A' ' 356' ' ' HIS . 1.1 p -70.71 -20.57 62.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.723 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 360' ' ' LEU . 9.3 mt -80.38 -39.24 28.79 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.642 -0.873 . . . . 10.0 108.642 177.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 16.2 m -66.54 -31.78 72.71 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.534 -0.913 . . . . 10.0 108.534 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . 0.51 ' HB3' ' HD3' ' C' ' 414' ' ' LYS . 46.0 mm-40 -75.06 9.01 2.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.086 -0.961 . . . . 10.0 110.782 178.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.58 ' HG2' HG22 ' C' ' 411' ' ' THR . 63.1 mttp -128.33 -46.69 1.33 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.268 -1.012 . . . . 10.0 108.268 178.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -67.61 -7.3 25.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.458 -0.792 . . . . 10.0 112.518 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.488 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 96.4 mttt -106.42 -66.96 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.526 0 C-N-CA 120.95 -0.3 . . . . 10.0 111.806 178.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.488 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 40.1 Cg_endo -66.28 -47.59 3.16 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 121.58 1.52 . . . . 10.0 112.557 -178.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -65.08 -38.98 92.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.506 0.193 . . . . 10.0 111.122 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 1.5 mt -68.47 -39.85 81.24 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.701 -0.4 . . . . 10.0 110.065 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 27.5 mt-10 -68.96 -35.38 76.68 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.557 -0.535 . . . . 10.0 109.557 178.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -47.21 81.82 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.855 -1.165 . . . . 10.0 107.855 177.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 367' ' ' ALA . 65.3 mt -62.28 -41.19 98.27 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.311 -0.859 . . . . 10.0 110.775 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 372' ' ' ARG . 52.4 mtt180 -63.39 -43.34 97.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.114 0.483 . . . . 10.0 110.035 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.5 mt-30 -68.13 -21.06 64.95 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.439 -0.8 . . . . 20.0 111.869 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -93.24 -37.35 5.66 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.821 -0.912 . . . . 10.0 110.821 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 18.5 mt -59.52 -37.52 78.55 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.306 0.484 . . . . 10.0 112.306 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . 0.447 ' HB2' ' CD ' ' A' ' 377' ' ' PRO . 81.8 mt -58.85 -62.33 5.97 Favored Pre-proline 0 CA--C 1.535 0.378 0 N-CA-C 111.734 0.272 . . . . 10.0 111.734 179.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.447 ' CD ' ' HB2' ' A' ' 376' ' ' LEU . 29.6 Cg_endo -63.68 -35.17 59.75 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.012 1.808 . . . . 10.0 112.044 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 15.6 t -64.46 -47.25 90.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-O 120.645 0.26 . . . . 10.0 110.581 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . 0.442 HD21 ' H52' ' A' ' 38' ' ' 17F . 18.3 mt -63.92 -32.3 73.78 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.655 -0.498 . . . . 10.0 109.655 178.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -69.87 -46.96 64.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.429 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.1 p -62.49 -36.85 83.82 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.187 -0.672 . . . . 10.0 109.187 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -68.47 -45.85 71.33 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.339 -0.846 . . . . 10.0 109.845 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 25.3 mtmt -60.17 -45.44 93.09 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.991 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 70.8 t -59.7 -44.63 94.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 109.752 -0.462 . . . . 10.0 109.752 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 27.9 m -65.93 -40.55 91.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.493 178.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . 0.443 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 7.4 m-30 -65.23 -48.0 74.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.764 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 75.1 mt -58.77 -48.67 80.43 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.256 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . 0.406 ' HB2' ' NZ ' ' C' ' 594' ' ' LYS . 18.3 p -66.44 -25.52 66.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.519 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -82.0 -42.07 19.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.41 179.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 84.5 mt -58.48 -41.37 85.14 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.41 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -64.45 -36.36 83.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.245 178.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.79 -43.28 84.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.039 0.447 . . . . 10.0 110.954 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -56.84 -52.43 65.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.761 -0.654 . . . . 10.0 111.009 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 1.452 ' CG2' HD21 ' A' ' 398' ' ' ASN . 0.9 OUTLIER -69.32 -22.47 63.77 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.838 0.352 . . . . 10.0 111.234 -179.633 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -68.1 -37.67 81.45 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.324 -0.398 . . . . 10.0 111.069 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . 0.641 ' HE3' ' HA ' ' C' ' 587' ' ' ALA . 3.7 mptp? -91.89 -38.58 12.22 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.956 0.408 . . . . 10.0 111.953 -179.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 9.4 mp -75.97 -36.33 59.3 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.2 -0.455 . . . . 10.0 111.689 -178.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . 1.452 HD21 ' CG2' ' A' ' 394' ' ' THR . 98.8 m-20 . . . . . 0 N--CA 1.465 0.282 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.172 -179.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 1.1 mm? . . . . . 0 N--CA 1.464 0.243 0 CA-C-O 121.052 0.453 . . . . 10.0 110.677 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 12.6 mtmt -84.89 45.54 1.17 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.848 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 6.8 mp -63.1 -31.36 72.48 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.771 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . 0.44 HD23 ' H ' ' C' ' 402' ' ' LEU . 0.3 OUTLIER -65.43 -37.34 86.63 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.392 -0.822 . . . . 10.0 110.386 179.617 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.4 -38.6 74.69 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -68.22 -36.34 79.35 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.118 -0.697 . . . . 10.0 109.118 178.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 68.9 t90 -66.49 -36.7 83.38 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.419 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -60.68 -46.39 90.53 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.939 -0.573 . . . . 10.0 109.96 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -32.81 74.69 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.129 0.49 . . . . 10.0 109.979 179.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 36.0 t -67.9 -37.61 78.7 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.089 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 177.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 21.8 m -68.52 -42.13 78.93 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.684 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.98 -43.36 88.03 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.897 -0.321 . . . . 10.0 110.538 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . 0.58 HG22 ' HG2' ' A' ' 363' ' ' LYS . 7.4 p -65.7 -38.14 88.4 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.409 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.58 -40.1 88.77 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.156 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 30.8 m -62.52 -44.67 95.79 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 178.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . 0.51 ' HD3' ' HB3' ' A' ' 362' ' ' GLU . 89.8 mttt -69.43 -25.29 64.04 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.137 178.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.0 -36.38 67.01 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.998 -1.112 . . . . 10.0 107.998 177.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -72.68 -23.6 60.9 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.235 -0.893 . . . . 10.0 110.191 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . 0.512 ' O ' ' HD2' ' C' ' 421' ' ' PRO . 78.4 mt-10 -64.33 -38.83 92.41 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 107.923 -1.14 . . . . 10.0 107.923 176.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . 0.73 ' O ' ' HB ' ' C' ' 422' ' ' VAL . 1.4 mt-30 -69.36 -30.19 68.14 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 115.103 -0.953 . . . . 10.0 109.057 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 88.5 mt -72.3 -1.74 16.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.633 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -92.82 -93.29 1.47 Allowed Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.748 -0.739 . . . . 10.0 111.483 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . 0.512 ' HD2' ' O ' ' C' ' 417' ' ' GLU . 9.6 Cg_endo -52.94 -46.03 36.73 Favored 'Trans proline' 0 N--CA 1.473 0.3 0 C-N-CA 123.321 2.681 . . . . 10.0 113.172 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . 0.73 ' HB ' ' O ' ' C' ' 418' ' ' GLN . 67.6 t -55.08 -42.47 65.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.429 0.157 . . . . 10.0 111.178 -179.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 2.8 m -72.71 -34.42 67.11 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.962 0.411 . . . . 10.0 110.069 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -61.7 -52.84 62.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.946 -0.57 . . . . 10.0 109.782 178.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . 0.683 ' HB2' ' NZ ' ' A' ' 352' ' ' LYS . 0.4 OUTLIER -68.51 -19.38 64.52 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.925 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -70.8 -42.79 69.86 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.292 -1.003 . . . . 10.0 108.292 178.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 18.9 m0 -69.4 -33.71 73.41 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.691 -0.855 . . . . 10.0 108.691 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . 0.478 ' O ' ' HB2' ' C' ' 431' ' ' GLU . 12.6 t70 -67.89 -41.83 82.13 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.772 -0.825 . . . . 10.0 108.772 177.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . 0.732 HD21 ' HA ' ' A' ' 345' ' ' ARG . 16.0 t-20 -63.95 -38.79 92.37 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.572 -0.899 . . . . 10.0 108.572 177.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 30.1 mt -66.6 -27.78 67.98 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.707 -0.678 . . . . 10.0 109.986 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' C' ' 428' ' ' ASP . 18.3 mm-40 -68.18 -38.81 82.44 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 107.705 -1.22 . . . . 10.0 107.705 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -68.57 -41.83 79.18 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.52 -0.919 . . . . 10.0 108.52 177.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 56.3 mm-40 -58.96 -53.76 54.78 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 115.353 -0.84 . . . . 10.0 109.886 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 16.4 p -63.52 -37.05 85.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 10.0 112.073 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -69.59 -45.4 68.72 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -63.95 -48.47 75.7 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.271 -1.132 . . . . 10.0 110.271 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 20.4 mt -62.58 -28.47 69.9 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 109.974 -0.38 . . . . 10.0 109.974 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' C' ' 438' ' ' ARG . 7.6 mtt180 -65.3 -42.88 92.63 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 178.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -65.22 -44.34 88.55 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . 0.694 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 45.5 mt-10 -62.65 -55.17 29.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.434 -0.803 . . . . 10.0 110.375 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 87.0 mmm -59.61 -45.7 91.15 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 112.972 0.73 . . . . 10.0 112.972 -179.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 15.8 p -57.28 -51.18 70.39 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.913 -0.315 . . . . 10.0 111.08 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -65.84 -46.18 79.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.726 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . 0.654 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 0.1 OUTLIER -60.18 -43.57 95.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.214 -179.808 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . 0.467 ' O ' HG12 ' C' ' 448' ' ' VAL . 63.3 mt -70.69 -45.06 65.7 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.673 0.273 . . . . 10.0 111.175 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -59.98 -45.21 93.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.126 0.488 . . . . 10.0 110.345 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . 0.503 ' OE1' ' HE2' ' C' ' 451' ' ' LYS . 4.5 tt0 -74.87 -26.8 59.93 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.454 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . 0.654 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.3 OUTLIER -66.91 -35.0 73.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.769 0.319 . . . . 10.0 110.383 179.488 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -70.47 -34.0 71.91 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.48 -0.933 . . . . 10.0 108.48 177.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -82.2 -1.45 49.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.034 -0.984 . . . . 10.0 109.95 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . 0.503 ' HE2' ' OE1' ' C' ' 447' ' ' GLU . 14.3 mttm -105.5 -44.41 4.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.603 -0.726 . . . . 10.0 109.055 178.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . 0.431 HG23 ' O ' ' C' ' 448' ' ' VAL . 53.6 t -61.07 -34.95 62.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.894 -0.593 . . . . 10.0 110.376 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -56.99 -62.46 5.11 Favored Pre-proline 0 CA--C 1.537 0.469 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.148 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -65.5 -29.25 53.23 Favored 'Trans proline' 0 C--N 1.36 1.164 0 C-N-CA 121.6 1.534 . . . . 10.0 111.08 178.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . 0.403 ' HB2' ' HA ' ' C' ' 452' ' ' VAL . 0.4 OUTLIER -61.32 -56.0 25.34 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 178.67 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 41.9 mt -61.05 -40.86 95.22 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.424 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -59.59 -50.31 74.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.804 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -72.12 -37.29 69.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.776 -178.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -65.17 -47.62 76.34 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -67.11 -32.33 73.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.26 -0.427 . . . . 10.0 109.948 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . 0.409 ' HE3' ' HB2' ' C' ' 461' ' ' LYS . 0.4 OUTLIER -63.15 -52.16 63.57 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.979 -0.748 . . . . 10.0 108.979 178.444 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . 0.537 ' HE3' ' HG ' ' A' ' 316' ' ' LEU . 22.7 mttm -66.34 -34.32 77.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.188 -0.915 . . . . 10.0 110.108 179.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 6.9 m95 -68.64 -32.54 72.46 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.239 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . 0.454 ' O ' ' HG3' ' C' ' 468' ' ' GLU . 13.6 mm-40 -66.85 -44.26 81.48 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 107.875 -1.157 . . . . 10.0 107.875 177.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 0.681 ' HB2' ' HE1' ' A' ' 312' ' ' HIS . 29.6 mt-10 -62.78 -41.79 99.4 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.833 -0.802 . . . . 10.0 108.833 177.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.55 -44.03 95.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.971 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 9.0 mmt -61.26 -44.44 97.24 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.57 -0.53 . . . . 10.0 109.57 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' C' ' 464' ' ' GLN . 50.9 mt-10 -61.89 -52.55 63.64 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.955 -0.757 . . . . 10.0 108.955 178.112 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 1.103 HD21 ' HG3' ' A' ' 308' ' ' ARG . 96.2 mt -54.6 -49.21 70.99 Favored 'General case' 0 C--O 1.225 -0.187 0 CA-C-N 115.62 -0.718 . . . . 20.0 111.474 179.4 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -60.49 -45.7 92.83 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 116.42 -0.355 . . . . 10.0 111.093 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -68.17 -46.16 71.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.608 0.242 . . . . 10.0 111.286 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -69.07 -15.94 63.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.798 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . 0.619 ' O ' ' HB2' ' C' ' 477' ' ' LEU . 65.2 mttt -97.31 -51.96 3.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.154 178.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 24.7 t -59.44 -39.08 78.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.107 -0.497 . . . . 10.0 112.049 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -54.86 -63.77 2.61 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 112.238 0.458 . . . . 10.0 112.238 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -68.86 -27.49 30.9 Favored 'Trans proline' 0 C--N 1.354 0.866 0 C-N-CA 121.823 1.682 . . . . 10.0 111.141 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . 0.619 ' HB2' ' O ' ' C' ' 473' ' ' LYS . 10.4 tp -65.3 -51.5 60.28 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . 0.508 ' HA ' ' HB2' ' C' ' 481' ' ' LEU . 61.0 mtt180 -67.21 -31.61 72.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.607 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -63.85 -45.49 89.27 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.381 -0.6 . . . . 10.0 109.381 178.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.84 -30.46 56.35 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.298 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . 0.508 ' HB2' ' HA ' ' C' ' 478' ' ' ARG . 20.4 mt -69.47 -40.77 76.9 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 109.679 -0.489 . . . . 10.0 109.679 178.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -67.02 -46.07 75.61 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.826 -0.435 . . . . 10.0 109.826 178.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -64.6 -41.46 96.2 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.798 -0.816 . . . . 10.0 108.798 178.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . 0.518 ' HA2' ' HE3' ' A' ' 290' ' ' LYS . . . -64.42 -40.07 97.45 Favored Glycine 0 N--CA 1.443 -0.869 0 N-CA-C 110.88 -0.888 . . . . 10.0 110.88 178.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.39 -38.62 81.49 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 109.465 -0.569 . . . . 10.0 109.465 178.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -63.41 -43.71 96.71 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 108.797 -0.816 . . . . 10.0 108.797 178.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -65.04 -41.66 95.0 Favored 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 109.203 -0.666 . . . . 10.0 109.203 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . 0.479 ' HD2' ' HA ' ' C' ' 488' ' ' LYS . 28.4 tptt -65.41 -42.4 92.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.085 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 67.7 mt -65.87 -43.66 87.73 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -61.55 -45.88 92.28 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.497 -0.927 . . . . 10.0 108.497 178.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . 0.76 ' HG2' ' HE3' ' C' ' 495' ' ' LYS . 6.8 tt0 -57.19 -51.96 67.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.875 -1.057 . . . . 10.0 109.03 178.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 78.6 mt -63.93 -42.22 97.42 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.865 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -61.36 -44.28 97.45 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.612 0.244 . . . . 10.0 111.233 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -72.08 -2.05 17.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.009 0.433 . . . . 10.0 111.253 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.76 ' HE3' ' HG2' ' C' ' 491' ' ' GLU . 93.1 mttt -111.31 -47.42 3.19 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.91 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 93.7 mt -64.93 -28.29 69.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.729 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . 0.506 ' O ' ' HG3' ' C' ' 501' ' ' GLU . 46.8 m -68.25 -62.17 3.35 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 120.791 -0.363 . . . . 10.0 110.832 178.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -62.19 -38.42 55.62 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.63 1.554 . . . . 10.0 111.288 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . 0.522 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 13.0 mt -70.58 -32.39 69.76 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.581 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -63.65 -48.18 79.8 Favored Glycine 0 N--CA 1.449 -0.441 0 N-CA-C 110.807 -0.917 . . . . 10.0 110.807 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' C' ' 497' ' ' SER . 27.6 mt-10 -63.05 -39.94 96.24 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 178.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . 0.808 ' HG2' ' HE ' ' C' ' 506' ' ' ARG . 27.4 tt0 -64.61 -45.53 86.51 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.039 179.128 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . 0.663 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 85.2 mmm -60.62 -35.74 76.91 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.624 -0.51 . . . . 10.0 109.624 178.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 55.4 mtt180 -67.66 -41.58 83.56 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -63.13 -42.42 99.51 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.999 -0.741 . . . . 10.0 108.999 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.808 ' HE ' ' HG2' ' C' ' 502' ' ' GLU . 43.5 mtt180 -62.43 -47.32 84.6 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.45 -46.14 89.6 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 115.318 -0.856 . . . . 10.0 110.479 179.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -61.45 -46.03 91.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.784 0.326 . . . . 10.0 110.19 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . 0.452 ' HB1' ' CE ' ' A' ' 264' ' ' LYS . . . -63.96 -36.15 83.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.634 179.421 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -76.0 -45.9 32.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.839 179.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 76.3 t -67.45 -43.38 87.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.619 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.402 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 8.4 t70 -64.56 -35.84 82.29 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.025 -0.732 . . . . 10.0 109.025 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.62 -44.39 86.66 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 107.316 -1.365 . . . . 10.0 107.316 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 50.9 mt -59.8 -35.42 74.64 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.24 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . 0.402 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 67.6 mtt180 -62.02 -49.35 76.36 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.638 -0.504 . . . . 10.0 109.638 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 4.7 p -81.81 6.15 16.48 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.899 -0.591 . . . . 10.0 111.865 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . 0.504 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 49.2 m170 -116.96 -45.86 2.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.857 0.36 . . . . 10.0 110.954 179.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 97.8 mt -76.04 -38.23 57.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.481 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -58.47 -58.66 17.41 Favored Pre-proline 0 CA--C 1.533 0.315 0 N-CA-C 111.658 0.244 . . . . 10.0 111.658 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.55 -37.5 58.08 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 121.518 1.479 . . . . 10.0 111.094 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . 0.504 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 16.4 t80 -60.58 -47.54 85.76 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.802 0.334 . . . . 10.0 110.28 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 34.9 m -69.4 -32.35 71.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.066 -0.515 . . . . 10.0 109.94 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . 0.675 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 22.6 t70 -67.31 -41.65 85.0 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.288 -0.634 . . . . 10.0 109.288 178.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -63.74 -38.82 92.52 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 107.971 -1.122 . . . . 10.0 107.971 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' C' ' 521' ' ' TYR . 79.7 mt -65.15 -31.64 72.93 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 115.142 -0.935 . . . . 10.0 110.061 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . 0.675 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 66.3 mtt180 -63.39 -34.24 77.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.169 0.509 . . . . 10.0 109.706 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -80.04 -48.0 13.99 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.023 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 50.8 mtt180 -64.84 -50.86 64.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.738 -0.665 . . . . 10.0 111.835 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 70.5 mt -60.62 -33.03 72.16 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.329 -0.249 . . . . 10.0 110.329 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -66.55 -39.58 88.61 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.944 -0.761 . . . . 10.0 108.944 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.27 -41.39 81.11 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 109.216 -0.661 . . . . 10.0 109.216 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -60.89 -43.99 97.73 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.33 -0.85 . . . . 10.0 108.8 178.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 60.0 mt -67.97 -34.62 76.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.679 -0.692 . . . . 10.0 110.078 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.41 -42.63 99.58 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.179 -0.675 . . . . 10.0 109.179 178.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -66.92 -43.6 82.86 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.176 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 88.5 mt -66.02 -24.8 66.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.758 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -80.18 -42.85 22.61 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.78 -0.452 . . . . 10.0 109.78 178.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -67.68 -47.76 68.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.366 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -74.22 -35.87 63.9 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.426 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -63.94 -46.59 91.12 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.423 -1.071 . . . . 10.0 110.423 178.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.62 -41.96 99.75 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 110.5 -1.04 . . . . 10.0 110.5 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . 0.469 ' O ' ' HG3' ' C' ' 546' ' ' GLU . . . -62.73 -53.07 59.99 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' C' ' 543' ' ' ARG . 54.3 mtt85 -52.99 -46.81 68.49 Favored 'General case' 0 C--O 1.221 -0.427 0 O-C-N 123.781 0.676 . . . . 10.0 110.784 179.135 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . 0.648 ' O ' ' HB2' ' C' ' 548' ' ' HIS . 54.6 mt -59.34 -42.77 92.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.462 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -71.86 -42.85 66.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.756 0.312 . . . . 10.0 110.842 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . 0.577 ' O ' ' HD2' ' C' ' 550' ' ' LYS . 52.0 mt-10 -66.81 -52.72 40.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.633 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . 0.839 ' HA ' ' HB2' ' C' ' 550' ' ' LYS . 21.2 m-30 -65.45 -20.25 66.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.643 0.259 . . . . 10.0 111.174 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . 0.648 ' HB2' ' O ' ' C' ' 544' ' ' LEU . 2.8 t-80 -68.33 -39.4 81.96 Favored 'General case' 0 CA--C 1.519 -0.25 0 N-CA-C 107.619 -1.252 . . . . 10.0 107.619 177.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . 0.574 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -78.13 -32.74 50.53 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.15 -0.932 . . . . 10.0 108.768 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . 0.839 ' HB2' ' HA ' ' C' ' 547' ' ' TYR . 0.2 OUTLIER -64.11 -33.89 76.81 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.441 -0.8 . . . . 10.0 109.492 178.448 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.83 -45.51 89.26 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.443 -0.798 . . . . 10.0 109.103 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -33.76 76.48 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.262 179.135 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . 0.574 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 89.0 mt-10 -60.8 -37.28 81.41 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 108.49 -0.929 . . . . 10.0 108.49 178.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -80.14 -36.19 35.56 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.216 -0.902 . . . . 10.0 110.998 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 65.4 mt -63.75 -41.89 97.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.843 0.354 . . . . 10.0 111.072 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 2.7 p -67.43 -39.68 85.47 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.986 0.422 . . . . 10.0 110.342 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 7.5 p -74.21 -24.75 59.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.919 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 20.5 mt -74.89 -33.05 62.0 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.992 -0.744 . . . . 10.0 108.992 177.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 49.2 m -61.95 -26.82 68.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.298 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -65.34 -17.37 64.47 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-O 121.383 0.611 . . . . 10.0 110.26 178.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . 0.408 ' HA ' ' HB3' ' C' ' 565' ' ' ALA . 3.8 mptt -111.15 -35.08 5.99 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.899 179.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -63.96 -22.6 66.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.64 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . 0.964 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 75.9 mttt -114.15 -70.6 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.49 0 CA-C-O 119.313 -0.375 . . . . 10.0 111.951 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . 0.964 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 50.8 Cg_exo -58.43 -51.76 6.8 Favored 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 122.151 1.901 . . . . 10.0 113.2 -179.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . 0.408 ' HB3' ' HA ' ' C' ' 561' ' ' LYS . . . -63.82 -41.5 97.85 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.065 -0.254 . . . . 10.0 111.408 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 1.1 mt -63.88 -38.52 91.39 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.829 -0.348 . . . . 10.0 110.107 178.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . 0.47 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 26.6 mm-40 -66.84 -39.03 87.5 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 178.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.66 -41.16 96.29 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.726 -0.842 . . . . 10.0 108.726 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 51.5 mt -63.15 -42.97 99.54 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.762 178.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -64.9 -43.03 94.2 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.021 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.6 mt-30 -65.36 -20.53 66.43 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.733 -0.667 . . . . 20.0 111.591 179.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -92.86 -38.37 5.5 Favored Glycine 0 CA--C 1.523 0.548 0 N-CA-C 109.397 -1.481 . . . . 10.0 109.397 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 26.4 mt -54.78 -42.71 72.08 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.36 0.504 . . . . 10.0 112.36 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . 0.791 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 96.0 mt -58.99 -62.05 6.6 Favored Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 120.811 -0.356 . . . . 10.0 111.709 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . 0.791 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 53.0 Cg_exo -58.36 -38.64 89.59 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.231 1.954 . . . . 10.0 111.741 178.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . 0.425 HG22 ' HE2' ' A' ' 202' ' ' LYS . 27.3 t -63.31 -46.75 94.73 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-O 120.722 0.296 . . . . 10.0 110.413 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 24.1 mt -64.61 -39.57 93.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.252 -0.277 . . . . 10.0 110.252 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . 0.499 ' O ' HG23 ' C' ' 582' ' ' VAL . 24.2 mt-10 -63.15 -48.95 76.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.33 -0.395 . . . . 10.0 110.631 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 23.1 p -65.79 -39.79 91.31 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.768 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.14 -40.77 96.87 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 116.22 -0.445 . . . . 10.0 109.831 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -61.26 -37.77 84.31 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.515 178.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . 0.499 HG23 ' O ' ' C' ' 578' ' ' GLU . 86.0 t -62.98 -46.21 96.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.21 -0.45 . . . . 10.0 109.874 179.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.17 -34.84 77.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.104 -0.498 . . . . 10.0 111.079 179.288 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -73.62 -44.77 56.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.158 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 15.8 mt -58.41 -47.38 84.1 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.393 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 14.1 p -64.11 -39.89 95.03 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.312 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . 0.641 ' HA ' ' HE3' ' A' ' 396' ' ' LYS . . . -62.81 -50.71 69.91 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.998 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 67.9 mt -62.79 -28.64 70.13 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.166 0.432 . . . . 10.0 112.166 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -86.57 -33.15 20.32 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.556 0.576 . . . . 10.0 112.556 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -85.13 -38.7 18.76 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.65 0.611 . . . . 10.0 112.65 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -67.1 -29.24 68.94 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 112.25 0.463 . . . . 10.0 112.25 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.28 -30.21 70.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.848 0.356 . . . . 10.0 110.905 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -63.47 -26.62 68.81 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.928 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . 0.406 ' NZ ' ' HB2' ' A' ' 388' ' ' SER . 0.1 OUTLIER -94.97 -4.59 46.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.594 -179.103 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 82.8 mt -98.5 -15.79 19.44 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.359 -0.382 . . . . 10.0 111.398 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 . . . . . 0 C--O 1.246 0.877 0 CA-C-O 118.412 -0.804 . . . . 10.0 110.229 179.927 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.43 ' N ' ' H51' ' A' ' 9' ' ' PCW . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.241 0 N-CA-C 109.818 -0.438 . . . . 10.0 109.818 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.5 m -109.94 104.59 13.53 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.793 0.33 . . . . 10.0 110.468 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.549 ' OE2' ' H72' ' A' ' 30' ' ' PCW . 17.5 tt0 -99.65 116.32 31.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.45 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -109.51 119.61 39.96 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.582 -179.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.523 ' HE2' ' O4 ' ' A' ' 40' ' ' 17F . 6.8 mptt -93.86 122.89 36.81 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 178.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.617 HD22 HD23 ' B' ' 159' ' ' LEU . 42.4 mt -117.93 124.37 48.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.836 0.351 . . . . 10.0 111.232 -178.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 29.2 t -107.86 114.14 45.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.226 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 26.0 t -91.15 117.09 33.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.36 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 19.1 m -113.68 161.41 12.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.719 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 152.57 172.03 20.65 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 111.321 -0.711 . . . . 10.0 111.321 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.562 ' HB3' HG13 ' B' ' 14' ' ' VAL . . . -66.74 167.05 11.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.189 0.519 . . . . 10.0 112.081 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -67.66 -16.57 67.98 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 115.863 -0.608 . . . . 10.0 113.94 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -115.0 18.72 16.08 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.398 -0.906 . . . . 10.0 113.73 -179.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.562 HG13 ' HB3' ' B' ' 11' ' ' ALA . 35.8 m -80.27 -32.27 13.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 117.691 0.746 . . . . 10.0 112.184 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.69 39.34 2.76 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.782 -0.723 . . . . 10.0 113.129 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -61.14 -47.99 83.67 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 2.9 p -62.49 -43.28 99.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.517 0.199 . . . . 10.0 111.106 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.01 -47.47 85.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.126 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 35.8 mt -61.82 -44.99 95.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.391 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . 0.425 ' O ' HG12 ' B' ' 24' ' ' ILE . 6.7 m -65.82 -51.4 59.26 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.041 -0.527 . . . . 10.0 112.283 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 50.3 mt -62.48 -30.27 48.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-O 120.932 0.396 . . . . 10.0 110.688 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.55 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 28.4 tp60 -66.28 -25.1 66.71 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.753 179.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 36.2 tp -95.15 -32.97 12.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.066 0.46 . . . . 10.0 110.219 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . 0.425 HG12 ' O ' ' B' ' 20' ' ' THR . 48.8 mm -73.27 -63.48 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.997 -0.547 . . . . 10.0 112.058 -179.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -110.04 -3.6 16.36 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.101 0.408 . . . . 10.0 112.101 -178.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.55 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 20.1 m-80 66.57 38.51 4.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.4 0.619 . . . . 10.0 109.703 -178.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 21.2 t60 -123.52 114.21 19.77 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.55 -179.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -85.1 134.82 34.18 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.592 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 m -98.96 115.19 38.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 N-CA-C 109.668 -0.493 . . . . 10.0 109.668 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -85.84 -7.07 58.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.081 -0.508 . . . . 10.0 111.65 -178.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -101.39 161.61 13.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.077 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.802 ' HA ' H5'1 ' B' ' 201' ' ' GNP . 68.6 t80 -85.81 91.7 8.41 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.084 0.469 . . . . 10.0 110.854 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.11 135.16 37.5 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.097 179.097 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.3 172.29 14.38 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.605 2.203 . . . . 10.0 112.364 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . 0.802 HG22 ' HA ' ' B' ' 59' ' ' ALA . 0.9 OUTLIER -165.6 136.13 3.68 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.398 -179.779 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 4.2 mp -130.56 -62.54 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 107.398 -1.334 . . . . 10.0 107.398 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.94 85.36 1.68 Allowed 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.029 -0.987 . . . . 10.0 109.031 178.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -120.86 110.41 16.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.611 -0.722 . . . . 10.0 111.006 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . 0.416 ' HB2' ' NE2' ' D' ' 818' ' ' GLN . 0.0 OUTLIER -100.51 149.1 24.05 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.464 -0.789 . . . . 10.0 112.292 -179.158 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -124.54 176.39 6.55 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.245 -0.888 . . . . 10.0 109.129 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' B' ' 41' ' ' ARG . 40.6 ttm180 -163.09 130.56 3.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.571 0.224 . . . . 10.0 111.268 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -157.49 158.02 34.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.401 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -120.83 128.0 52.44 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 7.9 m -139.53 173.52 10.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.999 0.428 . . . . 10.0 110.96 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 21.9 t -103.43 106.03 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.545 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 58.9 mt -102.99 114.42 42.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.684 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.829 ' HB2' HH22 ' B' ' 164' ' ' ARG . 29.7 m-20 61.32 27.19 16.89 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.947 -0.57 . . . . 10.0 111.571 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.63 -9.25 73.92 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.566 -0.826 . . . . 10.0 113.035 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -105.43 124.33 49.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.858 0.361 . . . . 10.0 110.903 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 12.7 t -80.85 136.91 36.17 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.723 -0.473 . . . . 10.0 109.723 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -154.68 161.0 41.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.727 0.299 . . . . 10.0 111.18 -179.256 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 29.7 tp -96.45 130.15 43.66 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 86.7 mt -109.3 115.86 30.78 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.925 0.393 . . . . 10.0 112.012 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -101.15 97.32 7.87 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.044 -1.095 . . . . 10.0 108.044 178.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 27.5 mt -93.5 129.24 44.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.897 -0.592 . . . . 10.0 112.496 -177.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 48.3 tp -119.26 115.59 24.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.861 -0.608 . . . . 10.0 109.91 178.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -89.59 119.31 29.9 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.793 -0.639 . . . . 10.0 110.293 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 40.2 p -75.74 156.83 34.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.881 -0.6 . . . . 10.0 112.074 -178.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.802 ' HA ' HG22 ' B' ' 35' ' ' THR . . . -57.38 155.17 9.56 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.488 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.52 -53.14 26.22 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.636 -0.792 . . . . 10.0 111.587 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -132.77 128.79 37.59 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.854 -0.424 . . . . 20.0 109.854 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.476 ' HG2' ' H ' ' B' ' 63' ' ' GLU . 2.2 tt0 -140.09 171.41 14.21 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.152 -0.476 . . . . 10.0 109.77 -179.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . 0.476 ' H ' ' HG2' ' B' ' 62' ' ' GLU . 20.5 mt-10 -108.18 -86.54 0.51 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.198 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -164.38 93.29 0.67 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.029 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 31.5 t -118.42 153.56 33.89 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.894 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.93 -28.76 69.75 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.179 0.514 . . . . 10.0 110.188 179.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 11.2 mmm -64.08 -31.59 72.83 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.06 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.559 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 48.8 ttt85 -67.17 -52.47 40.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.397 -0.82 . . . . 10.0 110.572 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -31.77 67.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.602 -0.727 . . . . 10.0 110.099 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.746 ' HB2' ' H12' ' A' ' 17' ' ' PCW . 14.2 tt0 -61.71 -57.59 11.36 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.31 -0.859 . . . . 10.0 112.313 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . 0.559 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 4.9 p90 -71.07 -18.71 62.54 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.373 0.879 . . . . 10.0 113.373 -178.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 84.9 mtp -89.39 -5.51 57.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.09 0.472 . . . . 10.0 111.016 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . 0.599 ' HD3' H322 ' A' ' 1' ' ' PCW . 11.0 ttm105 -89.18 -33.1 17.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.671 -179.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -47.48 62.19 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.837 0.68 . . . . 10.0 112.837 -178.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.49 148.38 45.29 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.678 -0.772 . . . . 10.0 113.897 -178.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -107.52 -45.65 4.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.192 0.52 . . . . 10.0 109.795 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -92.05 133.77 11.91 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.239 -0.744 . . . . 10.0 111.239 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -125.69 132.1 52.47 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.329 0.492 . . . . 10.0 112.329 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.726 ' HG ' HD22 ' B' ' 159' ' ' LEU . 78.0 mt -97.3 114.35 26.1 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.762 179.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . 0.499 ' HB3' HD12 ' B' ' 93' ' ' ILE . 21.1 m -87.31 89.94 8.18 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 21.9 t -91.14 123.48 43.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.78 -0.645 . . . . 10.0 111.417 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.639 ' HB3' HD11 ' B' ' 93' ' ' ILE . 38.5 p90 -132.95 168.73 17.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.822 -0.626 . . . . 10.0 109.668 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -102.8 120.89 41.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 110.022 -0.362 . . . . 10.0 110.022 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.924 HD11 ' HA ' ' B' ' 118' ' ' CYS . 42.2 pt -68.99 -7.75 8.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 112.124 0.416 . . . . 10.0 112.124 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -102.92 7.12 39.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.279 0.562 . . . . 10.0 110.603 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -141.77 100.54 3.77 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.065 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.9 -27.04 64.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.886 -0.597 . . . . 10.0 112.16 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 9.2 tmtm? -58.28 -47.58 83.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.515 -0.311 . . . . 10.0 110.939 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 71.1 p -67.75 -31.0 70.61 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.26 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -67.19 -40.74 86.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.091 0.472 . . . . 10.0 110.142 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -71.88 -29.36 64.27 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.727 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.57 -11.64 61.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.914 -0.584 . . . . 10.0 112.006 -179.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . 0.639 HD11 ' HB3' ' B' ' 82' ' ' PHE . 33.3 mm -59.46 -40.93 83.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.887 0.375 . . . . 10.0 110.086 179.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -64.18 -39.9 94.97 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 108.692 -0.855 . . . . 10.0 108.692 178.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 8.2 t-160 -63.26 -39.33 94.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.227 -0.897 . . . . 10.0 110.132 179.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . 0.401 ' O ' HG13 ' B' ' 100' ' ' ILE . 21.0 m-85 -69.88 -52.22 26.62 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.529 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . 0.573 ' NH1' ' HB3' ' B' ' 137' ' ' TYR . 8.6 ttt180 -54.1 -43.11 70.13 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.629 0.252 . . . . 10.0 111.435 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -65.39 -38.03 88.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.343 -0.389 . . . . 10.0 111.267 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -69.21 -36.45 77.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.965 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . 0.401 HG13 ' O ' ' B' ' 96' ' ' TYR . 73.8 mt -70.99 -37.86 69.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.344 178.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . 0.876 ' HD2' ' HG3' ' B' ' 107' ' ' GLU . 33.4 ttpt -60.39 -32.17 71.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.663 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 1.2 ttp-105 -68.01 -29.97 69.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.667 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.825 HG23 ' HE2' ' B' ' 104' ' ' LYS . 22.3 m -95.57 -9.35 9.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.541 -0.3 . . . . 10.0 111.536 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.825 ' HE2' HG23 ' B' ' 103' ' ' VAL . 14.0 mmtt -103.96 -18.22 14.68 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.572 -0.286 . . . . 10.0 110.861 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 15.2 t70 75.87 -39.0 0.36 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.644 -0.707 . . . . 10.0 112.527 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 5.0 m -107.73 156.29 19.26 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.726 0.298 . . . . 10.0 111.026 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . 0.876 ' HG3' ' HD2' ' B' ' 101' ' ' LYS . 35.1 mp0 -81.18 -19.66 42.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.944 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -79.16 84.12 5.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.522 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 19.8 t -127.39 132.6 24.41 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.858 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -65.53 99.23 0.36 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.581 2.188 . . . . 10.0 111.322 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . 0.441 ' HB2' HG21 ' B' ' 139' ' ' ILE . 66.9 mtt -121.56 153.79 37.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.592 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.609 ' HB ' HD23 ' B' ' 79' ' ' LEU . 99.1 t -134.62 130.67 53.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 179.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . 0.486 ' HG ' ' HE1' ' B' ' 82' ' ' PHE . 14.6 tp -85.35 114.67 22.59 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.644 -0.502 . . . . 10.0 109.644 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 66.2 t -109.34 112.05 38.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.784 -178.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -93.93 97.82 2.26 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 110.339 -1.104 . . . . 10.0 110.339 178.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . 0.557 ' HA ' ' O ' ' B' ' 144' ' ' THR . 65.3 t30 -87.07 162.67 17.45 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.139 0.422 . . . . 10.0 112.139 -178.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 92.8 mttt 74.15 34.95 0.8 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.207 -0.906 . . . . 10.0 112.455 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . 0.924 ' HA ' HD11 ' B' ' 84' ' ' ILE . 5.4 p -71.74 -7.47 48.29 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.983 0.42 . . . . 10.0 111.457 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -90.33 -5.12 56.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.785 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 68.0 mt -96.52 129.22 33.76 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.267 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.79 1.1 8.47 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 123.191 2.594 . . . . 10.0 112.136 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.35 16.16 5.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.419 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -56.8 122.29 11.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.65 -0.705 . . . . 10.0 111.902 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.71 -22.54 11.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.318 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 38.9 t -98.55 118.18 44.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.56 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . 0.578 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 31.7 t70 -72.12 151.24 43.16 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.263 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 2.0 m -58.59 -42.55 88.31 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.243 0.46 . . . . 10.0 112.243 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -67.13 -34.67 78.09 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.678 0.251 . . . . 10.0 111.678 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . 0.578 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 50.6 mt-30 -61.36 -43.34 99.03 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.232 0.539 . . . . 10.0 109.931 179.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.53 -42.78 64.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.643 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -59.86 -43.97 94.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.053 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -61.25 -43.48 98.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.718 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 31.2 tp -65.04 -40.41 94.76 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.232 -0.44 . . . . 10.0 109.897 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.32 -46.43 88.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.707 -0.678 . . . . 10.0 110.402 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.425 HH11 ' HD3' ' B' ' 135' ' ' ARG . 7.0 tpt180 -64.54 -32.9 74.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.242 -0.436 . . . . 10.0 110.482 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 44.0 m -70.61 -18.31 62.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.593 179.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . 0.573 ' HB3' ' NH1' ' B' ' 97' ' ' ARG . 8.1 m-30 -106.08 1.11 26.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.852 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 66.69 28.93 74.01 Favored Glycine 0 CA--C 1.517 0.199 0 CA-C-N 115.914 -0.584 . . . . 10.0 112.801 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . 0.441 HG21 ' HB2' ' B' ' 111' ' ' MET . 49.4 pt -123.21 153.84 65.02 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.593 0.235 . . . . 10.0 110.874 -179.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -83.29 149.22 13.25 Favored 'Trans proline' 0 C--O 1.235 0.332 0 C-N-CA 122.435 2.09 . . . . 10.0 112.019 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -109.46 128.22 54.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.253 -0.431 . . . . 10.0 110.12 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 24.7 mm -126.48 123.99 64.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.085 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . 0.528 ' HG2' ' HB3' ' B' ' 118' ' ' CYS . 4.3 tt0 -83.01 127.01 33.17 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 107.792 -1.188 . . . . 10.0 107.792 178.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . 0.557 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 11.1 m -133.58 160.6 36.99 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.136 0.493 . . . . 10.0 112.21 -177.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . 0.437 ' HA ' ' OD1' ' B' ' 116' ' ' ASN . 12.7 t -157.58 123.53 4.72 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.025 -0.731 . . . . 10.0 109.025 178.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -76.89 -21.39 54.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.074 0.464 . . . . 10.0 110.065 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -73.06 -48.4 36.32 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.173 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 34.2 p -92.04 -6.21 51.48 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.032 0.444 . . . . 10.0 111.205 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . 0.41 ' HG3' ' CG ' ' B' ' 22' ' ' GLN . 3.4 ttt-85 58.86 38.13 24.64 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.354 -0.839 . . . . 10.0 111.484 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -107.22 136.07 47.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.057 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 76.44 -10.09 18.38 Favored Glycine 0 CA--C 1.518 0.254 0 O-C-N 123.531 0.519 . . . . 10.0 114.332 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 22.5 t -55.52 -54.82 21.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 112.117 0.414 . . . . 10.0 112.117 -178.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.91 -47.7 82.14 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.994 -178.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -62.46 -36.55 82.8 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.255 0.465 . . . . 10.0 112.255 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -59.42 -47.19 86.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.935 0.398 . . . . 10.0 110.48 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -68.81 -42.55 77.13 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.644 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 17.2 m-30 -61.67 -43.69 98.37 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.658 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.523 ' O ' ' HG2' ' B' ' 162' ' ' GLU . 97.0 m -59.11 -40.45 85.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.26 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.726 HD22 ' HG ' ' B' ' 79' ' ' LEU . 30.1 tp -57.5 -44.69 85.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.289 0.566 . . . . 10.0 109.56 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 44.5 t -65.73 -38.23 81.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.179 179.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . 0.516 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 76.6 mtt180 -63.04 -35.68 81.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.843 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' B' ' 158' ' ' THR . 10.3 mm-40 -69.83 -41.4 75.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.05 0.452 . . . . 10.0 110.004 179.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . 0.541 ' O ' ' HG2' ' B' ' 167' ' ' LYS . 85.1 mt -62.85 -43.64 99.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.31 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . 0.829 HH22 ' HB2' ' B' ' 47' ' ' ASP . 0.2 OUTLIER -55.34 -48.44 74.21 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.707 179.327 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 29.1 mtmm -64.77 -37.58 88.1 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.238 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -61.25 -43.05 99.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.845 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . 0.541 ' HG2' ' O ' ' B' ' 163' ' ' ILE . 72.3 mmtt -65.97 -46.6 77.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.39 179.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.63 -47.82 83.68 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.384 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -62.9 -34.92 78.45 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.014 0.376 . . . . 10.0 112.014 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 15.1 mmt -71.74 -34.92 69.92 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.901 0.381 . . . . 10.0 110.583 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 21.6 m -70.85 -24.59 62.54 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.2 -0.455 . . . . 10.0 111.409 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . 0.425 ' HA ' ' H83' ' A' ' 6' ' ' PCW . 27.5 mtmt -97.34 -4.68 38.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.754 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 47.8 t0 62.62 94.96 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.794 0.683 . . . . 10.0 112.015 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . -83.07 76.18 2.28 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.816 -0.707 . . . . 10.0 112.227 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 39.1 mmtm -73.76 74.14 1.56 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.087 0.47 . . . . 10.0 111.13 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -113.65 115.65 28.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.852 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 20.3 mmmt 70.97 -59.92 0.53 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.995 0.739 . . . . 10.0 112.995 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -75.43 93.09 2.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.926 0.393 . . . . 10.0 110.367 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.36 155.79 15.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.872 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . 0.832 ' NZ ' ' HN1' ' A' ' 33' ' ' 17F . 85.7 mttt -94.76 101.16 12.98 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 178.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 10.8 m -70.89 87.48 0.72 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.555 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . 0.442 ' HB3' ' H ' ' B' ' 183' ' ' THR . 23.2 mmtt -151.35 -156.9 0.76 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.211 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . 0.442 ' H ' ' HB3' ' B' ' 182' ' ' LYS . 0.3 OUTLIER -73.48 100.78 3.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.343 179.802 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . 0.44 ' HA ' ' HD2' ' B' ' 184' ' ' LYS . 19.4 tptp -105.13 -9.86 17.5 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.81 -179.326 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 85.7 m . . . . . 0 C--O 1.236 0.37 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.938 179.905 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.036 -0.426 . . . . 10.0 112.036 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.28 131.75 53.78 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.806 0.336 . . . . 10.0 110.694 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 49.0 t -118.64 140.83 40.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.996 -178.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.96 123.11 34.2 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.353 178.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 812' ' ' VAL . . . . . 0.828 HG11 HD11 ' D' ' 834' ' ' LEU . 47.0 t -107.6 136.96 41.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 116.11 -0.496 . . . . 10.0 109.952 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -90.58 133.3 35.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.933 0.397 . . . . 10.0 111.487 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 814' ' ' LEU . . . . . . . . . . . . . 83.7 mt -101.67 147.63 34.13 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.766 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 815' ' ' PRO . . . . . 0.487 ' HD3' ' HB ' ' D' ' 877' ' ' VAL . 60.4 Cg_endo -72.72 45.16 0.84 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 123.247 2.631 . . . . 10.0 113.458 -178.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -148.98 27.58 0.86 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.117 0.484 . . . . 10.0 109.998 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 817' ' ' LYS . . . . . 0.53 ' HG2' ' H11' ' A' ' 22' ' ' PCW . 49.3 mttm 60.37 44.16 12.57 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.176 -0.92 . . . . 10.0 111.826 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 818' ' ' GLN . . . . . 0.416 ' NE2' ' HB2' ' B' ' 39' ' ' SER . 76.8 mt-30 -147.91 177.1 9.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.952 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 819' ' ' ARG . . . . . 0.402 ' HD2' HH11 ' D' ' 819' ' ' ARG . 0.0 OUTLIER -143.97 168.46 19.92 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.858 0.361 . . . . 10.0 111.287 -178.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 12.0 t -147.63 151.55 36.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.737 -0.665 . . . . 10.0 109.283 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 4.2 t -104.9 117.46 50.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.809 0.338 . . . . 10.0 111.016 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 21.1 t -112.68 140.81 30.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.716 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.22 137.03 33.71 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.71 179.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 22.0 t -87.43 120.88 37.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.824 0.345 . . . . 10.0 110.15 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 825' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' D' ' 825' ' ' ARG . 16.5 mtp180 -129.34 135.11 48.32 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.698 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -78.84 49.37 0.9 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.92 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . -161.04 25.98 0.27 Allowed Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 120.457 -0.878 . . . . 10.0 112.34 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 11.6 ptm -151.94 159.06 43.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.626 0.25 . . . . 10.0 111.128 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 829' ' ' SER . . . . . 0.72 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 93.9 p -100.98 -179.71 4.13 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.737 -179.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 830' ' ' VAL . . . . . 0.543 HG11 HG21 ' D' ' 850' ' ' VAL . 98.6 t -67.1 -33.39 62.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 108.898 -0.779 . . . . 10.0 108.898 178.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 831' ' ' TYR . . . . . 0.47 ' O ' ' HB2' ' D' ' 835' ' ' ASP . 73.4 t80 -59.38 -43.14 92.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.463 -0.789 . . . . 10.0 110.546 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -68.73 -56.07 9.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.115 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 1.7 m -57.59 -37.22 72.84 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.383 0.883 . . . . 10.0 113.383 -178.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 834' ' ' LEU . . . . . 0.828 HD11 HG11 ' D' ' 812' ' ' VAL . 3.4 mm? -91.89 -8.98 44.87 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.915 0.709 . . . . 10.0 112.915 -178.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 835' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' D' ' 831' ' ' TYR . 24.2 t70 -62.07 -56.81 15.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.956 0.407 . . . . 10.0 110.499 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -59.93 -33.16 71.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.82 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -67.75 -36.57 80.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.491 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 838' ' ' LEU . . . . . 0.708 HD21 HG11 ' D' ' 877' ' ' VAL . 88.0 mt -86.13 -43.31 13.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.42 -0.355 . . . . 10.0 111.913 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 839' ' ' LYS . . . . . 0.493 ' HA ' ' HD3' ' D' ' 839' ' ' LYS . 16.1 mmtp -61.64 -30.71 70.89 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.16 0.429 . . . . 10.0 112.16 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 5.1 p -71.11 -17.82 20.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.926 0.394 . . . . 10.0 111.226 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 841' ' ' ARG . . . . . 0.444 ' HA ' ' HD2' ' D' ' 841' ' ' ARG . 0.6 OUTLIER -108.93 -2.85 18.01 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.893 0.331 . . . . 10.0 111.893 -179.758 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 83.91 33.52 20.98 Favored Glycine 0 N--CA 1.453 -0.173 0 C-N-CA 120.934 -0.651 . . . . 10.0 113.057 179.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 64.3 mt -121.27 154.78 35.89 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -123.15 152.56 41.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.855 0.36 . . . . 10.0 111.035 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -66.73 -6.24 15.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.592 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -74.13 -27.1 60.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.691 -0.686 . . . . 10.0 111.599 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 1.9 m -124.38 20.57 8.79 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.655 0.264 . . . . 10.0 111.697 -178.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 82.6 m -143.9 157.34 44.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.926 0.393 . . . . 10.0 110.721 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 849' ' ' VAL . . . . . 0.551 ' HB ' HD11 ' D' ' 880' ' ' LEU . 4.4 p -144.43 156.54 14.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.87 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 850' ' ' VAL . . . . . 0.691 HG12 HG22 ' D' ' 877' ' ' VAL . 3.8 m -100.62 127.95 53.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.168 0.508 . . . . 10.0 112.3 -179.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 851' ' ' TYR . . . . . 0.475 ' CE1' HG22 ' D' ' 860' ' ' VAL . 74.5 m-85 -107.03 117.28 33.64 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 852' ' ' ARG . . . . . 0.671 ' HD2' ' OE1' ' D' ' 873' ' ' GLU . 12.7 mtm180 -75.93 127.39 32.89 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 110.126 -0.324 . . . . 10.0 110.126 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 853' ' ' LEU . . . . . 0.523 HD12 ' H72' ' A' ' 21' ' ' PCW . 0.5 OUTLIER -90.66 87.66 6.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.008 0.433 . . . . 10.0 110.883 -179.243 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 54.1 mt -99.67 103.1 14.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.353 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt 52.91 28.7 6.83 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.42 0.896 . . . . 10.0 113.42 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 98.53 6.37 56.47 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.535 -0.841 . . . . 10.0 113.318 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 857' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' D' ' 857' ' ' ARG . 45.0 mmt-85 -113.99 117.03 30.18 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.387 -0.478 . . . . 10.0 111.143 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 858' ' ' LYS . . . . . 0.423 ' HE3' ' O31' ' A' ' 10' ' ' PCW . 92.7 mttt -73.43 109.59 7.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.819 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 4.0 m -104.42 117.4 34.08 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.422 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 860' ' ' VAL . . . . . 0.475 HG22 ' CE1' ' D' ' 851' ' ' TYR . 2.1 t -67.55 132.86 32.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.742 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 28.7 m -136.27 146.75 47.03 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.118 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -81.4 170.03 16.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.508 -179.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 863' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -83.26 -18.49 38.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.04 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.04 -16.41 63.15 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.702 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.19 148.38 43.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.273 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 866' ' ' ALA . . . . . 0.72 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -82.16 161.57 22.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.385 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 9.2 tp -89.32 -0.48 8.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.499 0.666 . . . . 10.0 110.861 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 868' ' ' ALA . . . . . 0.491 ' HB3' ' HD3' ' D' ' 869' ' ' PRO . . . -62.42 -51.33 74.1 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 113.193 0.812 . . . . 10.0 113.193 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 869' ' ' PRO . . . . . 0.491 ' HD3' ' HB3' ' D' ' 868' ' ' ALA . 2.9 Cg_exo -78.08 31.8 0.44 Allowed 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 122.491 2.127 . . . . 10.0 112.864 -179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 870' ' ' LEU . . . . . 0.5 HD11 ' HD3' ' D' ' 852' ' ' ARG . 3.4 mm? -117.62 25.96 10.04 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.239 0.542 . . . . 10.0 110.108 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -71.78 105.38 3.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.915 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 90.17 13.16 60.74 Favored Glycine 0 CA--C 1.517 0.217 0 C-N-CA 120.842 -0.694 . . . . 10.0 113.095 178.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 873' ' ' GLU . . . . . 0.671 ' OE1' ' HD2' ' D' ' 852' ' ' ARG . 5.1 tt0 -114.43 156.15 25.04 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 122.709 -0.289 . . . . 10.0 110.648 -179.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -114.4 154.5 28.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.577 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 875' ' ' LEU . . . . . 0.476 HD23 ' HG2' ' D' ' 852' ' ' ARG . 6.3 mt -128.21 135.56 49.87 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.409 -0.359 . . . . 10.0 111.696 -178.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 876' ' ' ILE . . . . . 0.499 ' CD1' ' H12' ' A' ' 10' ' ' PCW . 63.9 mt -118.88 118.28 57.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 108.488 -0.93 . . . . 10.0 108.488 178.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 877' ' ' VAL . . . . . 0.708 HG11 HD21 ' D' ' 838' ' ' LEU . 11.9 t -90.02 124.3 42.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.566 0.222 . . . . 10.0 110.58 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 878' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -127.0 155.29 43.44 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.014 0.435 . . . . 10.0 111.045 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 879' ' ' VAL . . . . . . . . . . . . . 13.5 t -76.28 143.55 12.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.426 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 880' ' ' LEU . . . . . 0.595 ' OXT' ' H63' ' A' ' 8' ' ' PCW . 79.7 mt . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.438 -0.791 . . . . 10.0 111.313 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PCW . . . . . 0.788 H122 ' H20' ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PCW . . . . . 0.508 H321 H352 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PCW . . . . . 0.793 H332 ' H31' ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PCW . . . . . 0.462 H342 H172 ' A' ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PCW . . . . . 0.619 ' H12' H361 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PCW . . . . . 0.572 ' H32' H18A ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PCW . . . . . 0.882 ' H2 ' ' H11' ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PCW . . . . . 0.638 H152 H141 ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PCW . . . . . 0.92 H322 H351 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PCW . . . . . 0.769 H381 H142 ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PCW . . . . . 0.592 ' H39' ' H71' ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PCW . . . . . 0.838 ' H72' ' HN1' ' A' ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PCW . . . . . 0.676 H332 H142 ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PCW . . . . . 0.92 H351 H322 ' A' ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PCW . . . . . 0.645 ' H42' ' H1 ' ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PCW . . . . . 0.882 ' H11' ' H2 ' ' A' ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PCW . . . . . 0.746 ' H12' ' HB2' ' B' ' 70' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PCW . . . . . 0.788 H232 H442 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PCW . . . . . 0.782 H241 H161 ' A' ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PCW . . . . . 0.656 H332 H131 ' A' ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PCW . . . . . 0.523 ' H72' HD12 ' D' ' 853' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PCW . . . . . 0.561 H361 H372 ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PCW . . . . . 0.793 ' H31' H332 ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PCW . . . . . 0.552 ' H51' ' H73' ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PCW . . . . . 0.458 H232 H462 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PCW . . . . . 0.629 H461 H471 ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PCW . . . . . 0.524 H222 H442 ' A' ' 8' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PCW . . . . . 0.592 ' H71' ' H39' ' A' ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PCW . . . . . 0.701 H371 H441 ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PCW . . . . . 0.653 H442 H471 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PCW . . . . . 0.445 H462 H442 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PCW . . . . . 0.529 H122 ' H33' ' A' ' 33' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' 17F . . . . . 0.832 ' HN1' ' NZ ' ' B' ' 180' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' 17F . . . . . 0.648 ' H42' ' H52' ' A' ' 75' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' 17F . . . . . 0.788 ' H20' H122 ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' 17F . . . . . 0.63 ' H19' H181 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' 17F . . . . . 0.545 ' H57' H232 ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' 17F . . . . . 0.645 ' H1 ' ' H42' ' A' ' 15' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' 17F . . . . . 0.838 ' HN1' ' H72' ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PCW . . . . . 0.627 H261 H452 ' A' ' 58' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PCW . . . . . 0.701 H162 H141 ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PCW . . . . . 0.698 H372 H122 ' A' ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PCW . . . . . 0.778 H371 H431 ' A' ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PCW . . . . . 0.932 ' H40' ' H61' ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PCW . . . . . 0.567 H172 H131 ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PCW . . . . . 0.635 ' H20' ' H20' ' A' ' 76' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PCW . . . . . 0.689 H332 H181 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PCW . . . . . 0.788 H442 H232 ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PCW . . . . . 0.605 ' C4 ' ' HN1' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PCW . . . . . 0.591 ' H11' ' H32' ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PCW . . . . . 0.701 H141 H162 ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PCW . . . . . 0.792 H361 H122 ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PCW . . . . . 0.689 H181 H332 ' A' ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PCW . . . . . 0.661 H382 H362 ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PCW . . . . . 0.731 H331 H131 ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PCW . . . . . 0.932 ' H61' ' H40' ' A' ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PCW . . . . . 0.627 H452 H261 ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PCW . . . . . 0.78 ' H40' H161 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' PCW . . . . . 0.641 H322 ' H62' ' A' ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PCW . . . . . 0.78 H161 ' H40' ' A' ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PCW . . . . . 0.717 H351 H332 ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PCW . . . . . 0.641 ' H62' H322 ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PCW . . . . . 0.792 H122 H361 ' A' ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PCW . . . . . 0.479 ' O31' ' H51' ' A' ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PCW . . . . . 0.633 ' H20' H321 ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PCW . . . . . 0.633 H321 ' H20' ' A' ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PCW . . . . . 0.596 ' H31' H171 ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PCW . . . . . 0.778 H431 H371 ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PCW . . . . . 0.596 H171 ' H31' ' A' ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PCW . . . . . 0.687 H321 ' H19' ' A' ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PCW . . . . . 0.717 H332 H351 ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' 17F . . . . . 0.646 ' H53' H262 ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' 17F . . . . . 0.966 ' H4A' HN1A ' A' ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' 17F . . . . . 0.648 ' H52' ' H42' ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' 17F . . . . . 0.635 ' H20' ' H20' ' A' ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' 17F . . . . . 0.636 HN1A ' H62' ' A' ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' 17F . . . . . 0.605 ' HN1' ' C4 ' ' A' ' 50' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' 17F . . . . . 0.966 HN1A ' H4A' ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' 17F . . . . . 0.529 ' H18' ' H11' ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 201' ' ' GNP . . . . . 0.802 H5'1 ' HA ' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 74.8 mt . . . . . 0 CA--C 1.518 -0.28 0 CA-C-O 121.288 0.566 . . . . 10.0 110.171 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 41.5 mttm -61.42 -35.83 78.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.948 -1.023 . . . . 10.0 110.458 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 25.0 mt -66.6 -34.24 77.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.833 -0.622 . . . . 10.0 110.799 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 95.9 mt -66.43 -44.08 83.91 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.344 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.62 -35.16 76.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.956 0.407 . . . . 10.0 110.535 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . 0.448 ' O ' HG23 ' A' ' 210' ' ' VAL . 25.9 t-20 -65.66 -48.11 73.26 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 178.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 3.2 m95 -65.77 -30.65 71.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.725 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -63.05 -34.57 77.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.396 0.617 . . . . 10.0 109.717 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 49.6 m -78.21 -23.18 47.62 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.458 -0.792 . . . . 10.0 109.671 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 206' ' ' ASN . 77.6 t -77.76 -45.75 27.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.806 -0.633 . . . . 10.0 109.697 178.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 4.9 p -63.31 -43.14 98.65 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.887 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 26.8 p -61.09 -42.35 98.35 Favored 'General case' 0 C--N 1.333 -0.113 0 N-CA-C 109.75 -0.463 . . . . 10.0 109.75 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 84.6 m -67.31 -38.49 85.04 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.877 178.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . 0.445 ' HD1' ' HA ' ' A' ' 214' ' ' PHE . 1.7 m-30 -61.47 -40.64 95.25 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.089 0.471 . . . . 10.0 109.958 178.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 28.6 m -68.26 -45.97 71.71 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.092 178.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.4 -31.77 73.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.066 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 11.2 mt -67.49 -40.66 85.23 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.47 -0.567 . . . . 10.0 109.47 178.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . 0.594 ' HD3' H141 ' A' ' 15' ' ' PCW . 85.6 mtm180 -72.66 -33.42 66.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.861 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -62.14 -30.51 71.09 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -90.9 -32.66 15.93 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.329 -0.85 . . . . 10.0 109.952 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 218' ' ' ARG . 18.3 mt -59.56 -38.02 79.99 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.532 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -53.21 -67.83 1.93 Allowed Glycine 0 C--N 1.33 0.231 0 N-CA-C 111.426 -0.67 . . . . 10.0 111.426 178.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -58.73 -37.89 91.8 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.565 2.177 . . . . 10.0 111.786 177.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 4.6 t -55.94 -50.39 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-O 120.609 0.242 . . . . 10.0 110.754 179.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 4.7 p -67.16 -32.32 73.35 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.56 -0.456 . . . . 10.0 110.366 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -64.56 -52.0 59.88 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 178.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . 0.468 ' HG2' ' HG2' ' C' ' 546' ' ' GLU . 1.5 mp0 -61.18 -43.91 98.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.845 178.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -61.06 -48.82 79.95 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.838 179.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 17.5 m95 -63.28 -39.11 93.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.723 0.297 . . . . 10.0 110.833 179.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -62.8 -49.99 72.77 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.213 0.53 . . . . 10.0 110.269 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . 0.553 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 72.7 m-20 -68.45 -36.03 78.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.783 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 13.6 mt -65.05 -32.34 74.01 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -68.28 -37.52 80.77 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.942 -0.762 . . . . 10.0 108.942 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . 0.553 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 70.4 mttt -67.81 -39.95 83.89 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.734 -0.839 . . . . 10.0 108.734 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.26 -50.83 68.63 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.626 -0.716 . . . . 10.0 109.468 178.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 2.2 p -63.59 -38.06 89.7 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.819 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . 0.41 ' OE1' ' HD2' ' A' ' 240' ' ' ARG . 2.8 mm-40 -61.38 -44.05 97.82 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 109.917 -0.401 . . . . 10.0 109.917 178.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -66.03 -45.54 86.82 Favored Glycine 0 N--CA 1.443 -0.866 0 N-CA-C 109.19 -1.564 . . . . 10.0 109.19 177.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 46.8 mt -59.63 -34.21 72.49 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 115.256 -0.472 . . . . 10.0 111.166 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . 0.41 ' HD2' ' OE1' ' A' ' 237' ' ' GLU . 69.9 mtt180 -70.72 -44.38 66.98 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 178.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -64.78 -29.64 70.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.318 -0.856 . . . . 10.0 109.757 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . 0.634 ' HB3' HH21 ' C' ' 532' ' ' ARG . 15.5 mt-10 -86.93 -38.83 16.32 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.716 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . 0.478 ' HA ' ' HB2' ' A' ' 246' ' ' ASP . 1.7 mmt -62.01 -36.64 82.13 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.827 -0.17 . . . . 10.0 111.329 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 2.0 p -62.0 -39.99 94.11 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.79 -0.819 . . . . 10.0 108.79 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -73.35 -45.57 54.3 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.201 178.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . 0.478 ' HB2' ' HA ' ' A' ' 243' ' ' MET . 0.4 OUTLIER -53.91 -54.26 41.25 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 115.892 -0.595 . . . . 10.0 109.462 179.048 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.58 ' HB3' ' HE2' ' A' ' 251' ' ' LYS . 75.7 mt -63.52 -44.17 95.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.142 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -58.69 -55.18 38.45 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 120.746 0.308 . . . . 10.0 110.815 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -63.89 -50.09 70.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.821 -0.627 . . . . 10.0 111.603 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . 0.644 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 46.1 t -59.55 -45.58 93.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 112.057 0.391 . . . . 10.0 112.057 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.58 ' HE2' ' HB3' ' A' ' 247' ' ' LEU . 57.6 mtmt -72.48 -40.52 66.87 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.348 0.499 . . . . 10.0 112.348 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -68.68 -33.35 73.82 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.892 0.377 . . . . 10.0 110.696 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -88.12 -24.51 23.36 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.498 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.644 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.6 OUTLIER -63.45 -24.25 35.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.016 0.436 . . . . 10.0 110.005 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . 0.552 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 15.9 mt-30 -62.45 -64.5 2.98 Favored Pre-proline 0 N--CA 1.451 -0.419 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.43 178.258 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . 0.552 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 20.0 Cg_endo -63.59 -29.19 70.05 Favored 'Trans proline' 0 C--N 1.361 1.193 0 C-N-CA 121.802 1.668 . . . . 10.0 111.363 177.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . 0.494 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 5.0 m-30 -59.58 -57.77 11.52 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 109.424 -0.584 . . . . 10.0 109.424 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 72.7 mt -72.35 -32.86 66.85 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 115.686 -0.688 . . . . 10.0 111.003 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . 0.484 ' HB3' ' HA ' ' A' ' 256' ' ' PRO . 25.1 t70 -60.98 -49.06 78.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.748 0.309 . . . . 10.0 110.585 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -63.31 -44.97 93.48 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -61.41 -43.65 98.5 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.805 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -62.64 -46.23 89.19 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 110.258 -0.275 . . . . 10.0 110.258 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . 0.542 ' O ' ' HG3' ' A' ' 267' ' ' GLU . 71.0 mttt -59.6 -45.57 91.52 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.089 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.513 ' O ' ' HG3' ' A' ' 268' ' ' GLU . 14.1 mptt -65.8 -46.02 80.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.0 179.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 4.0 m0 -58.51 -41.14 84.76 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.39 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -59.86 -48.12 82.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.817 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . 0.542 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 31.3 mt-10 -64.12 -41.63 97.16 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . 0.601 ' O ' ' HB2' ' A' ' 272' ' ' TYR . 30.9 mt-10 -60.9 -40.1 91.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.861 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 96.2 mmm -75.6 -39.25 58.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.742 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -62.05 -52.58 63.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.286 0.565 . . . . 10.0 109.612 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.54 -22.44 66.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.504 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . 0.601 ' HB2' ' O ' ' A' ' 268' ' ' GLU . 1.0 OUTLIER -78.63 -46.44 19.24 Favored 'General case' 0 C--O 1.221 -0.406 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 178.305 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 43.0 mtt85 -62.98 -33.96 76.52 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.271 0.558 . . . . 10.0 109.78 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -70.63 -7.02 41.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.338 -0.846 . . . . 10.0 110.477 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.714 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 49.5 mttp -112.62 -36.38 5.23 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.493 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . 0.6 ' O ' ' HB2' ' A' ' 280' ' ' ARG . 53.5 t -48.96 -49.08 15.96 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.673 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . 0.74 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 65.3 mt-10 -62.7 -59.04 13.77 Favored Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 111.747 0.277 . . . . 10.0 111.747 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . 0.74 ' HD3' ' HB2' ' A' ' 277' ' ' GLU . 53.3 Cg_exo -56.26 -44.05 50.11 Favored 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 122.032 1.821 . . . . 10.0 111.932 178.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.719 ' HB3' ' HE3' ' C' ' 495' ' ' LYS . 34.8 mt -64.74 -40.06 94.69 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 116.578 -0.283 . . . . 10.0 110.304 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . 0.6 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 5.5 ttt180 -65.9 -35.36 80.42 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 109.214 -0.661 . . . . 10.0 109.214 178.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -64.94 -44.18 90.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.738 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -61.98 -48.24 81.24 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.9 -43.85 97.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.32 -0.855 . . . . 10.0 110.584 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -63.62 -50.55 68.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.745 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . 0.635 ' HA ' ' HD2' ' A' ' 288' ' ' ARG . 8.4 mm-40 -59.15 -45.86 89.87 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.899 0.38 . . . . 10.0 110.139 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.38 -44.64 96.54 Favored Glycine 0 N--CA 1.442 -0.921 0 N-CA-C 111.015 -0.834 . . . . 10.0 111.015 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -62.22 -38.29 88.62 Favored 'General case' 0 C--O 1.221 -0.441 0 N-CA-C 110.438 -0.208 . . . . 10.0 110.438 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . 0.635 ' HD2' ' HA ' ' A' ' 285' ' ' GLU . 75.5 mtt180 -58.24 -43.61 87.88 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -71.16 -49.98 38.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.144 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 59.9 mttt -57.48 -49.34 76.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.538 -0.756 . . . . 10.0 111.507 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 69.8 mt -66.46 -34.35 77.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.519 -0.31 . . . . 10.0 110.986 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . 0.473 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 0.2 OUTLIER -62.77 -53.25 57.14 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.682 -0.488 . . . . 10.0 109.682 179.194 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.4 -37.55 81.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.633 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 60.8 mt -64.57 -48.63 74.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.8 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 15.3 mt-30 -69.74 -33.36 72.35 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.84 0.353 . . . . 10.0 111.037 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.5 -11.2 60.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.148 178.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . 0.438 ' HE3' HD11 ' A' ' 301' ' ' LEU . 9.8 mttp -103.3 -38.64 7.14 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.94 -0.573 . . . . 10.0 109.84 177.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . 0.418 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 59.0 mt -63.73 -19.9 65.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.727 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . 0.542 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 14.8 m -80.63 -64.7 0.29 Allowed Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 116.578 -0.283 . . . . 10.0 111.736 179.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . 0.542 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 40.7 Cg_endo -68.72 -51.3 0.51 Allowed 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.954 1.769 . . . . 10.0 111.964 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.616 HD13 ' HG2' ' C' ' 473' ' ' LYS . 93.0 mt -66.81 -25.09 66.28 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.938 0.399 . . . . 10.0 110.193 179.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . 0.418 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -72.88 -41.19 50.06 Favored Glycine 0 N--CA 1.444 -0.822 0 N-CA-C 109.075 -1.61 . . . . 10.0 109.075 177.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -64.41 -41.79 96.44 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 178.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -64.11 -31.87 73.23 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.156 -0.475 . . . . 10.0 109.851 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 11.0 tpt -67.68 -42.3 82.34 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.741 -0.837 . . . . 10.0 108.741 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 306' ' ' ARG . 61.6 mtt180 -69.82 -40.11 76.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.449 -0.796 . . . . 10.0 109.801 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . 0.518 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 7.1 t0 -62.37 -43.26 99.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.497 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . 1.128 ' HG3' HD11 ' C' ' 469' ' ' LEU . 23.1 mmt180 -70.06 -32.03 69.92 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.547 178.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -67.18 -38.65 85.77 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.738 -0.838 . . . . 10.0 108.738 178.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . 0.518 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 82.3 mtt180 -56.74 -54.68 43.47 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 108.993 -0.743 . . . . 10.0 108.993 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -64.13 -39.82 94.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.498 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . 0.408 ' HB2' ' O ' ' A' ' 308' ' ' ARG . 0.1 OUTLIER -57.37 -54.98 40.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.89 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 31.5 t -73.68 -36.2 46.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.636 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . 0.723 ' HA ' ' HD2' ' A' ' 317' ' ' ARG . 6.0 t70 -63.55 -44.52 93.92 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.874 -0.33 . . . . 10.0 110.553 179.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -63.95 -31.97 73.35 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.492 -0.929 . . . . 10.0 108.492 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . 0.847 ' HG ' ' HE3' ' C' ' 462' ' ' LYS . 7.3 mt -69.44 -37.36 77.33 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.276 -0.874 . . . . 10.0 109.044 178.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.723 ' HD2' ' HA ' ' A' ' 314' ' ' ASP . 70.2 mtt180 -62.11 -47.2 85.69 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.997 -0.372 . . . . 10.0 109.997 178.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 1.6 m -69.16 -9.24 51.91 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.148 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -104.21 -46.57 4.39 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.642 179.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 96.4 mt -64.17 -34.51 78.23 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.42 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.71 -60.67 8.65 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-O 119.668 -0.206 . . . . 10.0 111.422 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -66.76 -31.29 39.84 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 121.632 1.554 . . . . 10.0 111.494 178.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . 0.402 ' CE1' ' HG2' ' C' ' 451' ' ' LYS . 4.6 m-30 -64.84 -42.01 95.26 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.824 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . 0.473 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 11.9 p -71.93 -38.54 69.83 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 178.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . 0.439 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 30.4 t0 -62.95 -44.27 96.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.192 0.52 . . . . 10.0 109.638 178.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -71.18 -31.23 67.39 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.42 -32.04 73.36 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.201 -0.666 . . . . 10.0 109.201 178.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' A' ' 324' ' ' SER . 80.9 mtt180 -64.62 -39.44 93.71 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.589 -0.893 . . . . 10.0 108.589 177.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -66.7 -40.43 88.47 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.956 -0.757 . . . . 10.0 108.956 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -63.83 -49.15 73.95 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.459 178.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 69.9 mt -58.81 -42.15 88.46 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.878 -0.601 . . . . 10.0 109.607 178.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -62.8 -50.42 71.07 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.591 178.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -56.28 -42.7 77.91 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.889 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . 0.451 ' HD3' ' HB3' ' C' ' 440' ' ' GLU . 35.9 mmt180 -71.34 -54.46 10.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.057 -0.52 . . . . 10.0 111.348 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . 0.547 ' O ' ' HG3' ' A' ' 339' ' ' LYS . 94.1 mt -63.22 -44.45 95.22 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.78 0.659 . . . . 10.0 112.78 -178.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -63.25 -42.24 99.15 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.543 0.211 . . . . 10.0 110.659 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.39 -38.77 91.0 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.778 -0.823 . . . . 10.0 108.778 178.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 39.5 mt -67.93 -18.85 64.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.955 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . 0.547 ' HG3' ' O ' ' A' ' 335' ' ' LEU . 82.5 mttt -75.84 -47.49 25.35 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.934 -0.765 . . . . 10.0 108.934 178.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -69.97 -50.35 42.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.545 -0.752 . . . . 10.0 109.3 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . 0.649 HD21 ' HA ' ' C' ' 433' ' ' GLU . 8.0 t-20 -61.85 -47.77 83.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.008 -0.996 . . . . 10.0 109.796 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -64.23 -41.25 98.37 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.961 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -58.46 -41.16 95.18 Favored Glycine 0 N--CA 1.45 -0.38 0 N-CA-C 111.05 -0.82 . . . . 10.0 111.05 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -70.36 -39.98 74.3 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . 0.518 ' O ' ' HB2' ' A' ' 349' ' ' TYR . 68.7 mtt180 -60.94 -44.24 97.52 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.368 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 66.6 mt -65.67 -44.0 87.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.502 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.65 -48.9 79.72 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . 0.423 ' HB3' ' NZ ' ' A' ' 352' ' ' LYS . 12.4 mt-10 -66.17 -33.24 75.33 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.399 -0.819 . . . . 10.0 110.75 179.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . 0.518 ' HB2' ' O ' ' A' ' 345' ' ' ARG . 1.3 t80 -62.94 -45.3 93.1 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.453 -0.573 . . . . 10.0 109.453 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 -69.33 -38.5 78.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.485 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.63 94.96 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.108 0.48 . . . . 10.0 110.083 178.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . 0.423 ' NZ ' ' HB3' ' A' ' 348' ' ' GLU . 14.4 mtmm -81.12 -18.36 46.74 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.117 178.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . 0.508 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -72.76 -42.29 64.16 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.259 -0.645 . . . . 10.0 109.259 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -62.39 -36.2 81.57 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.395 -0.595 . . . . 10.0 109.395 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -66.32 -34.57 78.29 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.941 -0.572 . . . . 10.0 109.465 178.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -69.1 -42.94 75.45 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.081 -1.081 . . . . 10.0 108.081 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 86.1 mt -65.15 -40.94 95.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.278 -0.873 . . . . 10.0 112.42 -179.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 1.7 p -61.74 -45.75 92.6 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.879 0.371 . . . . 10.0 110.844 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.4 p -70.97 -33.98 70.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.967 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . 0.426 HD11 H211 ' A' ' 2' ' ' PCW . 16.1 mt -66.35 -43.63 85.53 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.625 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 1.8 p -68.55 -28.87 67.35 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.101 0.477 . . . . 10.0 109.877 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -78.11 2.23 18.61 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-O 121.616 0.722 . . . . 10.0 110.034 178.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.451 ' O ' ' HB3' ' A' ' 367' ' ' ALA . 82.5 tttt -117.81 -36.83 3.55 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.401 -0.963 . . . . 10.0 108.401 177.322 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -72.1 -13.06 61.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.613 -0.722 . . . . 10.0 111.688 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.933 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 96.1 mttt -111.91 -70.1 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.552 0 C-N-CA 120.834 -0.346 . . . . 10.0 111.117 178.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.933 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 36.0 Cg_exo -60.04 -55.2 1.73 Allowed 'Trans proline' 0 C--N 1.355 0.868 0 C-N-CA 121.928 1.752 . . . . 10.0 112.302 -179.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -64.95 -41.07 95.81 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.304 0.483 . . . . 10.0 112.304 -179.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . 0.513 HD23 ' HA ' ' A' ' 368' ' ' LEU . 10.9 mt -66.01 -40.65 91.28 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.588 -0.445 . . . . 10.0 111.253 179.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -69.92 -32.34 70.59 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.886 -0.783 . . . . 10.0 108.886 178.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.78 -42.25 95.23 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.049 -1.093 . . . . 10.0 108.049 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . 0.434 HD12 HD23 ' A' ' 368' ' ' LEU . 51.6 mt -66.33 -34.4 77.9 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.154 -0.93 . . . . 10.0 109.936 178.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 368' ' ' LEU . 97.9 mtt180 -63.41 -44.87 93.4 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.05 -0.722 . . . . 10.0 109.05 178.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -73.03 -5.44 38.9 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.467 -0.788 . . . . 20.0 112.076 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -102.76 -41.15 2.36 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 109.748 -1.341 . . . . 10.0 109.748 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . 0.414 ' O ' HG12 ' A' ' 378' ' ' VAL . 89.1 mt -71.34 -37.99 71.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.463 -0.369 . . . . 10.0 111.439 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 58.5 mt -56.43 -59.64 11.49 Favored Pre-proline 0 CA--C 1.534 0.365 0 N-CA-C 112.212 0.449 . . . . 10.0 112.212 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -62.77 -35.37 68.88 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 121.84 1.693 . . . . 10.0 111.718 179.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . 0.414 HG12 ' O ' ' A' ' 375' ' ' LEU . 0.3 OUTLIER -67.16 -33.71 64.8 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 C-N-CA 120.652 -0.419 . . . . 10.0 110.643 179.646 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.73 -36.2 81.91 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . 0.433 ' O ' HG23 ' A' ' 384' ' ' VAL . 14.2 mt-10 -67.72 -44.17 78.25 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.92 -0.582 . . . . 10.0 109.74 178.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 13.7 m -62.25 -40.85 97.55 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.058 -0.719 . . . . 10.0 109.058 178.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -65.4 -43.01 91.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.247 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -57.78 -50.1 74.38 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.598 -0.274 . . . . 10.0 110.91 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 380' ' ' GLU . 81.7 t -59.07 -46.32 91.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.347 179.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 14.7 m -66.91 -40.67 87.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.914 -0.584 . . . . 10.0 111.682 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -68.44 -45.96 71.11 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.012 0.375 . . . . 10.0 112.012 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 37.4 mt -59.88 -43.29 94.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.034 0.445 . . . . 10.0 110.627 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . 0.437 ' O ' ' HB2' ' A' ' 392' ' ' GLU . 34.0 p -75.95 -16.2 60.04 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.502 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -87.0 -48.63 7.95 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.985 -0.376 . . . . 10.0 109.985 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 77.9 mt -59.9 -42.45 93.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.051 0.453 . . . . 10.0 109.834 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -64.75 -36.35 84.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.639 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . 0.628 ' O ' ' HG2' ' A' ' 396' ' ' LYS . 0.0 OUTLIER -66.88 -49.56 65.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.533 -179.831 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -55.79 -50.03 71.57 Favored 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.743 0.652 . . . . 10.0 111.643 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 5.0 m -60.92 -32.73 72.22 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.589 -0.732 . . . . 10.0 111.089 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -77.4 -11.73 59.88 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-O 120.658 0.266 . . . . 10.0 111.209 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . 0.739 ' HE3' ' HA ' ' C' ' 587' ' ' ALA . 21.5 mmtm -87.34 -38.54 16.13 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.789 -0.364 . . . . 10.0 110.669 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 8.7 mp -100.08 -107.17 0.22 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.058 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 . . . . . 0 N--CA 1.463 0.212 0 O-C-N 123.527 0.517 . . . . 10.0 111.753 -179.329 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . 0.456 ' HG ' ' HG2' ' C' ' 400' ' ' LYS . 1.4 pt? . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 121.341 0.591 . . . . 10.0 110.425 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . 0.456 ' HG2' ' HG ' ' C' ' 399' ' ' LEU . 1.4 mmmp? -104.78 15.15 28.41 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.443 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 58.7 mt -62.28 -39.82 94.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.495 -0.775 . . . . 10.0 111.664 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -62.33 -23.84 67.0 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.061 0.457 . . . . 10.0 111.073 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -79.01 -50.07 11.69 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.118 -0.697 . . . . 10.0 109.118 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -58.79 -44.72 90.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.243 -0.89 . . . . 10.0 110.394 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 25.9 m0 -64.76 -32.58 74.32 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.953 -0.567 . . . . 10.0 111.419 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -61.67 -50.27 73.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.452 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -37.51 87.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.21 0.528 . . . . 10.0 110.602 179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 74.9 t -67.99 -41.86 84.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.964 178.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 81.9 m -62.71 -48.08 80.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.795 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 2.5 p -60.86 -46.2 91.55 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.683 0.278 . . . . 10.0 111.206 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 12.1 p -66.19 -39.01 89.36 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.906 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -66.24 -40.03 89.95 Favored 'General case' 0 CA--C 1.522 -0.106 0 CA-C-N 116.552 -0.295 . . . . 10.0 110.402 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . 0.407 ' O ' ' HG3' ' C' ' 417' ' ' GLU . 30.8 m -63.15 -48.22 79.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.438 . . . . 10.0 110.012 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -66.62 -29.11 69.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.681 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 53.0 tp -67.31 -46.38 73.71 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 61.2 mtt180 -62.59 -40.49 97.07 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.669 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . 0.624 ' O ' ' HD2' ' C' ' 421' ' ' PRO . 27.6 mt-10 -61.77 -48.6 79.93 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.778 -0.646 . . . . 10.0 109.813 178.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -60.18 -42.67 95.49 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.768 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 49.0 mt -57.48 -26.77 61.76 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.612 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -56.57 -78.09 0.14 Allowed Glycine 0 CA--C 1.52 0.377 0 C-N-CA 120.957 -0.64 . . . . 10.0 111.613 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . 0.624 ' HD2' ' O ' ' C' ' 417' ' ' GLU . 12.4 Cg_endo -57.64 -33.4 96.6 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.901 2.401 . . . . 10.0 111.95 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . 0.401 HG22 ' HG2' ' A' ' 352' ' ' LYS . 21.9 t -61.72 -49.15 85.49 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 CA-C-N 116.717 -0.22 . . . . 10.0 111.004 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 19.7 m -69.78 -34.7 74.11 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 110.075 -0.342 . . . . 10.0 110.075 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -61.92 -49.99 73.94 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.221 -0.659 . . . . 10.0 109.221 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . 0.421 ' HB3' ' NZ ' ' A' ' 352' ' ' LYS . 59.4 mt-10 -63.63 -40.79 97.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.703 -0.68 . . . . 10.0 109.212 178.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -58.27 -43.07 87.8 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.937 179.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 28.5 m0 -67.87 -36.48 80.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.865 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . 0.418 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 15.1 t70 -70.53 -30.13 66.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.504 0.668 . . . . 10.0 109.429 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . 0.452 HD21 ' HA ' ' A' ' 345' ' ' ARG . 7.0 t-20 -73.46 -38.95 65.3 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.232 -1.025 . . . . 10.0 108.232 177.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . 0.447 ' HA ' ' HB2' ' C' ' 433' ' ' GLU . 42.0 mt -68.31 -24.02 64.8 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 177.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -67.01 -47.94 69.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.118 -1.438 . . . . 10.0 107.118 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . 0.418 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 49.6 mttp -65.65 -36.73 84.52 Favored 'General case' 0 C--N 1.333 -0.11 0 N-CA-C 108.576 -0.898 . . . . 10.0 108.576 178.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . 0.649 ' HA ' HD21 ' A' ' 341' ' ' ASN . 3.7 tm-20 -59.47 -57.67 11.94 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.105 -0.952 . . . . 10.0 109.454 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 33.8 m -63.48 -42.93 98.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.59 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -63.15 -41.2 99.23 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.782 0.325 . . . . 10.0 110.457 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -66.54 -48.56 61.94 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 110.013 -1.235 . . . . 10.0 110.013 178.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 14.9 mt -59.82 -33.63 72.0 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 120.499 0.19 . . . . 10.0 110.527 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 27.7 mtt180 -62.62 -38.91 92.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.464 -0.335 . . . . 10.0 110.769 179.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -67.64 -40.19 84.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.341 0.591 . . . . 10.0 109.697 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . 0.451 ' HB3' ' HD3' ' A' ' 334' ' ' ARG . 35.8 mt-10 -72.04 -50.08 31.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.301 -0.863 . . . . 10.0 110.91 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 92.1 mmm -63.49 -37.53 87.66 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.795 1.035 . . . . 10.0 113.795 -178.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 4.4 p -59.47 -45.65 91.04 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . 0.419 ' O ' ' HB2' ' C' ' 447' ' ' GLU . 80.6 mttt -70.46 -42.13 71.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.461 -0.79 . . . . 10.0 109.82 178.35 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -58.23 -48.17 81.22 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.739 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 78.2 mt -61.86 -50.11 73.54 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.678 0.251 . . . . 10.0 111.678 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -62.82 -42.94 99.93 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.822 0.344 . . . . 10.0 110.412 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . 0.594 ' O ' ' HB2' ' C' ' 451' ' ' LYS . 3.1 mt-10 -66.05 -43.13 88.4 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.31 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 2.8 p -66.76 -33.95 66.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 121.087 -0.245 . . . . 10.0 111.204 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -73.93 -43.58 57.85 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.996 0.426 . . . . 10.0 110.069 178.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -72.01 -11.8 60.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.915 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . 0.594 ' HB2' ' O ' ' C' ' 447' ' ' GLU . 0.2 OUTLIER -104.09 -30.41 10.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.975 179.399 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 5.4 p -69.76 -29.9 42.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.746 0.308 . . . . 10.0 110.567 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . 0.804 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 16.9 mt-30 -62.84 -59.6 12.1 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.198 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . 0.804 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 37.2 Cg_exo -63.58 -29.56 70.29 Favored 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 122.079 1.853 . . . . 10.0 110.952 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . 0.545 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.1 OUTLIER -69.3 -48.08 62.64 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.264 179.528 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 18.0 mt -64.77 -38.39 90.81 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 178.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -63.57 -50.24 70.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.903 -0.589 . . . . 10.0 109.816 178.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . 0.546 ' O ' ' HG3' ' C' ' 462' ' ' LYS . 19.0 t70 -62.07 -45.66 92.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.824 -0.626 . . . . 10.0 109.691 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -62.24 -41.24 98.25 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.841 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -64.09 -40.06 95.41 Favored 'General case' 0 C--O 1.225 -0.225 0 N-CA-C 109.562 -0.533 . . . . 10.0 109.562 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 43.0 mttp -61.08 -41.91 97.53 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 108.703 -0.851 . . . . 10.0 108.703 178.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . 0.847 ' HE3' ' HG ' ' A' ' 316' ' ' LEU . 35.1 mttm -66.6 -42.05 87.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.358 -0.837 . . . . 10.0 109.906 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 13.8 m0 -64.2 -35.18 79.95 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.043 178.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -67.49 -46.06 74.05 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 1.088 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 42.2 mt-10 -60.24 -44.25 95.4 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 121.191 0.52 . . . . 10.0 109.901 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -71.61 -48.09 50.31 Favored 'General case' 0 C--O 1.217 -0.652 0 CA-C-N 115.486 -0.779 . . . . 10.0 112.402 -179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 11.3 mmt -60.17 -43.94 95.43 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.802 -0.359 . . . . 10.0 110.582 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -65.33 -46.53 79.89 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.793 -0.817 . . . . 10.0 108.793 178.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 1.128 HD11 ' HG3' ' A' ' 308' ' ' ARG . 96.2 mt -59.64 -46.3 89.42 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 115.39 -0.823 . . . . 20.0 111.499 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 19.3 m-30 -63.87 -44.14 93.99 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.99 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 19.5 ttm105 -65.23 -47.06 78.15 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.621 0.248 . . . . 10.0 111.219 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -65.01 -9.2 19.96 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.274 -0.421 . . . . 10.0 112.055 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . 0.616 ' HG2' HD13 ' A' ' 301' ' ' LEU . 87.4 mttt -111.84 -43.67 3.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.648 -0.251 . . . . 10.0 111.188 179.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 42.4 t -64.95 -38.57 83.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.79 -0.186 . . . . 10.0 110.848 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -58.13 -59.7 12.47 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 120.879 -0.328 . . . . 10.0 111.311 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -65.32 -35.67 39.24 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 121.649 1.566 . . . . 10.0 111.384 178.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . 0.42 ' HB2' ' O ' ' C' ' 473' ' ' LYS . 10.2 mt -62.08 -41.95 98.7 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 109.82 -0.437 . . . . 10.0 109.82 179.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -63.16 -35.05 79.01 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . 0.606 ' O ' ' HG2' ' C' ' 483' ' ' GLU . . . -68.71 -51.33 42.74 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.767 -0.652 . . . . 10.0 109.298 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -62.93 -36.87 84.85 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.335 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 35.9 mt -66.09 -35.25 80.02 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -69.84 -36.71 75.8 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . 0.606 ' HG2' ' O ' ' C' ' 479' ' ' ALA . 61.1 mm-40 -63.57 -48.83 75.81 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 107.699 -1.223 . . . . 10.0 107.699 177.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -65.85 -33.37 85.6 Favored Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 114.999 -1.0 . . . . 10.0 111.319 178.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . 0.405 ' HB1' H281 ' A' ' 65' ' ' PCW . . . -68.63 -44.79 73.48 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 110.356 -0.239 . . . . 10.0 110.356 179.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -63.83 -39.57 94.53 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.125 -0.694 . . . . 10.0 109.125 178.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -65.33 -49.35 69.75 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.659 -0.867 . . . . 10.0 108.659 177.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -59.04 -38.99 80.62 Favored 'General case' 0 CA--C 1.522 -0.11 0 CA-C-N 115.943 -0.572 . . . . 10.0 110.613 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 39.3 mt -63.32 -44.23 95.54 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -69.61 -37.24 76.78 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.666 -0.494 . . . . 10.0 109.666 178.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -60.16 -43.84 95.48 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 177.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 58.2 mt -71.6 -37.56 70.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.569 179.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -61.6 -40.41 94.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.646 0.26 . . . . 10.0 110.305 179.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -75.66 9.59 2.19 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.081 -0.509 . . . . 10.0 111.009 178.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.719 ' HE3' ' HB3' ' A' ' 279' ' ' LEU . 56.8 mttp -123.2 -55.14 1.78 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.621 -0.718 . . . . 10.0 109.192 178.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 91.5 mt -61.23 -33.71 73.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.855 -0.612 . . . . 10.0 112.39 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . 0.452 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 13.6 m -69.8 -61.04 3.25 Favored Pre-proline 0 CA--C 1.536 0.417 0 C-N-CA 120.734 -0.387 . . . . 10.0 111.668 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . 0.452 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 37.1 Cg_endo -65.17 -48.09 3.9 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 121.708 1.606 . . . . 10.0 111.801 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . 0.633 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 12.4 mt -66.26 -34.01 77.03 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-N 116.908 -0.133 . . . . 10.0 110.983 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.87 -50.94 55.74 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.524 -0.846 . . . . 10.0 111.002 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -67.0 -34.28 77.4 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.931 0.396 . . . . 10.0 110.337 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . 0.512 ' HG2' ' HE ' ' C' ' 506' ' ' ARG . 27.7 tt0 -69.2 -46.66 66.88 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 178.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . 0.707 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 58.4 mmm -61.22 -32.26 72.03 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 178.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -64.97 -44.5 89.17 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.819 -0.808 . . . . 10.0 108.819 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . 0.505 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 1.1 t0 -68.15 -38.53 82.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.887 -0.597 . . . . 10.0 109.872 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.707 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 52.0 mtt180 -61.26 -45.28 95.18 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 107.963 -1.125 . . . . 10.0 107.963 177.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -62.25 -42.93 99.76 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.342 -0.844 . . . . 10.0 109.596 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' C' ' 512' ' ' ASP . 63.7 mtt180 -58.86 -49.44 77.74 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.596 -0.52 . . . . 10.0 109.596 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -61.41 -38.52 87.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.69 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . 0.497 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 5.7 m-70 -70.18 -51.41 31.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.778 179.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 66.7 t -65.29 -42.17 93.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.667 -179.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.531 ' HB2' ' O ' ' C' ' 508' ' ' ARG . 0.1 OUTLIER -64.62 -34.56 78.57 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.589 -0.523 . . . . 10.0 109.589 179.24 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -69.97 -39.82 75.75 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.548 -1.279 . . . . 10.0 107.548 177.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . 0.505 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 81.9 mt -64.61 -28.67 69.78 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.901 -0.591 . . . . 10.0 109.899 178.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' C' ' 512' ' ' ASP . 28.8 mtt180 -62.37 -30.93 71.54 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.568 -0.53 . . . . 10.0 109.568 178.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.13 2.23 24.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.691 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . 0.505 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 50.7 m170 -115.07 -16.4 11.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.505 -179.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 93.2 mt -111.95 -55.0 2.56 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.652 -0.249 . . . . 10.0 111.448 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -50.71 -60.19 5.94 Favored Pre-proline 0 N--CA 1.468 0.465 0 N-CA-C 113.134 0.79 . . . . 10.0 113.134 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -66.5 -29.22 44.96 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.44 1.426 . . . . 10.0 110.98 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . 0.438 ' HA ' ' OE1' ' C' ' 524' ' ' GLU . 63.9 t80 -66.19 -45.03 82.23 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.188 -0.46 . . . . 10.0 109.992 179.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . 0.465 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 11.1 p -66.83 -29.22 69.1 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.882 -0.414 . . . . 10.0 109.882 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . 0.793 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 12.7 t70 -70.76 -41.02 72.31 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 178.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . 0.438 ' OE1' ' HA ' ' C' ' 521' ' ' TYR . 72.7 mt-10 -63.22 -39.54 94.91 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 107.704 -1.221 . . . . 10.0 107.704 177.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 32.9 mt -64.0 -36.25 83.35 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.151 -0.931 . . . . 10.0 109.426 177.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . 0.793 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 78.6 mtt180 -60.59 -38.78 85.78 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -65.28 -45.37 84.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.24 0.543 . . . . 10.0 109.694 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -68.25 -41.31 81.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.443 -0.799 . . . . 10.0 110.121 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 53.3 mt -65.21 -35.08 79.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.204 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . 0.537 ' O ' ' HG2' ' C' ' 534' ' ' GLU . . . -61.36 -46.4 90.37 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.38 -39.39 89.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.821 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . 0.634 HH21 ' HB3' ' A' ' 242' ' ' GLU . 4.4 ttm180 -60.79 -39.69 89.79 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 178.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . 0.404 ' O ' ' HG3' ' C' ' 537' ' ' LYS . 71.5 mt -72.05 -33.96 68.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.575 -0.738 . . . . 10.0 109.914 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' C' ' 530' ' ' ALA . 71.1 mm-40 -59.36 -43.91 92.76 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 178.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.61 -40.88 98.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.366 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 94.9 mt -69.66 -11.37 60.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.778 -0.646 . . . . 10.0 111.171 179.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' C' ' 533' ' ' LEU . 77.9 mttt -94.18 -51.87 4.63 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.924 -0.769 . . . . 10.0 108.924 178.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -59.28 -54.75 43.28 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.585 -0.734 . . . . 10.0 110.044 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -75.83 -23.97 55.81 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.725 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.22 -54.33 24.53 Favored Glycine 0 N--CA 1.449 -0.484 0 N-CA-C 111.176 -0.769 . . . . 10.0 111.176 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.7 -34.34 89.37 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 110.988 -0.845 . . . . 10.0 110.988 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -66.28 -53.21 39.4 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 55.2 mtt85 -59.57 -34.89 73.27 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.378 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 58.7 mt -63.27 -41.09 98.99 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.142 0.496 . . . . 10.0 109.775 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -72.83 -40.84 65.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.611 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . 0.468 ' HG2' ' HG2' ' A' ' 227' ' ' GLU . 44.2 mt-10 -60.65 -50.49 73.29 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.816 -0.629 . . . . 10.0 109.544 178.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -58.92 -38.61 79.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.062 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.55 -43.17 94.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.155 179.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . 0.45 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -66.15 -49.77 66.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.753 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . 0.404 ' HD2' ' O ' ' C' ' 546' ' ' GLU . 0.0 OUTLIER -61.4 -36.64 80.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.851 179.491 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.06 -40.84 95.28 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 71.0 m -62.54 -49.17 76.39 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.944 -0.761 . . . . 10.0 108.944 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 44.3 mt-10 -60.49 -38.71 85.19 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.175 178.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -66.45 -38.37 87.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.278 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 75.2 mt -67.44 -35.69 79.73 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 178.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 16.9 m -70.01 -37.69 75.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.259 0.552 . . . . 10.0 109.796 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 3.1 p -78.55 -5.0 51.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.519 0.676 . . . . 10.0 110.156 179.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 19.7 mt -98.88 -30.42 12.39 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.25 -0.886 . . . . 10.0 109.64 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.97 -30.33 69.59 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.027 0.441 . . . . 10.0 110.117 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -71.36 -5.76 34.96 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 121.505 0.669 . . . . 10.0 110.06 178.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . 0.479 ' O ' ' HB3' ' C' ' 565' ' ' ALA . 11.3 mptt -113.12 -35.17 5.46 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.516 -0.766 . . . . 10.0 109.175 177.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -65.65 -24.91 67.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.248 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . 0.957 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 39.6 mtmt -102.89 -73.14 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.463 0 CA-C-O 119.208 -0.425 . . . . 10.0 111.969 179.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . 0.957 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 31.2 Cg_exo -58.95 -51.38 6.96 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 122.444 2.096 . . . . 10.0 113.735 -178.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . 0.479 ' HB3' ' O ' ' C' ' 561' ' ' LYS . . . -64.13 -52.28 59.85 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.617 0.228 . . . . 10.0 111.617 -179.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . 0.599 HD23 HD12 ' C' ' 569' ' ' LEU . 16.5 mt -59.88 -40.73 89.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.864 -0.153 . . . . 10.0 111.4 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . 0.536 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 22.1 mm-40 -63.06 -45.43 92.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.719 0.295 . . . . 10.0 110.709 178.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -66.67 -32.57 73.96 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.732 -0.387 . . . . 10.0 110.382 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . 0.599 HD12 HD23 ' C' ' 566' ' ' LEU . 38.1 mt -63.2 -39.09 93.63 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 177.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . 0.434 ' HA ' ' HB2' ' C' ' 573' ' ' LEU . 84.4 mtt180 -71.95 -36.92 70.02 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.154 -0.684 . . . . 10.0 109.154 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . 0.536 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.7 mt-30 -64.01 -23.38 67.31 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.218 -0.901 . . . . 20.0 111.292 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -94.91 -33.0 6.84 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 109.317 -1.513 . . . . 10.0 109.317 178.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . 0.588 ' HA ' HG12 ' C' ' 576' ' ' VAL . 13.9 mt -62.46 -41.0 98.45 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.938 0.347 . . . . 10.0 111.938 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . 0.402 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 90.0 mt -58.26 -60.12 11.2 Favored Pre-proline 0 C--N 1.327 -0.389 0 C-N-CA 121.145 -0.222 . . . . 10.0 111.543 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . 0.402 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 30.0 Cg_endo -65.08 -31.42 54.99 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 122.052 1.835 . . . . 10.0 112.155 178.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . 0.588 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.8 OUTLIER -68.13 -36.51 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 C-N-CA 120.7 -0.4 . . . . 10.0 110.251 179.145 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 34.5 mt -71.26 -35.77 71.52 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.73 -0.841 . . . . 10.0 108.73 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . 0.456 ' O ' HG23 ' C' ' 582' ' ' VAL . 68.7 mt-10 -64.8 -50.35 67.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.125 178.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 2.7 p -64.6 -42.1 95.78 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.424 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . 0.519 ' HB2' ' O ' ' C' ' 576' ' ' VAL . 0.5 OUTLIER -60.48 -42.05 95.49 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 178.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . 0.442 ' O ' ' HG ' ' C' ' 585' ' ' LEU . 66.3 mttt -65.38 -38.86 91.3 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-N 115.932 -0.577 . . . . 10.0 110.679 178.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . 0.456 HG23 ' O ' ' C' ' 578' ' ' GLU . 49.0 t -59.38 -49.56 83.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 N-CA-C 109.437 -0.579 . . . . 10.0 109.437 178.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 4.6 m -62.78 -40.12 96.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.876 178.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . 0.462 ' O ' ' HG ' ' C' ' 588' ' ' LEU . 0.8 OUTLIER -63.59 -45.63 89.54 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.958 -0.565 . . . . 10.0 111.066 179.425 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' C' ' 581' ' ' LYS . 52.7 mt -59.97 -42.3 93.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.306 -0.407 . . . . 10.0 110.272 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . 0.504 ' O ' ' HG3' ' C' ' 590' ' ' GLU . 20.8 m -67.56 -46.91 71.35 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.01 -0.737 . . . . 10.0 109.01 178.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . 0.739 ' HA ' ' HE3' ' A' ' 396' ' ' LYS . . . -55.9 -50.92 69.34 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.596 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' C' ' 584' ' ' PHE . 97.0 mt -55.41 -54.0 49.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.845 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . 0.407 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 18.4 mt-10 -65.07 -50.08 67.55 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.941 0.348 . . . . 10.0 111.941 -179.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . 0.504 ' HG3' ' O ' ' C' ' 586' ' ' SER . 35.7 mt-10 -60.38 -37.44 80.78 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -179.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -71.18 -39.85 71.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.536 0.207 . . . . 10.0 111.069 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 83.8 m -59.52 -33.81 71.84 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.963 0.411 . . . . 10.0 110.401 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 93.8 mttt -63.93 -22.36 66.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.833 -0.621 . . . . 10.0 111.583 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . 0.408 ' NZ ' ' HB2' ' A' ' 388' ' ' SER . 0.0 OUTLIER -101.67 -24.62 14.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.896 0.379 . . . . 10.0 110.699 179.093 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 81.3 mt -75.95 -31.19 58.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.326 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 . . . . . 0 C--O 1.245 0.823 0 CA-C-O 118.566 -0.731 . . . . 10.0 110.495 179.823 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 17.6 mmt . . . . . 0 C--O 1.233 0.235 0 CA-C-O 121.162 0.506 . . . . 10.0 110.597 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 2.7 m -99.1 -55.83 2.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.666 -0.697 . . . . 10.0 111.085 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -81.39 144.51 31.38 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.292 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -128.93 109.48 11.28 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.661 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 40.8 mmtt -93.41 106.07 18.07 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.356 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.536 ' HB3' HD23 ' B' ' 159' ' ' LEU . 8.7 mt -102.6 108.4 19.66 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.733 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 49.9 t -99.89 115.04 40.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.189 0.518 . . . . 10.0 110.61 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.495 HG22 HD12 ' B' ' 79' ' ' LEU . 39.3 t -87.73 112.35 23.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.594 HG21 HD11 ' B' ' 100' ' ' ILE . 17.6 m -108.95 160.16 7.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.826 0.346 . . . . 10.0 111.038 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 158.35 171.86 24.76 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.596 -0.812 . . . . 10.0 111.938 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.41 -176.82 3.31 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.156 0.503 . . . . 10.0 112.13 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -92.51 111.41 4.06 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.005 -0.617 . . . . 10.0 112.489 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 124.08 -20.28 7.16 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.905 -0.664 . . . . 10.0 111.959 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.446 HG23 ' HG3' ' B' ' 16' ' ' LYS . 24.8 m -53.38 -51.67 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 112.658 0.614 . . . . 10.0 112.658 -179.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.55 29.54 1.41 Allowed Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.461 -0.876 . . . . 10.0 113.944 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.446 ' HG3' HG23 ' B' ' 14' ' ' VAL . 49.8 mtmt -58.73 -51.21 70.92 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.258 0.551 . . . . 10.0 110.715 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.09 -44.66 91.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.325 -0.852 . . . . 10.0 111.484 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.32 -46.22 89.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.35 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 46.4 mt -62.6 -39.15 92.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.837 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 18.6 m -67.8 -45.86 73.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.791 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 67.5 mt -65.48 -31.67 54.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.173 0.511 . . . . 10.0 110.087 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.484 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 6.4 tp-100 -69.58 -20.53 63.65 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.332 179.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 6.8 tp -92.16 -46.74 7.6 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.415 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . 0.455 HD11 HD13 ' B' ' 55' ' ' ILE . 40.8 mm -75.73 -63.8 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 112.781 0.66 . . . . 10.0 112.781 -178.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -87.79 -15.86 35.73 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.025 0.38 . . . . 10.0 112.025 -178.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.484 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 64.6 t30 66.21 47.67 1.8 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.629 0.728 . . . . 10.0 110.046 -179.373 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 51.6 t60 -143.14 134.62 26.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.458 -0.792 . . . . 10.0 110.388 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -93.35 133.65 36.38 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.381 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 6.1 m -98.19 137.45 25.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.095 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -94.26 -18.15 21.95 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.359 0.599 . . . . 10.0 110.467 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -93.2 175.88 6.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.692 -0.686 . . . . 10.0 111.684 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.696 ' HA ' H5'1 ' B' ' 201' ' ' GNP . 70.5 t80 -94.95 133.99 38.1 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.872 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -101.31 95.81 5.35 Favored Pre-proline 0 C--O 1.235 0.298 0 N-CA-C 110.113 -0.328 . . . . 10.0 110.113 178.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . 0.615 ' HD3' ' O ' ' B' ' 32' ' ' TYR . 23.0 Cg_exo -66.31 103.97 0.7 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.545 2.163 . . . . 10.0 108.509 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 87.8 m -120.32 141.12 50.32 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 114.117 1.154 . . . . 10.0 114.117 -176.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.463 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 5.0 mp -113.82 -28.58 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 N-CA-C 106.583 -1.636 . . . . 10.0 106.583 176.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.434 ' HB3' HG23 ' D' ' 821' ' ' VAL . 30.1 tt0 -176.65 103.5 0.06 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 114.651 -1.159 . . . . 10.0 110.378 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . 1.034 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 52.6 m-20 -114.35 139.03 49.8 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . 0.558 ' HB2' ' HB3' ' D' ' 818' ' ' GLN . 4.0 m -116.01 131.0 57.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.91 0.385 . . . . 10.0 111.8 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . 0.401 ' HB3' HG13 ' B' ' 24' ' ' ILE . 93.2 m-85 -129.81 150.06 51.27 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.111 -0.7 . . . . 10.0 109.111 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . 0.483 ' HB2' ' NE2' ' D' ' 818' ' ' GLN . 35.4 ttp180 -165.1 136.98 4.23 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.08 -0.248 . . . . 10.0 111.436 -178.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 7.4 tttm -150.58 162.9 39.75 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.376 -0.601 . . . . 10.0 109.376 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -103.09 118.15 36.16 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.886 -0.412 . . . . 10.0 109.886 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 9.1 m -139.36 166.99 20.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-O 121.056 0.455 . . . . 10.0 111.303 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.555 ' HA ' ' HA ' ' B' ' 50' ' ' THR . 10.9 t -96.93 129.23 47.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 109.122 -0.696 . . . . 10.0 109.122 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . 0.727 HD13 HG11 ' B' ' 160' ' ' VAL . 9.6 mt -113.29 94.38 3.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.752 0.311 . . . . 10.0 111.095 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 61.56 41.17 12.74 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.521 -0.763 . . . . 10.0 111.744 178.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.56 -33.19 6.04 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.532 -0.758 . . . . 10.0 112.284 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.505 ' OE1' ' H71' ' A' ' 30' ' ' PCW . 49.2 mt-10 -91.87 111.67 23.29 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.778 0.323 . . . . 10.0 110.928 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.555 ' HA ' ' HA ' ' B' ' 45' ' ' VAL . 3.8 m -76.74 132.3 39.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.782 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 73.5 m -148.75 175.64 11.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.749 0.309 . . . . 10.0 111.368 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 22.3 tp -106.56 126.27 52.05 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.596 -0.52 . . . . 10.0 109.596 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.462 HD22 HD11 ' B' ' 6' ' ' LEU . 66.7 mt -105.76 126.82 52.61 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.5 0.556 . . . . 10.0 112.5 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -106.56 117.04 33.0 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.129 -1.063 . . . . 10.0 108.129 178.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.455 HD13 HD11 ' B' ' 24' ' ' ILE . 4.0 mp -113.5 143.53 23.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 120.598 0.237 . . . . 10.0 111.125 -178.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 12.4 tp -128.1 122.71 32.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.895 0.378 . . . . 10.0 111.823 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 1.034 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 12.6 t0 -88.51 105.95 17.96 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 107.429 -1.323 . . . . 10.0 107.429 178.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 27.1 p -80.9 164.65 22.47 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.539 0.94 . . . . 10.0 113.539 -177.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.463 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -73.22 140.0 46.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.218 179.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.68 -9.78 60.95 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.607 -0.806 . . . . 10.0 112.413 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -141.13 79.21 1.68 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.198 0.523 . . . . 20.0 110.241 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -134.62 152.83 52.06 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.057 -179.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -103.42 -154.45 0.5 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.319 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -82.79 103.0 11.95 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.3 -0.56 . . . . 10.0 111.099 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -123.14 143.07 50.24 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.708 -0.678 . . . . 10.0 109.84 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.37 -30.98 71.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.949 0.404 . . . . 10.0 110.396 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 1.1 mmt -61.42 -45.95 92.15 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.561 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.446 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 14.4 ttm180 -64.21 -43.58 94.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.545 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.444 ' O ' ' HB2' ' B' ' 73' ' ' ARG . 0.1 OUTLIER -62.4 -19.2 63.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.761 -0.654 . . . . 10.0 111.357 179.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -97.03 -45.75 6.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.298 179.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' B' ' 68' ' ' ARG 0.282 0.6 OUTLIER -69.05 -25.44 64.47 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 113.124 0.787 . . . . 10.0 113.124 -179.077 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 34.0 mtp -93.72 2.25 56.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.237 0.541 . . . . 10.0 110.134 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' B' ' 69' ' ' ASP . 10.8 ttm180 -95.54 -25.86 16.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.731 -179.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.44 -4.17 58.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.7 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -83.81 156.53 33.08 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.752 -0.737 . . . . 10.0 112.687 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -113.88 -46.49 3.02 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.188 0.518 . . . . 10.0 109.693 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . 0.426 ' HA3' HD11 ' B' ' 163' ' ' ILE . . . -111.63 137.26 14.16 Favored Glycine 0 N--CA 1.444 -0.797 0 N-CA-C 110.161 -1.176 . . . . 10.0 110.161 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -122.02 124.11 43.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.26 0.552 . . . . 10.0 112.406 -178.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.929 ' HG ' HD22 ' B' ' 159' ' ' LEU . 70.2 mt -97.18 110.27 22.85 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.472 -0.785 . . . . 10.0 109.685 179.068 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . 0.54 ' HB3' HD12 ' B' ' 93' ' ' ILE . 26.3 m -85.94 92.81 8.78 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.491 HG22 ' HB ' ' B' ' 114' ' ' VAL . 47.1 t -91.36 121.96 42.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.847 -0.615 . . . . 10.0 112.203 -178.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.736 ' HB3' HD11 ' B' ' 93' ' ' ILE . 29.7 p90 -128.33 158.95 36.8 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.419 -0.81 . . . . 10.0 109.066 178.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -100.13 126.05 46.33 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 110.088 -0.338 . . . . 10.0 110.088 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.769 HD11 ' HA ' ' B' ' 118' ' ' CYS . 32.0 pt -69.49 -9.98 12.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.394 0.616 . . . . 10.0 110.288 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . 0.415 ' HA ' ' O ' ' B' ' 122' ' ' SER . 0.0 OUTLIER -87.68 -11.83 47.18 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.095 -0.957 . . . . 10.0 110.353 179.298 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -133.08 106.86 7.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.028 -178.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.26 -31.67 70.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.698 -0.683 . . . . 10.0 112.357 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -61.42 -35.58 77.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.696 0.284 . . . . 10.0 110.493 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 15.6 m -66.5 -32.69 74.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.475 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . 0.439 ' CE1' ' HA ' ' B' ' 130' ' ' ALA . 51.5 t80 -68.64 -39.08 80.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.55 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -76.67 -25.76 54.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.259 0.552 . . . . 10.0 110.621 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -68.63 -17.64 64.15 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.841 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . 0.736 HD11 ' HB3' ' B' ' 82' ' ' PHE . 34.2 mm -57.92 -39.53 72.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.742 179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 67.0 t60 -67.5 -37.5 82.93 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.61 -0.515 . . . . 10.0 109.61 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -63.45 -36.09 82.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.577 -0.738 . . . . 10.0 110.022 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . 0.483 ' CD1' ' HB ' ' B' ' 9' ' ' VAL . 1.1 m-85 -80.01 -40.41 27.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.435 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' B' ' 97' ' ' ARG . 1.9 ttm180 -56.65 -45.25 81.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.558 -0.292 . . . . 10.0 111.177 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 63.1 mm-40 -64.35 -38.76 92.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.906 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -62.71 -42.49 99.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.0 -0.545 . . . . 10.0 109.718 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . 0.594 HD11 HG21 ' B' ' 9' ' ' VAL . 57.9 mt -66.26 -47.47 84.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.757 179.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . 0.886 ' HG2' ' HA ' ' B' ' 107' ' ' GLU . 49.6 mtpt -57.15 -41.38 79.02 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.86 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 55.4 ttp85 -68.45 -46.55 69.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.909 -0.587 . . . . 10.0 112.313 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 35.1 m -68.27 -30.78 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.177 0 N-CA-C 112.551 0.575 . . . . 10.0 112.551 -179.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -87.15 -9.34 55.51 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 121.152 -0.219 . . . . 10.0 111.14 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 5.9 t70 63.06 29.91 16.27 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 123.803 0.69 . . . . 10.0 111.25 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 53.1 m -163.48 145.08 9.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.486 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . 0.886 ' HA ' ' HG2' ' B' ' 101' ' ' LYS . 0.0 OUTLIER -90.29 -11.34 41.1 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.541 0.686 . . . . 10.0 109.271 178.574 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -91.24 72.63 6.22 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.794 -1.094 . . . . 10.0 109.532 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.455 ' HA ' ' HD3' ' B' ' 110' ' ' PRO . 58.6 t -123.09 133.43 24.51 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.361 -179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' B' ' 109' ' ' VAL . 26.8 Cg_exo -63.0 107.89 0.69 Allowed 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.819 2.346 . . . . 10.0 111.555 179.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 54.4 mtt -127.0 153.15 46.29 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.118 -0.492 . . . . 10.0 109.91 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.705 ' HB ' HD23 ' B' ' 79' ' ' LEU . 92.6 t -134.11 132.57 55.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 109.307 -0.627 . . . . 10.0 109.307 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 20.1 tp -85.89 117.94 25.06 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . 0.491 ' HB ' HG22 ' B' ' 81' ' ' VAL . 23.2 t -114.52 117.88 56.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.972 0.415 . . . . 10.0 111.496 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -101.14 110.51 3.9 Favored Glycine 0 N--CA 1.45 -0.407 0 N-CA-C 110.517 -1.033 . . . . 10.0 110.517 178.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -97.75 166.38 11.51 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.031 0.382 . . . . 10.0 112.031 -178.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 36.8 mttm 72.55 35.05 1.17 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 123.702 0.801 . . . . 10.0 112.187 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . 0.769 ' HA ' HD11 ' B' ' 84' ' ' ILE . 31.7 p -71.47 -13.36 61.79 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.064 0.394 . . . . 10.0 112.064 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -88.99 2.53 53.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.967 0.413 . . . . 10.0 111.172 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 38.0 mt -98.07 137.51 20.86 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.044 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -74.73 -14.14 21.9 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.768 2.312 . . . . 10.0 111.899 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . 0.415 ' O ' ' HA ' ' B' ' 85' ' ' ASN . 0.6 OUTLIER -79.25 37.25 0.32 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.295 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -71.21 110.43 5.86 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.378 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.58 -18.22 14.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.063 179.136 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 40.4 t -105.68 113.9 43.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 115.658 -0.701 . . . . 10.0 109.543 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -76.39 152.43 36.28 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.662 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.5 -44.05 93.19 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.768 -0.651 . . . . 10.0 112.401 -179.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 8.4 tmtm? -61.25 -40.1 92.8 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.946 0.403 . . . . 10.0 110.908 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -63.45 -44.48 94.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.683 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . 0.439 ' HA ' ' CE1' ' B' ' 90' ' ' PHE . . . -66.63 -44.93 80.68 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.236 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -62.35 -36.16 81.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.748 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.47 -47.87 80.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.778 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 18.9 tp -63.96 -41.84 97.45 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.501 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.69 -47.1 86.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.436 179.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -62.95 -34.96 78.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.977 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 14.7 m -66.55 -25.75 66.81 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.213 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 16.2 m-30 -99.69 -4.73 30.16 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.473 -0.331 . . . . 10.0 111.481 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 71.53 33.24 64.01 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 111.624 -0.59 . . . . 10.0 111.624 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 48.8 pt -123.54 147.71 53.69 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-O 120.574 0.226 . . . . 10.0 110.813 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . 0.437 ' HG2' HG22 ' B' ' 112' ' ' VAL . 59.2 Cg_endo -73.07 151.92 50.45 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.625 2.216 . . . . 10.0 111.714 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -114.2 127.16 55.77 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.766 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 34.4 mm -125.14 122.05 62.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.082 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -90.89 124.37 35.13 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.595 -0.891 . . . . 10.0 108.595 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . 0.476 ' HA ' ' O ' ' B' ' 150' ' ' GLN . 44.6 p -130.34 172.66 11.6 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 122.105 0.955 . . . . 10.0 113.373 -177.094 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . 0.431 ' HB2' ' SG ' ' B' ' 118' ' ' CYS . 6.0 t -160.99 117.08 2.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.045 -1.434 . . . . 10.0 107.341 178.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.57 -17.87 62.91 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.769 0.319 . . . . 10.0 111.244 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 70.5 tttt -84.0 -44.61 13.98 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.209 0.448 . . . . 10.0 112.209 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 36.6 p -93.8 -13.69 27.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.735 0.302 . . . . 10.0 111.317 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 18.6 ttt-85 67.49 44.98 1.64 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.078 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . 0.476 ' O ' ' HA ' ' B' ' 144' ' ' THR . 21.6 tt0 -85.33 103.24 14.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.486 -0.779 . . . . 10.0 111.592 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 58.9 37.23 90.62 Favored Glycine 0 CA--C 1.519 0.285 0 CA-C-N 115.889 -0.596 . . . . 10.0 114.306 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 70.4 t -66.25 -54.52 25.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.911 0.386 . . . . 10.0 110.711 -179.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.45 -32.38 71.28 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -58.17 -42.62 86.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.85 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.89 -48.19 82.29 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.966 0.412 . . . . 10.0 110.64 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -65.17 -43.15 92.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.808 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 16.0 m-30 -60.71 -41.89 96.15 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.419 179.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 32.8 m -58.93 -38.16 78.34 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.501 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.929 HD22 ' HG ' ' B' ' 79' ' ' LEU . 24.2 tp -62.4 -46.11 90.08 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.047 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . 0.727 HG11 HD13 ' B' ' 46' ' ' ILE . 43.2 t -64.04 -39.35 85.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.987 -0.552 . . . . 10.0 109.571 178.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -63.53 -29.96 71.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.705 -0.679 . . . . 10.0 110.683 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -77.97 -43.72 28.84 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.208 178.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . 0.426 HD11 ' HA3' ' B' ' 77' ' ' GLY . 93.2 mt -60.17 -45.32 96.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.475 179.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -59.48 -48.12 82.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.356 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -66.39 -36.13 82.07 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.966 0.412 . . . . 10.0 110.821 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -63.04 -44.19 96.58 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.524 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -71.77 -39.41 69.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.604 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -57.55 -40.75 79.58 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.259 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -59.93 -36.04 76.21 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.936 -0.574 . . . . 10.0 112.165 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 25.3 mmt -90.44 -22.96 21.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.87 0.367 . . . . 10.0 111.556 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 31.4 t -79.37 -39.04 33.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.968 -179.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -95.24 3.99 53.98 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.732 -179.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . 0.464 ' OD1' ' H81' ' A' ' 18' ' ' PCW . 27.8 t70 70.26 -56.05 0.6 Allowed 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.497 -0.774 . . . . 10.0 112.977 178.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 96.66 -75.68 0.72 Allowed Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 121.217 -0.515 . . . . 10.0 111.976 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 60.7 mmtt -114.15 100.5 8.42 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.981 -0.377 . . . . 10.0 109.981 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.68 130.3 42.44 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.646 -179.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -60.5 116.64 4.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.564 -0.744 . . . . 10.0 110.468 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -130.34 -30.48 1.92 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.253 -0.43 . . . . 10.0 111.347 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 95.7 mttt 70.0 121.99 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.43 0 O-C-N 123.684 0.615 . . . . 10.0 112.454 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 11.3 tptp -139.26 127.07 22.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.97 -179.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 23.3 m 70.41 155.36 0.14 Allowed 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 113.131 0.789 . . . . 10.0 113.131 179.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -153.12 -67.02 0.15 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.177 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 2.1 m -103.58 131.61 50.56 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.962 -0.563 . . . . 10.0 109.511 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 81.9 tttt 64.13 87.02 0.12 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.448 0.642 . . . . 10.0 111.186 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 4.9 t . . . . . 0 C--N 1.323 -0.557 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.903 -179.558 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.285 0 N-CA-C 111.503 -0.639 . . . . 10.0 111.503 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.01 136.73 52.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.737 0.303 . . . . 10.0 111.404 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 20.9 t -122.57 142.07 40.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.977 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 811' ' ' LYS . . . . . 0.656 ' HG2' HG22 ' D' ' 821' ' ' VAL . 70.1 mttt -93.92 125.78 38.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.033 0.444 . . . . 10.0 111.641 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 812' ' ' VAL . . . . . . . . . . . . . 59.4 t -99.47 118.22 45.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.082 -0.71 . . . . 10.0 109.082 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 813' ' ' TYR . . . . . 0.437 ' HB2' HG22 ' D' ' 876' ' ' ILE . 83.9 m-85 -91.84 113.79 26.16 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.173 0.511 . . . . 10.0 111.185 -179.004 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 814' ' ' LEU . . . . . 0.68 HD13 ' HD2' ' D' ' 841' ' ' ARG . 23.6 mt -81.04 150.39 68.46 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.329 -0.851 . . . . 10.0 110.94 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 815' ' ' PRO . . . . . 0.721 ' HD3' ' HB ' ' D' ' 877' ' ' VAL . 37.3 Cg_endo -65.24 -7.41 15.6 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.178 2.585 . . . . 10.0 113.295 -179.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -90.28 17.22 7.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.986 0.422 . . . . 10.0 110.618 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 817' ' ' LYS . . . . . . . . . . . . . 53.8 tttt 66.23 45.03 2.38 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 115.429 -0.805 . . . . 10.0 111.72 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 818' ' ' GLN . . . . . 0.558 ' HB3' ' HB2' ' B' ' 39' ' ' SER . 54.5 mt-30 -146.33 175.48 10.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.608 179.248 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.33 167.76 23.51 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.894 0.702 . . . . 10.0 112.894 -178.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 2.6 t -147.63 145.26 28.9 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.101 -0.954 . . . . 10.0 108.833 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 821' ' ' VAL . . . . . 0.656 HG22 ' HG2' ' D' ' 811' ' ' LYS . 21.9 t -101.1 115.25 42.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.963 0.411 . . . . 10.0 111.328 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 24.1 t -110.66 141.54 25.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.449 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 1.2 m -80.84 128.13 33.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 824' ' ' VAL . . . . . . . . . . . . . 42.5 t -66.28 127.86 28.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.735 0.302 . . . . 10.0 110.477 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 825' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' D' ' 825' ' ' ARG . 0.6 OUTLIER -118.91 127.4 53.45 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.983 0.42 . . . . 10.0 110.881 179.909 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -77.05 74.6 3.63 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.675 -0.693 . . . . 10.0 112.349 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 165.41 -40.18 0.28 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.506 -0.854 . . . . 10.0 112.769 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 828' ' ' MET . . . . . . . . . . . . . 10.5 ptm -75.22 154.85 37.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.041 0.448 . . . . 10.0 111.738 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 829' ' ' SER . . . . . 0.58 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.5 OUTLIER -98.81 169.4 9.49 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.164 -179.473 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 87.6 t -57.95 -42.92 83.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.515 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 831' ' ' TYR . . . . . 0.732 ' HB2' ' HB3' ' D' ' 863' ' ' TRP . 83.0 t80 -56.03 -34.72 66.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.828 -0.624 . . . . 10.0 111.321 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 832' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -77.27 -49.39 15.16 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.306 -0.406 . . . . 10.0 111.133 -179.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 3.4 m -63.39 -40.79 98.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.396 -0.366 . . . . 10.0 111.626 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 834' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -71.58 -24.11 61.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.536 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -63.8 -32.55 74.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.037 0.446 . . . . 10.0 110.274 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 14.0 tttm -72.47 -6.42 43.62 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.552 -0.749 . . . . 10.0 111.282 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 837' ' ' ALA . . . . . 0.439 ' HB1' HD21 ' D' ' 814' ' ' LEU . . . -117.73 -46.77 2.64 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.967 0.413 . . . . 10.0 111.49 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 838' ' ' LEU . . . . . 0.427 HD12 ' HG3' ' D' ' 845' ' ' GLN . 74.8 mt -65.73 -43.92 87.56 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.819 0.674 . . . . 10.0 112.819 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -67.75 -21.24 65.28 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.131 0.419 . . . . 10.0 112.131 -179.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 50.5 t -75.54 -23.67 16.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.042 0.449 . . . . 10.0 110.583 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 841' ' ' ARG . . . . . 0.68 ' HD2' HD13 ' D' ' 814' ' ' LEU . 5.6 mtt-85 -106.55 -6.9 17.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.628 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 85.1 40.22 8.11 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.786 -0.721 . . . . 10.0 112.633 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 843' ' ' LEU . . . . . . . . . . . . . 76.1 mt -114.68 129.04 56.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.791 0.329 . . . . 10.0 110.65 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -90.53 134.61 34.25 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.052 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 845' ' ' GLN . . . . . 0.427 ' HG3' HD12 ' D' ' 838' ' ' LEU . 14.7 mp0 -57.61 -34.25 69.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.965 -0.562 . . . . 10.0 112.096 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -72.01 -5.6 36.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.137 0.494 . . . . 10.0 111.565 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 3.6 m -126.04 25.43 6.75 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.081 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 848' ' ' CYS . . . . . . . . . . . . . 64.3 m -145.31 165.22 29.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.01 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 11.4 p -143.66 145.86 21.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.886 -0.412 . . . . 10.0 109.886 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 850' ' ' VAL . . . . . 0.45 HG22 HG22 ' D' ' 877' ' ' VAL . 60.2 t -114.43 135.75 53.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.9 0.381 . . . . 10.0 110.944 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 851' ' ' TYR . . . . . 0.725 ' HB2' HG13 ' D' ' 876' ' ' ILE . 78.4 m-85 -118.69 141.35 48.69 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.194 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 852' ' ' ARG . . . . . 0.539 ' HD3' HD11 ' D' ' 870' ' ' LEU . 34.3 mtm180 -94.08 121.9 36.04 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.136 -0.69 . . . . 10.0 109.136 178.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 853' ' ' LEU . . . . . 0.959 ' HG ' ' H41' ' A' ' 24' ' ' PCW . 1.1 tm? -84.19 113.67 21.25 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.113 -179.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 15.9 mt -111.07 72.96 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.685 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 855' ' ' LYS . . . . . . . . . . . . . 96.1 mttt 66.43 9.09 6.22 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.998 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 147.28 -42.44 0.9 Allowed Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 121.109 -0.567 . . . . 10.0 111.848 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 857' ' ' ARG . . . . . 0.792 HH12 ' H39' ' A' ' 24' ' ' PCW . 7.3 mmt180 -69.74 139.94 53.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.737 0.303 . . . . 10.0 111.27 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 858' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -108.86 120.75 43.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.366 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 6.9 m -115.31 132.0 56.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.864 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 860' ' ' VAL . . . . . 0.575 HG22 ' HE1' ' D' ' 851' ' ' TYR . 11.5 t -65.73 137.78 24.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.646 -0.252 . . . . 10.0 111.052 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 861' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -124.5 149.3 47.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.528 -0.306 . . . . 10.0 110.268 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -92.74 163.99 13.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.83 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 863' ' ' TRP . . . . . 0.732 ' HB3' ' HB2' ' D' ' 831' ' ' TYR . 88.2 m95 -80.35 -34.44 36.52 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.237 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -72.36 -10.66 60.07 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.677 0.621 . . . . 10.0 112.677 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 2.7 m -68.01 148.61 50.79 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 110.032 -0.358 . . . . 10.0 110.032 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 866' ' ' ALA . . . . . 0.58 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -80.22 152.46 29.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.506 0.193 . . . . 10.0 110.7 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 867' ' ' ILE . . . . . . . . . . . . . 6.0 tp -89.76 -4.92 10.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.241 0.543 . . . . 10.0 110.871 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -56.99 -50.99 85.03 Favored Pre-proline 0 CA--C 1.539 0.543 0 N-CA-C 113.342 0.867 . . . . 10.0 113.342 -179.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -76.61 6.02 4.37 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 121.912 1.741 . . . . 10.0 113.171 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 870' ' ' LEU . . . . . 0.539 HD11 ' HD3' ' D' ' 852' ' ' ARG . 3.4 mm? -90.75 47.03 1.37 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.218 0.532 . . . . 10.0 111.151 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 871' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -93.33 108.35 20.02 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.464 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 90.83 -0.23 76.17 Favored Glycine 0 CA--C 1.517 0.193 0 C-N-CA 121.069 -0.586 . . . . 10.0 113.617 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 873' ' ' GLU . . . . . 0.464 ' OE1' ' HD2' ' D' ' 852' ' ' ARG . 5.4 mt-10 -98.73 134.88 41.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.861 0.331 . . . . 10.0 111.286 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 874' ' ' GLU . . . . . 0.502 ' HB2' ' HB3' ' D' ' 853' ' ' LEU . 51.7 mt-10 -83.85 139.92 32.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 10.0 109.937 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 96.1 mt -114.13 118.2 33.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.109 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 876' ' ' ILE . . . . . 0.725 HG13 ' HB2' ' D' ' 851' ' ' TYR . 1.3 pt -111.69 120.36 61.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.385 179.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 877' ' ' VAL . . . . . 0.721 ' HB ' ' HD3' ' D' ' 815' ' ' PRO . 6.1 t -97.64 142.8 13.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.333 -178.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 878' ' ' GLU . . . . . 0.499 ' OE1' ' H61' ' A' ' 7' ' ' PCW . 9.8 mm-40 -125.26 160.04 30.22 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.547 178.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 879' ' ' VAL . . . . . 0.884 ' HB ' ' H72' ' A' ' 7' ' ' PCW . 80.8 t -93.79 132.46 37.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 116.258 -0.428 . . . . 10.0 109.999 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 880' ' ' LEU . . . . . 0.4 ' C ' ' H52' ' A' ' 4' ' ' PCW . 44.6 mt . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.377 -0.82 . . . . 10.0 109.589 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PCW . . . . . 0.877 H152 ' H33' ' A' ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PCW . . . . . 0.479 H361 H421 ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PCW . . . . . 0.628 H221 H182 ' A' ' 19' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PCW . . . . . 0.663 H332 H132 ' A' ' 7' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PCW . . . . . 0.699 ' H39' ' H83' ' A' ' 17' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PCW . . . . . 0.632 H272 H481 ' A' ' 24' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PCW . . . . . 0.884 ' H72' ' HB ' ' D' ' 879' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PCW . . . . . 0.565 H211 H261 ' A' ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PCW . . . . . 0.611 H451 H342 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PCW . . . . . 0.558 ' H62' ' H40' ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PCW . . . . . 0.765 H322 ' H62' ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PCW . . . . . 0.597 H411 H12A ' A' ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PCW . . . . . 0.735 H181 H162 ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PCW . . . . . 0.635 ' H42' H371 ' A' ' 23' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PCW . . . . . 0.874 ' H71' ' H2 ' ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PCW . . . . . 0.715 H152 ' H19' ' A' ' 39' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PCW . . . . . 0.699 ' H83' ' H39' ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PCW . . . . . 0.735 H162 H181 ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PCW . . . . . 0.628 H182 H221 ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PCW . . . . . 0.646 H462 H411 ' A' ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PCW . . . . . 0.676 H152 H272 ' A' ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PCW . . . . . 0.558 ' H40' ' H62' ' A' ' 10' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PCW . . . . . 0.635 H371 ' H42' ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PCW . . . . . 0.959 ' H41' ' HG ' ' D' ' 853' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PCW . . . . . 0.611 H342 H451 ' A' ' 9' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PCW . . . . . 0.721 H472 H261 ' A' ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PCW . . . . . 0.578 H411 H151 ' A' ' 27' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PCW . . . . . 0.765 ' H62' H322 ' A' ' 11' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PCW . . . . . 0.658 ' H32' ' HN1' ' A' ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PCW . . . . . 0.646 H411 H462 ' A' ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PCW . . . . . 0.544 H161 H262 ' A' ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' 17F . . . . . 0.676 H11A H11A ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' 17F . . . . . 0.853 ' H9 ' ' H63' ' A' ' 40' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' 17F . . . . . 0.676 H11A H11A ' A' ' 33' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' 17F . . . . . 0.597 H12A H411 ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' 17F . . . . . 0.709 ' H10' ' H31' ' A' ' 13' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' 17F . . . . . 0.877 ' H33' H152 ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' 17F . . . . . 0.874 ' H2 ' ' H71' ' A' ' 15' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' 17F . . . . . 0.853 ' H63' ' H9 ' ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PCW . . . . . 0.551 ' H31' H351 ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PCW . . . . . 0.619 ' H31' H151 ' A' ' 69' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PCW . . . . . 0.977 ' H82' HN1A ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PCW . . . . . 0.561 ' O11' ' H82' ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PCW . . . . . 0.674 H362 H152 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PCW . . . . . 0.622 ' H61' ' O1 ' ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PCW . . . . . 0.635 ' H61' H422 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PCW . . . . . 0.788 ' H32' ' H62' ' A' ' 57' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PCW . . . . . 0.757 ' H31' ' H4 ' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PCW . . . . . 0.676 H272 H152 ' A' ' 21' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PCW . . . . . 0.551 H351 ' H31' ' A' ' 41' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PCW . . . . . 0.645 H371 H411 ' A' ' 68' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PCW . . . . . 0.603 H131 H331 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PCW . . . . . 0.605 H441 H242 ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PCW . . . . . 0.413 H411 H381 ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PCW . . . . . 0.788 ' H62' ' H32' ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PCW . . . . . 0.701 ' H12' H431 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PCW . . . . . 0.582 ' H2 ' ' H9A' ' A' ' 77' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' PCW . . . . . 0.848 H151 H442 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PCW . . . . . 0.848 H442 H151 ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PCW . . . . . 0.744 ' H31' ' H2 ' ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PCW . . . . . 0.702 H462 H483 ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PCW . . . . . 0.605 H242 H441 ' A' ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PCW . . . . . 0.405 H281 ' HB1' ' C' ' 485' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PCW . . . . . 0.671 H451 ' H29' ' A' ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PCW . . . . . 0.747 H142 H371 ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PCW . . . . . 0.721 H261 H472 ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PCW . . . . . 0.619 H151 ' H31' ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PCW . . . . . 0.406 H321 ' O1P' ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PCW . . . . . 0.675 ' H19' ' H81' ' A' ' 71' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PCW . . . . . 0.744 ' H2 ' ' H31' ' A' ' 62' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' 17F . . . . . 0.622 ' O1 ' ' H61' ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' 17F . . . . . 0.977 HN1A ' H82' ' A' ' 43' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' 17F . . . . . 0.406 ' H2 ' ' C8 ' ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' 17F . . . . . 0.523 ' H38' ' H59' ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' 17F . . . . . 0.582 ' H9A' ' H2 ' ' A' ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' 17F . . . . . 0.757 ' H4 ' ' H31' ' A' ' 50' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' 17F . . . . . 0.671 ' H29' H451 ' A' ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' 17F . . . . . 0.605 ' H36' H461 ' A' ' 49' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 201' ' ' GNP . . . . . 0.696 H5'1 ' HA ' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 90.3 mt . . . . . 0 N--CA 1.457 -0.102 0 CA-C-O 120.982 0.42 . . . . 10.0 110.69 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -63.35 -34.26 77.32 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.562 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 88.1 mt -67.73 -37.79 82.66 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.324 179.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 66.9 mt -69.86 -40.79 75.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.786 -0.643 . . . . 10.0 111.376 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -63.12 -44.44 95.61 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.296 0.57 . . . . 10.0 109.764 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . 0.458 ' O ' HG23 ' A' ' 210' ' ' VAL . 50.1 t30 -64.65 -42.97 95.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.674 178.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -58.26 -41.81 85.1 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.43 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -61.92 -36.33 81.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.998 0.428 . . . . 10.0 110.8 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 41.6 m -72.0 -22.59 61.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.399 179.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 206' ' ' ASN . 77.0 t -80.45 -39.46 18.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 7.5 m -61.49 -44.1 97.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.133 179.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.38 -43.41 94.56 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.013 -0.54 . . . . 10.0 111.443 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.3 -44.33 91.95 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.753 0.311 . . . . 10.0 110.283 179.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -62.7 -35.2 78.96 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.909 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 9.9 m -72.65 -44.26 62.09 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.526 -0.306 . . . . 10.0 110.542 178.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -61.38 -43.8 98.25 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.724 -0.472 . . . . 10.0 109.724 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 67.8 mt -62.44 -40.74 97.56 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.619 -0.718 . . . . 10.0 110.284 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 52.0 mtm180 -66.31 -41.26 89.98 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.322 179.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.472 ' O ' ' HD2' ' A' ' 223' ' ' PRO . 19.7 mt-10 -64.35 -36.69 84.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.092 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.05 -33.99 61.8 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.653 178.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . 0.51 ' HA ' ' HB ' ' A' ' 224' ' ' VAL . 18.3 mt -60.64 -26.17 66.85 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.645 179.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -56.71 -71.68 0.7 Allowed Glycine 0 N--CA 1.452 -0.285 0 N-CA-C 110.595 -1.002 . . . . 10.0 110.595 178.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . 0.472 ' HD2' ' O ' ' A' ' 219' ' ' GLU . 11.9 Cg_endo -58.8 -30.42 92.68 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.392 2.061 . . . . 10.0 111.092 177.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . 0.51 ' HB ' ' HA ' ' A' ' 221' ' ' LEU . 5.0 t -61.56 -51.71 69.65 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.065 0 CA-C-N 116.882 -0.145 . . . . 10.0 110.791 179.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 12.6 p -67.22 -34.3 77.18 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.141 -0.318 . . . . 10.0 110.141 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -64.96 -48.47 73.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.327 178.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -64.6 -39.58 93.98 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -63.87 -48.4 76.83 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.077 178.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . 0.465 ' CE3' ' HA ' ' A' ' 229' ' ' TRP . 0.6 OUTLIER -59.59 -42.26 92.15 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.319 179.141 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -63.66 -48.88 75.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.539 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -64.22 -46.88 81.92 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.406 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 57.3 mt -61.0 -40.2 92.64 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.605 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -63.53 -44.27 94.72 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 109.685 -0.487 . . . . 10.0 109.685 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -64.43 -36.49 84.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.493 -0.321 . . . . 10.0 110.517 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -68.56 -45.44 72.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.543 178.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . 0.579 ' HA ' ' HB2' ' A' ' 239' ' ' LEU . 4.3 p -68.6 -31.07 69.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.161 179.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -59.92 -47.4 85.91 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 108.323 -0.992 . . . . 10.0 108.323 177.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -68.99 -43.86 70.65 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 110.263 -1.135 . . . . 10.0 110.263 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . 0.579 ' HB2' ' HA ' ' A' ' 236' ' ' THR . 20.8 mt -57.02 -42.57 80.63 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 115.735 -0.233 . . . . 10.0 110.845 178.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -70.69 -39.9 73.23 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.962 -0.384 . . . . 10.0 109.962 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . 0.405 HE21 ' HB3' ' A' ' 241' ' ' GLN . 6.3 tt0 -59.6 -40.8 88.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.623 179.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . 0.492 ' HB3' HH21 ' C' ' 532' ' ' ARG . 35.2 mt-10 -81.67 -30.83 32.54 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.327 -0.851 . . . . 10.0 110.236 179.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 49.7 ttm -64.6 -44.87 89.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.489 -0.323 . . . . 10.0 110.868 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 13.1 p -62.87 -45.27 93.33 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.863 -0.792 . . . . 10.0 108.863 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . 0.404 ' O ' ' HG3' ' A' ' 249' ' ' GLU . 15.1 mttm -60.43 -55.19 36.52 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.487 -0.779 . . . . 10.0 109.881 178.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -56.43 -45.96 80.51 Favored 'General case' 0 C--O 1.225 -0.222 0 O-C-N 123.652 0.595 . . . . 10.0 110.753 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 24.2 mt -60.35 -45.34 93.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.766 -0.197 . . . . 10.0 111.029 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 71.1 mt-10 -66.16 -41.8 89.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.63 0.252 . . . . 10.0 110.433 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 245' ' ' LYS . 88.2 mt-10 -64.39 -43.76 93.44 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.67 -0.493 . . . . 10.0 109.67 178.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . 0.562 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 35.5 t -65.31 -44.16 94.9 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.641 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.256 179.102 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.472 ' O ' ' HG3' ' A' ' 255' ' ' GLN . 92.3 mttt -62.49 -48.21 80.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.041 0.448 . . . . 10.0 111.062 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -63.58 -41.87 98.33 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.178 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -77.18 -28.26 53.95 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 111.676 0.25 . . . . 10.0 111.676 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.587 HG22 ' HG ' ' A' ' 258' ' ' LEU . 0.4 OUTLIER -71.43 -20.14 20.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 C-N-CA 121.186 -0.206 . . . . 10.0 110.73 179.778 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . 0.472 ' HG3' ' O ' ' A' ' 251' ' ' LYS . 22.3 mt-30 -59.36 -61.07 8.59 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.505 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -65.23 -28.62 55.72 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.515 1.477 . . . . 10.0 111.059 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . 0.44 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 7.9 m-30 -64.04 -58.25 7.25 Favored 'General case' 0 C--O 1.231 0.091 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . 0.587 ' HG ' HG22 ' A' ' 254' ' ' VAL . 80.8 mt -65.45 -37.51 87.11 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.731 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -62.47 -44.89 95.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.917 0.389 . . . . 10.0 110.192 179.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . 0.898 ' HA ' ' HE2' ' A' ' 263' ' ' LYS . 10.9 t0 -64.3 -52.21 59.63 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.077 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . 0.529 ' HZ ' ' HG ' ' C' ' 514' ' ' LEU . 18.5 m-85 -62.02 -29.05 70.02 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.81 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . 0.513 ' HB2' ' O ' ' A' ' 258' ' ' LEU . 7.1 tt0 -66.44 -49.13 67.74 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . 0.898 ' HE2' ' HA ' ' A' ' 260' ' ' ASP . 23.9 mtmt -63.05 -44.94 94.48 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.824 -0.626 . . . . 10.0 109.336 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.453 ' CE ' ' HB1' ' C' ' 509' ' ' ALA . 13.9 mptt -58.26 -50.16 74.57 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.604 -0.726 . . . . 10.0 109.724 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . 0.497 ' HB2' ' O ' ' A' ' 261' ' ' PHE . 0.0 OUTLIER -61.41 -39.35 90.44 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.618 179.714 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . 0.42 HE21 ' HB3' ' A' ' 266' ' ' GLN . 8.0 mt-30 -60.8 -47.62 85.49 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 178.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -63.88 -42.07 97.58 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . 0.456 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 35.8 mt-10 -58.99 -49.2 78.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.393 178.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 99.7 mmm -67.23 -40.08 86.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.464 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -60.7 -49.68 76.55 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 110.003 -0.369 . . . . 10.0 110.003 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 66.1 mt -64.84 -35.49 81.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.844 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . 0.702 ' HD2' HH22 ' C' ' 506' ' ' ARG . 0.3 OUTLIER -64.73 -42.52 95.17 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.206 178.978 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . 0.648 ' HA ' HG12 ' A' ' 276' ' ' VAL . 15.1 mtt85 -74.25 -38.66 63.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.84 0.352 . . . . 10.0 110.788 179.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -65.83 -26.23 67.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.367 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.796 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 93.6 mttt -95.2 -37.51 11.01 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.862 179.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . 0.648 HG12 ' HA ' ' A' ' 273' ' ' ARG . 2.2 p -62.22 -24.86 36.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 C-N-CA 121.31 -0.156 . . . . 10.0 111.355 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . 0.508 ' HB3' ' CD ' ' A' ' 278' ' ' PRO . 5.0 tp10 -62.93 -62.47 5.6 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 178.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . 0.508 ' CD ' ' HB3' ' A' ' 277' ' ' GLU . 18.5 Cg_endo -63.86 -31.54 67.54 Favored 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 121.694 1.596 . . . . 10.0 111.068 177.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.796 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 40.8 mt -65.09 -37.05 86.25 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 178.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 18.9 mtt180 -67.81 -34.88 77.61 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 178.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -67.74 -40.39 84.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.346 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 85.9 mt-10 -61.43 -47.93 83.47 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 108.89 -0.781 . . . . 10.0 108.89 178.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 48.6 mt -65.1 -38.71 91.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.335 -0.848 . . . . 10.0 110.537 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -66.57 -59.44 3.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.327 -0.397 . . . . 10.0 111.099 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -61.49 -37.85 85.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.048 0.451 . . . . 10.0 110.223 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -64.59 -49.0 66.98 Favored Glycine 0 N--CA 1.441 -0.996 0 N-CA-C 110.755 -0.938 . . . . 10.0 110.755 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.33 -35.11 79.81 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 110.249 -0.278 . . . . 10.0 110.249 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . 0.595 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 54.8 mtt180 -57.37 -45.7 84.14 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.794 -0.447 . . . . 10.0 109.794 178.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -71.04 -49.04 49.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.09 178.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -55.4 -43.2 75.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.724 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 64.0 mt -74.0 -39.28 63.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.891 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . 0.595 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 2.1 t-80 -60.99 -47.87 84.45 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 120.936 0.398 . . . . 10.0 109.936 179.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.87 -39.32 94.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.623 -0.717 . . . . 10.0 109.959 179.07 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 26.7 mt -67.37 -42.77 82.89 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.751 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -64.54 -43.73 93.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.763 0.316 . . . . 10.0 110.48 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.7 -3.94 21.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.257 0.551 . . . . 10.0 110.702 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -108.08 -34.67 6.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.484 -0.78 . . . . 10.0 109.125 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 57.7 mt -64.3 -31.34 72.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.22 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . 0.498 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 2.6 m -68.27 -62.41 3.14 Favored Pre-proline 0 CA--C 1.54 0.564 0 CA-C-N 116.602 -0.272 . . . . 10.0 111.431 179.208 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . 0.498 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 35.1 Cg_endo -65.04 -50.98 1.79 Allowed 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 121.853 1.702 . . . . 10.0 112.229 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.688 ' HB3' ' HE2' ' C' ' 473' ' ' LYS . 92.0 mt -65.85 -25.55 67.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.767 0.318 . . . . 10.0 110.87 -179.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -76.74 -48.55 8.69 Favored Glycine 0 N--CA 1.443 -0.848 0 N-CA-C 110.49 -1.044 . . . . 10.0 110.49 178.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -64.06 -42.3 97.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.394 0.14 . . . . 10.0 110.776 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . 0.44 ' O ' ' HG2' ' A' ' 308' ' ' ARG . 15.9 mt-10 -64.09 -35.59 81.26 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.977 0.418 . . . . 10.0 110.158 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 27.0 ttt -68.11 -39.41 82.81 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . 0.463 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 66.4 mtt180 -67.32 -36.74 82.08 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 178.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . 0.553 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 7.9 t0 -65.05 -44.44 89.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.841 -0.618 . . . . 10.0 109.391 178.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . 0.997 ' HG3' HD21 ' C' ' 469' ' ' LEU . 13.4 mmt180 -66.28 -37.92 86.58 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 177.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -62.85 -35.02 78.59 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 115.488 -0.778 . . . . 10.0 109.649 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . 0.553 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 77.9 mtt180 -59.85 -45.64 91.79 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.771 -0.826 . . . . 10.0 108.771 178.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -69.59 -42.45 74.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.853 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . 0.659 ' HE1' ' HB2' ' C' ' 465' ' ' GLU . 2.8 m-70 -54.39 -53.23 56.78 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.826 -0.624 . . . . 10.0 109.723 179.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 95.6 t -70.37 -41.7 78.48 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.36 0 CA-C-N 115.389 -0.823 . . . . 10.0 111.538 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -58.61 -53.89 53.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.625 0.25 . . . . 10.0 111.17 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -60.32 -33.83 72.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.265 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 8.9 mt -72.89 -40.71 65.34 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.928 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.7 ttm105 -62.7 -51.55 66.75 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.548 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 3.6 m -67.15 -13.4 61.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.237 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -96.15 -43.63 7.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.85 0.357 . . . . 10.0 110.127 178.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 57.6 mt -64.63 -33.56 76.21 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.21 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . 0.428 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -54.52 -60.96 6.39 Favored Pre-proline 0 CA--C 1.534 0.328 0 O-C-N 123.149 0.281 . . . . 10.0 111.352 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.428 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 36.6 Cg_endo -68.62 -34.84 18.4 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 121.599 1.532 . . . . 10.0 110.69 178.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . 0.477 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 4.0 m-30 -57.31 -50.05 74.17 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.227 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 8.4 p -64.69 -36.71 85.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.529 -0.305 . . . . 10.0 110.801 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . 0.602 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 1.0 OUTLIER -68.89 -39.96 79.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.139 0.495 . . . . 10.0 109.977 179.117 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . 0.418 ' O ' ' HB3' ' A' ' 329' ' ' GLN . 35.8 mt-10 -67.27 -34.4 77.35 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.032 -0.729 . . . . 10.0 109.032 177.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 63.8 mt -68.09 -33.02 73.75 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 108.708 -0.849 . . . . 10.0 108.708 177.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . 0.602 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 84.7 mtt180 -67.4 -39.31 85.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.167 -1.049 . . . . 10.0 108.167 177.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . 0.418 ' HB3' ' O ' ' A' ' 326' ' ' GLU . 5.7 tt0 -61.04 -42.15 97.93 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.895 -1.15 . . . . 10.0 107.895 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . 0.649 HH12 HG23 ' C' ' 448' ' ' VAL . 57.8 mtt180 -63.07 -53.95 45.66 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.391 -0.822 . . . . 10.0 109.08 178.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 98.3 mt -53.3 -42.74 66.94 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.851 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . 0.643 ' O ' ' HB2' ' A' ' 336' ' ' GLU . . . -60.69 -45.32 94.64 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.239 -0.437 . . . . 10.0 109.949 178.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -68.99 -46.58 67.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.37 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . 0.633 ' HD2' ' OE1' ' C' ' 440' ' ' GLU . 4.3 mmt85 -60.92 -52.73 63.8 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.505 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 339' ' ' LYS . 83.9 mt -63.15 -34.92 78.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.993 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . 0.643 ' HB2' ' O ' ' A' ' 332' ' ' ALA . 0.3 OUTLIER -64.82 -44.32 90.23 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.221 -0.659 . . . . 10.0 109.221 178.83 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.12 -39.78 94.77 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.401 -0.963 . . . . 10.0 108.401 178.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 70.2 mt -66.68 -22.55 66.08 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.971 178.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 335' ' ' LEU . 91.2 mttt -75.38 -48.13 24.37 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.017 -0.734 . . . . 10.0 109.017 178.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -68.93 -47.75 64.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.637 -0.71 . . . . 10.0 109.829 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . 0.791 HD21 ' HA ' ' C' ' 433' ' ' GLU . 47.9 t-20 -65.85 -49.76 67.0 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.627 179.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.85 -37.76 94.86 Favored Glycine 0 C--N 1.33 0.227 0 CA-C-N 115.929 -0.578 . . . . 10.0 112.445 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.38 -46.21 94.75 Favored Glycine 0 N--CA 1.449 -0.457 0 N-CA-C 110.829 -0.908 . . . . 10.0 110.829 178.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -70.3 -37.33 74.76 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . 0.665 ' HA ' HD21 ' C' ' 429' ' ' ASN . 19.0 mtt180 -57.46 -58.72 7.05 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.269 179.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . 0.563 ' O ' ' HB2' ' A' ' 350' ' ' HIS . 92.7 mt -58.3 -39.82 80.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.565 -179.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -64.9 -49.21 71.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.768 0.318 . . . . 10.0 110.323 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -64.94 -43.73 91.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.182 -0.463 . . . . 10.0 111.209 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 22.7 m-30 -63.53 -39.69 95.09 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.922 -0.399 . . . . 10.0 109.922 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . 0.563 ' HB2' ' O ' ' A' ' 346' ' ' LEU . 0.6 OUTLIER -64.92 -44.17 90.42 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.705 178.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -59.25 -44.73 92.38 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.256 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . 0.452 ' HD3' ' HA ' ' C' ' 422' ' ' VAL . 16.4 mtmm -68.33 -27.14 66.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.525 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -69.23 -43.48 73.95 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 178.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.47 -45.19 94.62 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -63.36 -38.46 91.25 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.888 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . 0.425 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 5.2 m-70 -66.91 -35.61 80.39 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.142 178.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 78.4 mt -71.21 -39.87 71.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.192 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 68.7 m -62.78 -44.55 95.89 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 178.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 4.4 p -76.16 -16.57 59.84 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.417 179.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 356' ' ' HIS . 0.5 OUTLIER -76.18 -35.41 59.15 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 107.488 -1.301 . . . . 10.0 107.488 177.411 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 29.1 m -67.71 -25.32 65.6 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -72.36 -2.4 19.12 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.21 -0.904 . . . . 10.0 109.923 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.416 ' O ' ' HB3' ' A' ' 367' ' ' ALA . 31.2 mttp -123.16 -42.31 2.27 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 178.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -63.28 -22.25 66.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.535 -0.757 . . . . 10.0 111.429 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.899 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 96.6 mttt -102.12 -67.91 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.454 0 C-N-CA 120.819 -0.352 . . . . 10.0 111.544 179.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.899 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 21.9 Cg_exo -65.52 -55.36 0.45 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 122.268 1.979 . . . . 10.0 113.316 -178.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 363' ' ' LYS . . . -60.89 -38.85 87.11 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.285 0.476 . . . . 10.0 112.285 -179.075 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 368' ' ' LEU . 3.0 mt -67.03 -42.25 85.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.776 0.322 . . . . 10.0 110.478 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . 1.059 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 2.7 mt-10 -69.19 -29.85 67.92 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.746 -0.464 . . . . 10.0 109.746 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -69.98 -44.42 69.47 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 178.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.72 -46.85 88.8 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.385 -0.825 . . . . 10.0 109.634 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 52.5 mtt85 -65.62 -36.69 84.44 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 1.059 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 98.7 mt-30 -63.08 -30.52 71.66 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.546 -0.752 . . . . 20.0 111.297 179.237 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -86.44 -36.09 9.99 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 109.149 -1.58 . . . . 10.0 109.149 178.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 17.6 mt -58.09 -40.31 80.82 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.011 0.374 . . . . 10.0 112.011 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 83.4 mt -55.4 -62.92 3.63 Favored Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 112.069 0.396 . . . . 10.0 112.069 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -63.19 -32.49 73.98 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 121.969 1.78 . . . . 10.0 111.564 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 6.5 t -63.45 -44.79 99.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 N-CA-C 109.916 -0.401 . . . . 10.0 109.916 178.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 33.7 mt -60.92 -35.63 77.19 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.438 -0.578 . . . . 10.0 109.438 178.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -62.86 -52.03 64.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.874 178.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.2 -38.11 85.38 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.611 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -67.97 -43.12 79.73 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.707 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -62.0 -48.42 80.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.486 -0.325 . . . . 10.0 110.538 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 75.8 t -57.51 -42.77 81.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.467 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 5.3 p -74.82 -55.03 6.24 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.174 0.435 . . . . 10.0 112.174 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -60.53 -44.53 95.97 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.311 0.856 . . . . 10.0 113.311 -178.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.484 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 56.8 mt -61.29 -41.98 97.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.689 0.281 . . . . 10.0 111.335 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 93.5 p -79.12 -26.12 42.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.329 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -65.92 -39.99 91.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 95.4 mt -61.85 -35.14 77.4 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.945 -0.571 . . . . 10.0 109.953 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 37.9 mt-10 -68.1 -42.4 80.37 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.55 -0.907 . . . . 10.0 108.55 178.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . 0.601 ' HA ' ' HD2' ' A' ' 395' ' ' LYS . 0.4 OUTLIER -61.7 -40.37 94.78 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.545 -0.752 . . . . 10.0 111.085 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -63.63 -51.82 63.54 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.493 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 4.8 m -58.63 -30.58 67.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.725 -0.671 . . . . 10.0 111.452 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . 0.601 ' HD2' ' HA ' ' A' ' 392' ' ' GLU . 93.1 mttt -58.66 -37.47 76.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.601 -0.272 . . . . 10.0 111.684 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -90.13 -24.05 21.19 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.071 0.397 . . . . 10.0 112.071 -179.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 93.7 mt -71.74 -74.47 0.15 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.814 0.34 . . . . 10.0 110.915 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 . . . . . 0 C--N 1.326 -0.44 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.392 -179.447 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 6.6 tt . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.819 0.342 . . . . 10.0 110.147 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 62.2 mttt -75.09 -43.71 51.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.649 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 55.9 mt -62.34 -28.16 69.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.185 0.517 . . . . 10.0 111.515 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.12 -37.99 84.83 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.011 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.87 -38.83 61.82 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.387 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . 0.453 ' O ' HG23 ' C' ' 408' ' ' VAL . 14.7 t-20 -57.56 -41.63 81.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.318 -0.856 . . . . 10.0 109.013 178.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -64.67 -33.99 77.23 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 115.415 -0.811 . . . . 10.0 111.847 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.68 -50.06 75.3 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.893 0.378 . . . . 10.0 110.21 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 1.2 m -63.79 -34.79 78.7 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.579 -0.526 . . . . 10.0 109.579 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . 0.453 HG23 ' O ' ' C' ' 404' ' ' ASN . 50.6 t -64.82 -41.38 92.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.003 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 2.8 m -61.05 -46.55 90.23 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 42.3 m -60.55 -38.33 84.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.86 178.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 91.5 m -63.15 -44.99 93.99 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.093 -0.503 . . . . 10.0 109.889 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . 0.453 ' O ' ' HG3' ' C' ' 416' ' ' ARG . 4.0 m-85 -64.72 -41.41 96.0 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.389 178.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 15.0 m -62.84 -44.34 96.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.019 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -66.88 -26.72 67.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.231 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 30.5 mt -70.86 -38.05 73.12 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 178.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' C' ' 412' ' ' PHE . 86.9 mtt180 -66.96 -40.11 87.41 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 108.751 -0.833 . . . . 10.0 108.751 178.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -65.16 -23.52 67.14 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 115.421 -0.809 . . . . 10.0 110.379 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -82.57 -48.25 11.2 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.57 -0.9 . . . . 10.0 108.57 177.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 84.6 mt -52.88 -35.05 57.33 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.203 -0.908 . . . . 10.0 112.151 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' C' ' 424' ' ' GLN . . . -52.94 -77.67 0.13 Allowed Glycine 0 CA--C 1.52 0.352 0 N-CA-C 111.84 -0.504 . . . . 10.0 111.84 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -56.94 -32.6 93.16 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.807 2.338 . . . . 10.0 111.742 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . 0.452 ' HA ' ' HD3' ' A' ' 352' ' ' LYS . 5.6 t -60.0 -50.21 81.02 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.226 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.925 179.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 21.4 p -70.78 -36.43 73.04 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.499 0.19 . . . . 10.0 110.901 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' C' ' 420' ' ' GLY . 29.8 mt-30 -57.82 -48.78 78.74 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.566 -0.531 . . . . 10.0 109.566 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . 0.422 ' OE1' ' HG3' ' A' ' 352' ' ' LYS . 97.2 mt-10 -76.33 -29.73 57.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.669 -0.696 . . . . 10.0 110.543 179.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . 0.44 ' HB2' ' O ' ' C' ' 422' ' ' VAL . 32.7 t80 -66.3 -46.99 75.05 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.824 0.345 . . . . 10.0 110.14 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . 0.531 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 47.3 m0 -64.86 -37.5 87.82 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 179.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.39 -34.19 75.6 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.574 178.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . 0.665 HD21 ' HA ' ' A' ' 345' ' ' ARG . 20.0 t-20 -68.95 -39.35 79.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.761 -1.2 . . . . 10.0 107.761 177.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . 0.65 ' HA ' ' HB2' ' C' ' 433' ' ' GLU . 69.1 mt -66.33 -25.9 67.05 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.251 -0.886 . . . . 10.0 110.287 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 35.5 mm-40 -63.0 -53.33 55.61 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.874 -0.787 . . . . 10.0 108.874 178.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -66.87 -31.52 72.17 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . 0.791 ' HA ' HD21 ' A' ' 341' ' ' ASN . 0.8 OUTLIER -64.0 -53.81 44.16 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.56 -0.745 . . . . 10.0 110.614 179.148 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 9.5 p -69.87 -40.27 75.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.855 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -67.0 -44.54 80.1 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.639 0.257 . . . . 10.0 110.726 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -61.8 -48.6 82.93 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 110.117 -1.193 . . . . 10.0 110.117 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 16.9 mt -61.16 -34.51 75.15 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 110.017 -0.364 . . . . 10.0 110.017 178.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 20.9 mtt85 -65.97 -43.28 88.31 Favored 'General case' 0 C--O 1.22 -0.454 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 178.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . 0.487 ' O ' ' HE2' ' C' ' 443' ' ' LYS . 28.8 mt-30 -62.92 -33.82 76.13 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-O 121.328 0.585 . . . . 10.0 109.678 178.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . 0.633 ' OE1' ' HD2' ' A' ' 334' ' ' ARG . 52.4 mt-10 -74.43 -59.6 2.65 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.09 178.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 75.1 mtm -62.36 -27.9 69.39 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 114.538 1.31 . . . . 10.0 114.538 -177.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 25.4 p -57.52 -59.07 5.72 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.259 0.552 . . . . 10.0 110.144 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . 0.487 ' HE2' ' O ' ' C' ' 439' ' ' GLN . 21.6 pttt -74.04 -31.27 62.82 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.334 179.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . 0.579 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 0.4 OUTLIER -61.38 -43.28 99.13 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.286 -0.415 . . . . 10.0 110.577 179.759 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . 0.441 ' HA ' ' HB ' ' C' ' 448' ' ' VAL . 81.2 mt -76.46 -42.23 44.5 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.418 -0.355 . . . . 10.0 111.311 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -62.62 -40.6 97.47 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.095 0.474 . . . . 10.0 110.055 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.11 -30.43 62.32 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.961 -0.755 . . . . 10.0 108.961 178.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . 0.649 HG23 HH12 ' A' ' 330' ' ' ARG . 1.2 t -57.83 -43.89 85.16 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 CA-C-N 116.068 -0.514 . . . . 10.0 109.819 178.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -67.35 -40.51 85.85 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -69.69 -10.19 57.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.099 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . 0.603 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 0.0 OUTLIER -104.62 -39.72 6.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.15 179.14 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 50.4 t -70.13 -36.4 67.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.797 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -55.08 -61.5 5.8 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 116.778 -0.192 . . . . 10.0 111.429 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.51 -26.37 40.42 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 121.823 1.682 . . . . 10.0 111.502 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . 0.603 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 0.1 OUTLIER -69.33 -47.93 62.93 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.796 -0.446 . . . . 10.0 109.796 179.342 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' C' ' 456' ' ' LEU . 17.5 mt -67.42 -32.22 72.96 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.29 -0.633 . . . . 10.0 109.29 178.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -67.11 -47.88 69.82 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.114 -0.699 . . . . 10.0 109.114 178.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . 0.584 ' HA ' ' HE2' ' C' ' 461' ' ' LYS . 41.3 t0 -66.81 -41.11 88.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.962 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -64.9 -40.09 94.54 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.931 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -62.94 -43.51 98.6 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 109.925 -0.398 . . . . 10.0 109.925 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . 0.584 ' HE2' ' HA ' ' C' ' 458' ' ' ASP . 27.5 mtmt -63.13 -46.39 87.47 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 15.5 mtmm -64.65 -36.97 85.98 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.221 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 36.1 t90 -66.33 -37.23 84.87 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.899 -0.778 . . . . 10.0 108.899 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -64.68 -45.17 87.8 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.536 -0.912 . . . . 10.0 108.536 177.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 0.804 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 45.6 mt-10 -61.2 -42.76 99.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.653 178.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . 0.861 ' OE1' HD12 ' C' ' 469' ' ' LEU . 0.4 OUTLIER -67.19 -39.51 86.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.968 -0.56 . . . . 10.0 109.877 178.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.11 -43.46 98.36 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 108.989 -0.745 . . . . 10.0 108.989 178.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -63.71 -45.11 91.47 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.133 -1.062 . . . . 10.0 108.133 177.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 0.997 HD21 ' HG3' ' A' ' 308' ' ' ARG . 96.5 mt -56.09 -45.11 79.53 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 115.35 -0.841 . . . . 20.0 109.782 177.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 15.4 m-30 -64.89 -41.82 95.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.521 179.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 59.6 mtt180 -66.57 -44.67 81.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.977 0.418 . . . . 10.0 111.174 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -78.0 -2.94 39.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.043 -0.526 . . . . 10.0 112.188 -179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . 0.688 ' HE2' ' HB3' ' A' ' 301' ' ' LEU . 62.5 mttt -116.08 -63.2 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.518 0.199 . . . . 10.0 111.29 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 66.1 t -57.54 -43.23 82.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.292 0.849 . . . . 10.0 113.292 -178.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.26 -59.74 12.84 Favored Pre-proline 0 CA--C 1.533 0.308 0 N-CA-C 112.34 0.496 . . . . 10.0 112.34 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -65.38 -29.99 53.69 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 121.835 1.69 . . . . 10.0 111.264 178.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 12.5 mt -67.44 -40.75 85.46 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . 0.553 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 67.3 ttt180 -63.48 -34.78 78.53 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 109.222 -0.658 . . . . 10.0 109.222 178.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -68.49 -47.29 67.42 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.22 -45.17 94.53 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.857 -0.611 . . . . 10.0 109.589 178.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 62.9 mt -67.39 -33.08 74.46 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.633 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . 0.553 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 5.7 tt0 -66.25 -47.12 74.79 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 178.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . 0.444 ' O ' ' HG3' ' C' ' 487' ' ' GLN . 42.1 mm-40 -66.67 -41.91 87.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.615 178.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.22 -39.24 97.67 Favored Glycine 0 N--CA 1.447 -0.586 0 N-CA-C 110.842 -0.903 . . . . 10.0 110.842 178.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.04 -36.74 78.04 Favored 'General case' 0 C--O 1.219 -0.507 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 178.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 64.3 mtt180 -64.52 -39.67 94.21 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.34 -0.615 . . . . 10.0 109.34 178.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' C' ' 483' ' ' GLU . 45.7 mt-30 -67.67 -43.85 79.25 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' C' ' 491' ' ' GLU . 78.9 tttt -65.64 -31.87 73.13 Favored 'General case' 0 C--O 1.226 -0.149 0 CA-C-N 115.725 -0.67 . . . . 10.0 109.599 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 21.1 mt -66.66 -41.32 88.39 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 108.626 -0.879 . . . . 10.0 108.626 177.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . 0.522 ' HA ' ' OE1' ' C' ' 493' ' ' GLN . 17.1 m-70 -64.12 -39.48 94.12 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 108.298 -1.001 . . . . 10.0 108.298 178.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . 0.558 ' HB3' ' HE2' ' C' ' 495' ' ' LYS . 39.9 mt-10 -60.9 -53.6 55.32 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.248 -1.019 . . . . 10.0 108.248 177.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 82.3 mt -57.81 -38.4 75.47 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 115.358 -0.837 . . . . 10.0 111.466 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . 0.522 ' OE1' ' HA ' ' C' ' 490' ' ' HIS . 69.2 mt-30 -61.07 -37.53 83.01 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.886 0.374 . . . . 10.0 110.298 179.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -81.56 -17.06 49.68 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.603 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.611 ' HG2' HD22 ' A' ' 279' ' ' LEU . 10.5 mtmm -103.64 6.37 37.06 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.685 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 32.6 mt -124.93 -44.08 1.95 Allowed 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 112.093 0.405 . . . . 10.0 112.093 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . 0.803 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 10.3 m -66.93 -62.32 3.92 Favored Pre-proline 0 CA--C 1.539 0.534 0 N-CA-C 112.215 0.45 . . . . 10.0 112.215 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . 0.803 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 21.8 Cg_exo -67.18 -21.36 48.57 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 122.158 1.905 . . . . 10.0 111.89 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' C' ' 499' ' ' LEU . 12.6 mt -87.1 -41.75 13.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.939 179.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.49 -45.09 94.15 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 111.446 -0.662 . . . . 10.0 111.446 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -64.48 -32.56 74.24 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 121.239 0.543 . . . . 10.0 109.846 178.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . 0.458 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 38.6 tt0 -73.02 -40.24 65.34 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.443 178.253 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . 0.59 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 87.2 mmm -60.46 -34.69 74.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 10.0 109.652 178.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -70.76 -34.3 71.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.1 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -71.38 -36.81 71.55 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.025 -1.102 . . . . 10.0 108.025 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.702 HH22 ' HD2' ' A' ' 272' ' ' TYR . 54.8 mtt180 -62.53 -38.38 89.75 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 107.836 -1.172 . . . . 10.0 107.836 177.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -64.05 -35.48 80.88 Favored 'General case' 0 C--O 1.226 -0.138 0 CA-C-N 115.65 -0.704 . . . . 10.0 109.994 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . 0.513 ' O ' ' HB3' ' C' ' 512' ' ' ASP . 75.2 mtt180 -64.16 -32.8 74.51 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.715 -0.846 . . . . 10.0 108.715 178.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . 0.453 ' HB1' ' CE ' ' A' ' 264' ' ' LYS . . . -96.57 13.12 29.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.118 -0.946 . . . . 10.0 110.909 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -128.74 -67.56 0.79 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.29 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 47.7 t -69.01 -49.76 59.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.626 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.582 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 12.0 t70 -66.75 -34.18 77.26 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.919 0.39 . . . . 10.0 110.36 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -68.31 -39.31 82.04 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.116 -1.068 . . . . 10.0 108.116 177.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . 0.529 ' HG ' ' HZ ' ' A' ' 261' ' ' PHE . 11.3 mt -67.48 -24.69 65.62 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.452 -0.794 . . . . 10.0 110.366 178.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . 0.582 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 89.8 mtt180 -58.75 -51.59 69.3 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.05 -0.722 . . . . 10.0 109.05 178.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.3 9.87 4.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.417 0.627 . . . . 10.0 110.901 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . 0.497 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 49.7 m170 -113.89 -39.16 4.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.146 -0.479 . . . . 10.0 109.874 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 95.0 mt -89.39 -30.75 18.13 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.582 -0.736 . . . . 10.0 111.714 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . 0.427 ' N ' ' HD2' ' C' ' 520' ' ' PRO . . . -58.11 -54.63 53.68 Favored Pre-proline 0 CA--C 1.531 0.222 0 C-N-CA 121.235 -0.186 . . . . 10.0 110.739 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . 0.427 ' HD2' ' N ' ' C' ' 519' ' ' ALA . 33.3 Cg_endo -67.47 -32.03 32.75 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 121.31 1.34 . . . . 10.0 110.048 177.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -62.8 -46.08 89.63 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.933 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . 0.409 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 3.8 p -68.33 -33.52 74.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.015 0.436 . . . . 10.0 110.084 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -66.18 -45.5 80.63 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 178.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -65.84 -36.4 83.35 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 178.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 19.0 mt -60.81 -39.39 88.79 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.405 178.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' C' ' 522' ' ' SER . 54.7 mtt85 -63.54 -38.46 91.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.179 178.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -62.78 -46.7 86.81 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.449 -0.945 . . . . 10.0 108.449 178.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 48.2 mtt180 -63.16 -41.89 99.34 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 114.896 -1.047 . . . . 10.0 109.77 178.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 76.7 mt -65.24 -41.69 94.09 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.456 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -59.26 -49.63 77.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.227 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -61.7 -47.92 83.13 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.723 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . 0.492 HH21 ' HB3' ' A' ' 242' ' ' GLU . 1.5 mtt180 -64.6 -42.19 95.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.484 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 26.3 mt -64.36 -43.11 95.58 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 120.64 0.257 . . . . 10.0 110.34 179.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -63.42 -40.32 96.87 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.949 -0.389 . . . . 10.0 109.949 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.17 -41.21 99.19 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.955 -0.757 . . . . 10.0 108.955 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 96.1 mt -69.97 -19.63 63.35 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.681 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -87.46 -41.0 13.85 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 178.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.99 -51.64 52.52 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.722 -0.844 . . . . 10.0 108.722 178.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -70.66 -34.06 71.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.393 -0.821 . . . . 10.0 108.822 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.18 -45.66 85.22 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.956 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.02 -41.11 99.65 Favored Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 110.237 -1.145 . . . . 10.0 110.237 178.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.45 92.58 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 109.327 -0.62 . . . . 10.0 109.327 178.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 74.4 mtt180 -64.72 -38.52 91.27 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.952 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 85.9 mt -61.12 -41.7 97.18 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.555 -0.535 . . . . 10.0 109.555 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -68.34 -43.36 77.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.419 178.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -61.0 -47.53 86.04 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.052 179.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 15.7 m-30 -61.28 -43.56 98.67 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.399 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -59.67 -46.82 87.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.508 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -63.01 -54.86 31.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.564 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -58.63 -39.62 81.01 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.973 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.18 -41.4 90.34 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 116.491 -0.322 . . . . 10.0 110.466 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 47.2 m -62.39 -45.29 93.82 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -64.21 -29.7 70.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.317 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -79.48 -46.68 16.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.33 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 56.2 mt -60.04 -40.7 90.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.52 -0.309 . . . . 10.0 111.144 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 4.8 p -65.6 -47.79 74.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.867 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 12.3 p -68.83 -32.21 71.74 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.881 -0.328 . . . . 10.0 110.808 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 25.4 mt -63.84 -44.87 91.88 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.576 -0.527 . . . . 10.0 109.576 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . 0.475 ' O ' ' HG3' ' C' ' 563' ' ' LYS . 2.4 p -71.84 -34.82 69.6 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.777 -0.453 . . . . 10.0 109.777 178.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 74.4 mt-10 -63.74 -24.16 67.66 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.686 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 48.1 mttp -97.91 -31.39 12.21 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.141 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -63.84 -39.01 93.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.696 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . 0.475 ' HG3' ' O ' ' C' ' 559' ' ' SER . 91.8 mttt -56.03 -61.86 5.72 Favored Pre-proline 0 CA--C 1.534 0.327 0 CA-C-N 116.42 -0.354 . . . . 10.0 111.44 179.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . 0.467 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 30.7 Cg_endo -65.65 -35.48 37.28 Favored 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 121.822 1.681 . . . . 10.0 111.736 179.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.8 82.69 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 121.145 -0.222 . . . . 10.0 110.814 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 57.3 mt -64.82 -41.61 95.63 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.204 -0.295 . . . . 10.0 110.204 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . 0.958 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 88.1 mt-10 -64.17 -44.14 92.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.662 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -67.88 -41.1 83.34 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.374 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 33.5 mt -58.79 -49.46 77.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.238 -0.437 . . . . 10.0 109.826 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . 0.427 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 59.2 mtt180 -65.85 -38.89 90.06 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.731 -0.47 . . . . 10.0 109.731 178.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . 0.958 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 98.5 mt-30 -61.51 -40.21 93.8 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.665 -0.698 . . . . 20.0 111.974 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -78.44 -37.31 27.89 Favored Glycine 0 CA--C 1.521 0.445 0 N-CA-C 109.927 -1.269 . . . . 10.0 109.927 179.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 18.8 mt -54.87 -37.21 65.99 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 112.021 0.378 . . . . 10.0 112.021 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . 0.551 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 53.4 mt -56.27 -66.02 1.32 Allowed Pre-proline 0 CA--C 1.538 0.484 0 N-CA-C 112.419 0.526 . . . . 10.0 112.419 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . 0.551 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 43.1 Cg_endo -68.72 -32.82 22.75 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 121.578 1.519 . . . . 10.0 112.11 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 15.4 t -65.27 -49.18 80.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.751 -0.204 . . . . 10.0 111.034 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 46.1 mt -65.2 -36.87 85.53 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 110.14 -0.319 . . . . 10.0 110.14 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . 0.523 ' O ' HG23 ' C' ' 582' ' ' VAL . 55.0 mm-40 -66.24 -46.37 77.38 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 110.091 -0.337 . . . . 10.0 110.091 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 44.0 m -62.15 -43.12 99.54 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.968 0.414 . . . . 10.0 109.986 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . 0.42 ' HD1' ' HA ' ' C' ' 580' ' ' PHE . 5.3 m-30 -65.51 -37.37 86.58 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.903 -0.59 . . . . 10.0 109.564 178.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -60.82 -41.21 95.26 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . 0.523 HG23 ' O ' ' C' ' 578' ' ' GLU . 95.2 t -61.65 -39.9 84.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.115 -0.698 . . . . 10.0 109.115 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 13.4 m -68.92 -36.94 78.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.238 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -70.32 -43.2 70.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.733 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 98.6 mt -61.55 -45.94 92.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.12 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 2.9 p -65.63 -40.94 93.09 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.69 -0.485 . . . . 10.0 109.69 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -60.46 -53.11 61.49 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 115.76 -0.655 . . . . 10.0 110.632 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.3 mt -56.09 -45.13 79.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.868 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -68.91 -39.63 79.57 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.665 0.617 . . . . 10.0 112.665 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -70.93 -41.1 71.61 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.993 0.425 . . . . 10.0 110.814 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . 0.438 ' HE1' ' HB3' ' A' ' 392' ' ' GLU . 22.3 m-30 -64.52 -39.66 94.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.759 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.38 -25.9 67.77 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.947 0.351 . . . . 10.0 111.947 -179.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -72.95 -39.21 66.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.12 0.486 . . . . 10.0 110.191 179.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -77.03 -26.48 53.74 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.872 -0.604 . . . . 10.0 110.634 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 83.4 mt -95.82 46.8 1.09 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.05 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.428 -0.796 . . . . 10.0 109.665 -179.968 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.3 ptt? . . . . . 0 C--O 1.23 0.053 0 CA-C-O 120.976 0.417 . . . . 10.0 110.503 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 7.1 t -142.98 22.38 1.92 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.716 0.769 . . . . 10.0 110.295 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -108.87 137.53 46.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.341 -0.845 . . . . 10.0 109.639 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -125.84 157.33 37.87 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.809 0.338 . . . . 10.0 111.386 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 mmtm -114.77 112.57 23.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.707 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.635 HD22 HD23 ' B' ' 159' ' ' LEU . 25.8 mt -108.65 117.28 33.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.971 0.415 . . . . 10.0 110.841 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 39.8 t -107.42 119.34 56.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.131 0.491 . . . . 10.0 110.724 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 21.6 t -90.63 121.1 40.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.545 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 18.3 m -114.91 165.27 10.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.917 0.389 . . . . 10.0 110.952 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 144.92 163.82 10.28 Favored Glycine 0 N--CA 1.445 -0.7 0 N-CA-C 110.8 -0.92 . . . . 10.0 110.8 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.53 176.1 7.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.293 0.568 . . . . 10.0 111.893 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.64 123.61 6.16 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.915 -0.659 . . . . 10.0 111.963 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 121.23 -20.06 8.54 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.627 -0.797 . . . . 10.0 112.12 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 34.2 m -65.2 -36.43 77.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.795 0.331 . . . . 10.0 111.58 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 104.7 39.26 2.39 Favored Glycine 0 CA--C 1.518 0.257 0 C-N-CA 120.598 -0.811 . . . . 10.0 113.596 179.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -59.73 -51.98 67.45 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.943 0.401 . . . . 10.0 111.267 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -60.04 -36.3 76.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.895 -0.593 . . . . 10.0 111.895 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.92 -50.99 68.65 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.691 0.282 . . . . 10.0 110.745 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 72.0 mt -59.72 -36.83 77.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.456 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . 0.495 HG23 HG21 ' B' ' 55' ' ' ILE . 29.2 m -68.79 -51.05 45.13 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.291 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 97.6 mt -63.11 -32.0 54.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-O 120.816 0.341 . . . . 10.0 110.977 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.454 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 38.0 tp60 -64.45 -30.34 71.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.533 179.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 23.8 tp -85.35 -30.71 23.46 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.114 0.483 . . . . 10.0 110.474 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 43.2 mm -73.13 -59.36 3.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.954 -0.567 . . . . 10.0 112.086 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -125.1 4.92 7.9 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 113.179 0.807 . . . . 10.0 113.179 -178.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.454 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 54.6 t30 58.27 51.43 8.45 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.293 0.568 . . . . 10.0 111.198 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 40.6 t60 -129.39 120.9 26.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.839 -0.618 . . . . 10.0 110.089 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -84.29 118.26 24.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.414 -0.357 . . . . 10.0 110.64 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 10.1 m -77.39 141.57 15.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.541 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -105.74 -24.02 12.6 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.258 0.551 . . . . 10.0 109.948 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 3.4 pm0 -86.43 140.36 30.06 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.28 -0.873 . . . . 10.0 111.054 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.541 ' HA ' H5'2 ' B' ' 201' ' ' GNP . 48.2 t80 -85.49 68.73 10.54 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.395 0.617 . . . . 10.0 109.814 178.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . 0.517 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 0.7 OUTLIER -71.3 138.02 84.12 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.724 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . 0.517 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 13.4 Cg_exo -72.25 -178.37 3.22 Favored 'Trans proline' 0 N--CA 1.463 -0.303 0 C-N-CA 123.158 2.572 . . . . 10.0 111.706 179.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.2 m -166.71 137.39 3.26 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.443 -0.344 . . . . 10.0 110.711 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 76.8 mt -123.01 -52.91 2.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 107.817 -1.179 . . . . 10.0 107.817 177.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -148.1 115.06 6.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.079 -0.964 . . . . 10.0 109.001 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . 0.716 ' HB2' ' HB3' ' B' ' 57' ' ' ASP . 23.9 m-20 -132.66 133.61 43.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.093 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 2.0 p -120.96 122.27 39.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.987 0.423 . . . . 10.0 111.796 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . 0.405 ' CE2' ' HB3' ' B' ' 38' ' ' ASP . 71.3 m-85 -122.49 155.52 36.02 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . 0.454 ' HB2' ' NE2' ' D' ' 818' ' ' GLN . 2.5 ttt180 -153.97 141.05 19.39 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.814 0.34 . . . . 10.0 111.21 -178.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -158.48 155.98 29.47 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.726 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -105.24 131.28 52.91 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.529 -0.545 . . . . 10.0 109.529 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 15.7 m -139.02 158.22 29.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.685 0.279 . . . . 10.0 111.104 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 54.6 t -92.43 100.62 11.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.047 -0.723 . . . . 10.0 109.047 178.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 39.1 mt -88.86 104.67 15.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.683 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 58.67 12.77 2.32 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.95 1.093 . . . . 10.0 113.95 178.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 132.45 -33.13 2.71 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.414 -0.898 . . . . 10.0 113.087 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -101.38 134.87 43.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.639 0.257 . . . . 10.0 110.703 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 5.6 t -81.61 140.86 34.19 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 71.3 m -147.09 158.59 43.99 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.833 0.349 . . . . 10.0 111.328 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.04 122.46 40.06 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 82.9 mt -111.87 120.98 43.78 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.541 0.571 . . . . 10.0 112.541 -178.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.88 113.19 24.79 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 107.697 -1.224 . . . . 10.0 107.697 177.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.495 HG21 HG23 ' B' ' 20' ' ' THR . 12.4 mt -101.5 127.05 55.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 120.811 0.338 . . . . 10.0 110.934 -178.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.6 tp -109.04 113.87 27.12 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.861 -0.609 . . . . 10.0 111.737 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.716 ' HB3' ' HB2' ' B' ' 38' ' ' ASP . 10.0 t70 -90.85 101.56 14.32 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.89 -0.781 . . . . 10.0 108.89 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 38.0 p -80.95 165.05 22.11 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 112.912 0.708 . . . . 10.0 112.912 -178.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.36 156.83 33.42 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.473 -0.785 . . . . 10.0 111.392 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -79.83 -55.82 3.48 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.786 -0.721 . . . . 10.0 111.969 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -120.32 127.82 52.7 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.762 -0.458 . . . . 20.0 109.762 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.565 ' OE1' ' HD2' ' B' ' 68' ' ' ARG . 27.7 tt0 -163.02 168.33 21.18 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.697 -0.483 . . . . 10.0 109.697 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . 0.537 ' HB3' ' H ' ' B' ' 64' ' ' TYR . 3.6 mm-40 -105.37 -136.96 0.36 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.586 -0.279 . . . . 10.0 110.943 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . 0.537 ' H ' ' HB3' ' B' ' 63' ' ' GLU . 48.1 t80 -103.47 90.11 3.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.1 0.476 . . . . 10.0 110.97 -179.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 3.1 m -101.4 139.39 37.13 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.702 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.11 -37.78 88.55 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.006 0.431 . . . . 10.0 111.183 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 39.4 ttp -64.76 -35.77 82.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.036 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.61 ' HA ' ' CE2' ' B' ' 71' ' ' TYR . 22.6 ttt85 -66.5 -51.53 55.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.545 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.33 -38.99 72.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.876 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 3.0 tp60 -58.53 -56.09 26.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.64 -0.709 . . . . 10.0 112.255 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . 0.61 ' CE2' ' HA ' ' B' ' 68' ' ' ARG . 1.7 p90 -67.28 -15.74 63.87 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 113.594 0.961 . . . . 10.0 113.594 -178.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . 0.559 ' HB3' HG21 ' B' ' 103' ' ' VAL . 86.2 mtp -80.16 -18.31 50.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.773 0.321 . . . . 10.0 111.197 179.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . 0.578 ' HD2' ' O2P' ' A' ' 23' ' ' PCW . 4.1 mtt-85 -75.15 -29.75 60.57 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.864 0.364 . . . . 10.0 110.715 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.59 -0.39 37.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.853 -0.612 . . . . 10.0 112.468 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -84.92 127.56 8.24 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.331 -0.937 . . . . 10.0 112.44 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -86.93 -42.28 13.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.218 0.532 . . . . 10.0 109.823 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -130.32 144.45 15.75 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 110.538 -1.025 . . . . 10.0 110.538 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -122.64 129.26 51.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.046 0.451 . . . . 10.0 111.861 -178.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.855 ' HG ' HD22 ' B' ' 159' ' ' LEU . 78.7 mt -96.88 108.82 21.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.549 -0.751 . . . . 10.0 109.886 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 19.3 m -85.47 91.08 8.12 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.027 -0.36 . . . . 10.0 110.027 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 47.4 t -89.6 121.61 39.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.542 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.639 ' HB3' HD11 ' B' ' 93' ' ' ILE . 20.1 p90 -130.51 152.1 50.26 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.661 -0.7 . . . . 10.0 109.882 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -91.67 125.97 36.59 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.976 -0.379 . . . . 10.0 109.976 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.848 HD11 ' HA ' ' B' ' 118' ' ' CYS . 43.8 pt -70.44 -8.06 10.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.2 0.524 . . . . 10.0 111.16 -179.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . 0.499 HD21 ' HB3' ' B' ' 117' ' ' LYS . 0.0 OUTLIER -101.43 5.56 42.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.104 179.572 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -132.07 106.81 8.24 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.402 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . 0.484 ' O ' ' HG3' ' B' ' 91' ' ' GLU . 0.2 OUTLIER -59.2 -39.52 82.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.906 -0.588 . . . . 10.0 112.479 -179.085 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -59.1 -36.06 74.5 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.778 0.288 . . . . 10.0 111.778 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 21.1 m -64.71 -36.53 84.59 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.001 0.429 . . . . 10.0 110.6 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -70.94 -34.43 71.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.682 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' B' ' 87' ' ' THR . 30.5 mt-10 -79.31 -25.78 42.34 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.97 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . 0.472 ' O ' ' HB3' ' B' ' 95' ' ' HIS . 0.3 OUTLIER -80.75 -2.64 47.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.495 -179.22 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . 0.639 HD11 ' HB3' ' B' ' 82' ' ' PHE . 29.5 mm -58.58 -42.36 84.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.728 0.299 . . . . 10.0 111.104 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 17.2 t60 -68.4 -26.62 65.64 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.986 0.422 . . . . 10.0 110.366 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . 0.472 ' HB3' ' O ' ' B' ' 92' ' ' ASP . 9.9 t-160 -66.08 -40.8 91.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.685 -0.689 . . . . 10.0 109.803 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -71.7 -44.27 64.48 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.408 -0.96 . . . . 10.0 108.408 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -51.84 -53.47 39.95 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.967 -1.015 . . . . 10.0 111.691 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -64.76 -37.18 86.72 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.126 0.417 . . . . 10.0 112.126 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . 0.411 ' O ' HG13 ' B' ' 103' ' ' VAL . 35.2 tt0 -61.97 -49.72 74.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.019 -0.363 . . . . 10.0 110.019 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . 0.555 ' HA ' HG22 ' B' ' 103' ' ' VAL . 42.1 mt -62.81 -42.15 95.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 10.0 111.018 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . 0.714 ' HE2' ' HG3' ' B' ' 107' ' ' GLU . 9.1 mtpm? -60.29 -32.86 71.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.545 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 49.2 ttp85 -80.69 -40.14 25.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.938 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.559 HG21 ' HB3' ' B' ' 72' ' ' MET . 18.8 m -69.16 -26.34 31.73 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 112.469 0.544 . . . . 10.0 112.469 -179.186 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -98.86 -14.09 19.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.761 0.315 . . . . 10.0 110.868 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 11.4 t70 59.47 39.48 21.8 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.146 -178.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 19.6 m -155.16 139.37 16.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.458 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . 0.714 ' HG3' ' HE2' ' B' ' 101' ' ' LYS . 7.2 mp0 -85.74 -13.07 49.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.651 0.739 . . . . 10.0 109.46 178.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -102.06 86.03 2.79 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.934 -1.03 . . . . 10.0 110.177 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 55.9 t -130.82 131.84 23.53 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.014 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -64.24 112.13 1.81 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.866 2.378 . . . . 10.0 111.824 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . 0.432 ' HB2' HG21 ' B' ' 139' ' ' ILE . 57.5 mtt -130.54 149.61 52.13 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.126 -0.488 . . . . 10.0 109.746 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.526 ' HB ' HD23 ' B' ' 79' ' ' LEU . 99.4 t -130.97 128.03 61.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.772 -0.455 . . . . 10.0 109.772 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 17.1 tp -82.91 119.56 24.57 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.557 -0.535 . . . . 10.0 109.557 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 51.2 t -117.26 117.03 53.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 120.963 0.411 . . . . 10.0 111.48 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -98.79 115.14 5.22 Favored Glycine 0 N--CA 1.45 -0.388 0 N-CA-C 110.304 -1.118 . . . . 10.0 110.304 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -103.04 164.18 11.77 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 117.204 0.502 . . . . 10.0 112.147 -178.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . 0.499 ' HB3' HD21 ' B' ' 85' ' ' ASN . 13.6 mtmt 69.44 41.68 1.26 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.108 -0.951 . . . . 10.0 113.112 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . 0.848 ' HA ' HD11 ' B' ' 84' ' ' ILE . 15.4 p -81.04 -12.49 59.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.21 0.529 . . . . 10.0 110.266 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -76.47 -12.19 60.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.388 -0.824 . . . . 10.0 110.945 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 31.6 mt -95.17 136.86 22.35 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.143 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -72.84 3.54 4.33 Favored 'Trans proline' 0 CA--C 1.53 0.295 0 C-N-CA 122.623 2.216 . . . . 10.0 112.904 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.26 32.56 0.69 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.858 0.361 . . . . 10.0 111.147 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . 0.643 ' HG3' HD12 ' B' ' 84' ' ' ILE . 24.6 ttm-85 -64.4 105.1 0.87 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.899 0.381 . . . . 10.0 111.557 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.5 m -94.12 -40.86 9.83 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.297 0.57 . . . . 10.0 109.661 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 45.7 t -86.7 122.84 39.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.566 -0.743 . . . . 10.0 109.577 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.9 150.14 42.85 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.986 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.38 -35.99 77.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.444 -179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -69.47 -33.99 73.71 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.62 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -62.43 -47.53 83.65 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.046 0.45 . . . . 10.0 110.151 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.33 94.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.741 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -63.2 -44.49 95.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.439 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -62.96 -42.22 99.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.987 0.422 . . . . 10.0 111.221 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 37.1 tp -66.2 -43.88 85.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.046 0.451 . . . . 10.0 110.276 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.22 -43.54 97.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.618 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -61.34 -35.53 77.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.683 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.0 m -67.27 -33.95 76.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.875 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -83.41 -19.84 35.25 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.231 0.539 . . . . 10.0 110.194 178.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.21 30.46 25.25 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 111.03 -0.828 . . . . 10.0 111.03 -179.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . 0.432 HG21 ' HB2' ' B' ' 111' ' ' MET . 48.7 pt -123.37 151.63 63.09 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.763 -0.218 . . . . 10.0 110.74 -179.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.36 156.96 33.07 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.384 2.056 . . . . 10.0 112.059 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -122.73 129.84 52.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.512 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 33.2 mm -125.97 125.59 68.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.142 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -87.32 124.41 33.33 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.208 -1.034 . . . . 10.0 108.208 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . 0.599 ' HA ' ' O ' ' B' ' 150' ' ' GLN . 40.2 p -126.82 172.94 9.95 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.577 0.955 . . . . 10.0 113.577 -177.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 26.5 t -159.79 125.16 4.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.245 -1.343 . . . . 10.0 107.615 178.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.47 -27.2 65.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.946 0.403 . . . . 10.0 111.828 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -73.79 -55.74 5.85 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.603 0.594 . . . . 10.0 112.603 -179.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 44.4 p -83.22 -14.81 52.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.641 -0.254 . . . . 10.0 111.591 -178.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 27.0 ttt180 68.32 22.88 7.86 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.622 0.725 . . . . 10.0 109.834 -178.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . 0.599 ' O ' ' HA ' ' B' ' 144' ' ' THR . 10.1 tt0 -62.05 111.45 1.94 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.907 -1.042 . . . . 10.0 111.833 -179.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 67.89 9.38 56.32 Favored Glycine 0 C--O 1.227 -0.303 0 N-CA-C 114.658 0.623 . . . . 10.0 114.658 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.68 -53.34 48.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 117.511 0.655 . . . . 10.0 111.17 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -62.01 -45.1 95.07 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.118 0.485 . . . . 10.0 110.373 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -63.48 -36.13 82.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.852 -0.613 . . . . 10.0 112.53 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.0 -47.85 81.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.908 0.385 . . . . 10.0 110.196 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -66.91 -42.02 86.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.686 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -62.99 -42.34 99.82 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.18 -0.463 . . . . 10.0 110.598 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.551 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 66.1 m -60.09 -41.4 92.4 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.807 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.855 HD22 ' HG ' ' B' ' 79' ' ' LEU . 41.0 tp -57.8 -43.65 85.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.495 -0.321 . . . . 10.0 110.222 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 46.4 t -64.78 -36.72 78.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.117 -0.492 . . . . 10.0 109.929 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . 0.551 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 67.3 mtt180 -63.25 -44.63 94.62 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.126 179.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' B' ' 158' ' ' THR . 17.0 mm-40 -64.39 -38.07 89.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.095 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . 0.509 ' O ' ' HG2' ' B' ' 167' ' ' LYS . 96.1 mt -65.02 -43.64 96.05 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.201 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -63.16 -40.33 97.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.534 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -65.5 -31.62 72.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.241 0.543 . . . . 10.0 109.653 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 20.8 t-80 -67.23 -35.65 80.03 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.913 178.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' B' ' 163' ' ' ILE . 55.1 mmtt -63.26 -48.93 76.09 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.789 -0.641 . . . . 10.0 109.623 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -61.37 -42.81 99.31 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.243 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -58.47 -46.39 86.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.943 -0.572 . . . . 10.0 110.474 179.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 16.8 ttm -67.01 -24.39 66.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.625 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 17.0 m -77.94 -12.76 60.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.018 0.437 . . . . 10.0 110.977 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -111.61 -40.46 4.33 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.244 -0.434 . . . . 10.0 111.619 -179.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -98.23 3.94 48.87 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.418 0.525 . . . . 10.0 112.418 -178.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . -109.47 31.38 7.65 Favored Glycine 0 N--CA 1.453 -0.183 0 N-CA-C 111.037 -0.825 . . . . 10.0 111.037 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . 0.864 ' HE2' HN1A ' A' ' 40' ' ' 17F . 19.9 tptt -155.03 131.56 10.52 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 -179.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . 0.409 ' O ' ' HE3' ' B' ' 175' ' ' LYS . 26.8 mmtp -82.93 119.87 24.97 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.995 -0.743 . . . . 10.0 108.995 179.031 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 16.0 ttmm 75.29 95.15 0.07 Allowed 'General case' 0 C--O 1.234 0.268 0 O-C-N 123.934 0.771 . . . . 10.0 111.301 -178.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . 0.607 ' NZ ' ' HN1' ' A' ' 40' ' ' 17F . 10.0 mmtt -116.97 144.92 44.01 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.657 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . 0.874 ' NZ ' ' HN1' ' A' ' 36' ' ' 17F . 0.1 OUTLIER -82.55 -14.94 54.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.806 179.82 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt 72.37 -60.59 0.52 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.76 -0.654 . . . . 10.0 111.693 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 11.6 m -80.49 164.77 22.75 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.505 -0.316 . . . . 10.0 110.252 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -100.19 -53.54 3.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.717 0.294 . . . . 10.0 111.597 -179.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.74 148.73 31.69 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.056 0.455 . . . . 10.0 111.704 -179.055 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 10.8 ptmm? -82.59 170.84 14.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.538 179.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 60.2 m . . . . . 0 C--N 1.32 -0.693 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.721 179.345 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' 808' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 N-CA-C 111.946 -0.462 . . . . 10.0 111.946 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' 809' ' ' THR . . . . . . . . . . . . . 1.6 p -126.15 130.11 50.38 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.618 0.247 . . . . 10.0 110.944 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 810' ' ' VAL . . . . . . . . . . . . . 45.7 t -117.81 128.7 74.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.154 -0.476 . . . . 10.0 109.804 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 811' ' ' LYS . . . . . . . . . . . . . 13.3 pttp -93.34 119.35 32.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.163 0.506 . . . . 10.0 111.395 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 812' ' ' VAL . . . . . 0.572 HG11 HD11 ' D' ' 834' ' ' LEU . 35.0 t -96.62 129.11 47.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.868 -0.605 . . . . 10.0 109.465 179.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 813' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -90.71 139.25 30.9 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.062 0.458 . . . . 10.0 111.194 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 814' ' ' LEU . . . . . 0.463 HD13 ' HG3' ' D' ' 841' ' ' ARG . 68.4 mt -112.4 154.94 44.37 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.507 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 815' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.91 55.13 1.71 Allowed 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.038 2.492 . . . . 10.0 112.649 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 816' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -151.3 19.65 0.75 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.164 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 817' ' ' LYS . . . . . 0.427 ' O ' ' H41' ' A' ' 25' ' ' PCW . 67.0 mttm 62.12 31.97 17.59 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.715 -0.675 . . . . 10.0 111.22 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 818' ' ' GLN . . . . . 0.454 ' NE2' ' HB2' ' B' ' 41' ' ' ARG . 95.2 mt-30 -141.91 173.47 11.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.254 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 819' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.48 171.02 18.73 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.793 0.33 . . . . 10.0 111.708 -179.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 820' ' ' THR . . . . . . . . . . . . . 9.7 t -138.12 141.49 40.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.725 -0.671 . . . . 10.0 109.357 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 821' ' ' VAL . . . . . . . . . . . . . 47.2 t -92.33 110.84 23.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.973 0.416 . . . . 10.0 111.333 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 822' ' ' VAL . . . . . . . . . . . . . 17.3 t -102.07 141.5 18.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.247 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 823' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.99 135.77 35.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.46 -0.337 . . . . 10.0 110.095 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 824' ' ' VAL . . . . . 0.701 HG11 ' HB2' ' D' ' 871' ' ' ASP . 57.3 t -75.14 116.3 17.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 110.231 -0.285 . . . . 10.0 110.231 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 825' ' ' ARG . . . . . . . . . . . . . 23.6 mtp180 -129.26 109.5 11.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.995 0.426 . . . . 10.0 111.196 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 826' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -70.21 114.54 8.46 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.477 0.656 . . . . 10.0 110.186 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 827' ' ' GLY . . . . . . . . . . . . . . . 147.71 -34.75 1.23 Allowed Glycine 0 N--CA 1.446 -0.65 0 N-CA-C 110.118 -1.193 . . . . 10.0 110.118 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 828' ' ' MET . . . . . 0.433 ' HB2' ' HB2' ' D' ' 832' ' ' ASP . 10.7 ptm -98.0 150.29 21.53 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.447 -0.377 . . . . 10.0 110.132 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 829' ' ' SER . . . . . 0.67 ' HA ' ' HA ' ' D' ' 866' ' ' ALA . 0.3 OUTLIER -94.36 176.73 6.19 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.301 -179.065 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D ' 830' ' ' VAL . . . . . . . . . . . . . 92.3 t -59.05 -37.29 67.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 831' ' ' TYR . . . . . 0.498 ' HA ' ' HE3' ' D' ' 863' ' ' TRP . 52.9 t80 -58.09 -49.7 76.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.497 -0.774 . . . . 10.0 110.912 179.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 832' ' ' ASP . . . . . 0.433 ' HB2' ' HB2' ' D' ' 828' ' ' MET . 3.3 m-20 -68.42 -38.36 81.15 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.08 -0.509 . . . . 10.0 112.05 -179.064 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 833' ' ' SER . . . . . . . . . . . . . 5.4 m -73.02 -43.45 62.06 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.814 0.672 . . . . 10.0 112.814 -178.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 834' ' ' LEU . . . . . 0.572 HD11 HG11 ' D' ' 812' ' ' VAL . 0.6 OUTLIER -79.22 -15.02 58.67 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.454 0.539 . . . . 10.0 112.454 -178.896 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D ' 835' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -56.3 -52.44 64.52 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.056 0.391 . . . . 10.0 112.056 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 836' ' ' LYS . . . . . . . . . . . . . 5.2 mmmm -59.55 -36.39 76.07 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.062 0.393 . . . . 10.0 112.062 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 837' ' ' ALA . . . . . . . . . . . . . . . -71.34 -38.3 71.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.915 0.388 . . . . 10.0 111.294 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 838' ' ' LEU . . . . . 0.421 HD21 HG11 ' D' ' 877' ' ' VAL . 90.4 mt -75.03 -45.22 43.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.275 -0.42 . . . . 10.0 111.184 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 839' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -58.91 -37.97 77.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.019 -0.537 . . . . 10.0 112.224 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 840' ' ' VAL . . . . . . . . . . . . . 3.2 p -71.12 -12.75 16.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 121.073 0.463 . . . . 10.0 111.407 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 841' ' ' ARG . . . . . 0.463 ' HG3' HD13 ' D' ' 814' ' ' LEU . 11.8 mmt180 -110.65 -2.0 16.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.838 0.351 . . . . 10.0 111.061 179.696 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 842' ' ' GLY . . . . . . . . . . . . . . . 77.65 24.4 65.13 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.999 -0.62 . . . . 10.0 112.443 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 843' ' ' LEU . . . . . 0.478 ' HB3' ' SG ' ' D' ' 848' ' ' CYS . 93.3 mt -106.52 143.93 33.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.545 0.212 . . . . 10.0 110.481 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 844' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -109.32 159.34 17.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.259 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 845' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -78.15 62.57 2.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.791 0.329 . . . . 10.0 110.995 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 846' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -134.32 -67.16 0.59 Allowed 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.123 -0.489 . . . . 10.0 112.046 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 847' ' ' CYS . . . . . . . . . . . . . 1.7 p -87.78 -17.05 32.47 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.229 0.537 . . . . 10.0 110.707 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 848' ' ' CYS . . . . . 0.478 ' SG ' ' HB3' ' D' ' 843' ' ' LEU . 4.6 m -83.43 128.59 34.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.982 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 849' ' ' VAL . . . . . . . . . . . . . 5.0 p -121.35 137.94 53.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.3 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 850' ' ' VAL . . . . . 0.438 HG22 HG22 ' D' ' 877' ' ' VAL . 20.7 t -98.62 127.31 51.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.779 -179.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 851' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -108.04 135.92 48.59 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.19 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 852' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' D' ' 858' ' ' LYS . 71.6 mtp180 -87.2 169.88 11.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.002 -0.544 . . . . 10.0 109.564 178.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 853' ' ' LEU . . . . . 0.856 ' HG ' ' H71' ' A' ' 31' ' ' PCW . 0.6 OUTLIER -121.42 78.65 1.45 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.461 0.648 . . . . 10.0 111.049 -179.697 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D ' 854' ' ' ILE . . . . . . . . . . . . . 65.8 mt -91.66 94.24 4.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.227 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 855' ' ' LYS . . . . . 0.496 ' HA ' ' HD3' ' D' ' 855' ' ' LYS . 31.5 mmtt 58.58 28.39 17.02 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.51 -0.768 . . . . 10.0 112.157 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 856' ' ' GLY . . . . . . . . . . . . . . . 102.25 -19.85 47.13 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 121.042 -0.599 . . . . 10.0 112.13 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 857' ' ' ARG . . . . . 0.445 ' HE ' ' C19' ' A' ' 31' ' ' PCW . 0.0 OUTLIER -83.48 111.61 19.21 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.925 0.393 . . . . 10.0 111.3 -179.648 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D ' 858' ' ' LYS . . . . . 0.652 ' HE2' HD13 ' D' ' 876' ' ' ILE . 86.6 mttt -69.95 112.9 6.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.892 178.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 859' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -110.35 134.49 52.24 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.792 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 860' ' ' VAL . . . . . . . . . . . . . 46.1 t -68.81 123.68 22.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.661 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 861' ' ' THR . . . . . 0.463 ' HB ' ' HG3' ' D' ' 852' ' ' ARG . 1.8 t -105.22 172.8 6.6 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.184 -0.302 . . . . 10.0 110.184 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 862' ' ' ALA . . . . . . . . . . . . . . . -114.34 163.59 15.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.985 0.421 . . . . 10.0 110.817 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 863' ' ' TRP . . . . . 0.498 ' HE3' ' HA ' ' D' ' 831' ' ' TYR . 78.7 m95 -82.6 -21.44 35.17 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.539 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 864' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.91 -16.58 58.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.668 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 865' ' ' THR . . . . . . . . . . . . . 2.9 m -69.49 138.81 53.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.647 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 866' ' ' ALA . . . . . 0.67 ' HA ' ' HA ' ' D' ' 829' ' ' SER . . . -76.43 151.55 36.48 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.671 -0.492 . . . . 10.0 109.671 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 867' ' ' ILE . . . . . 0.464 ' HA ' HD23 ' D' ' 870' ' ' LEU . 7.3 tp -82.93 0.59 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 121.104 0.478 . . . . 10.0 112.155 -179.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 868' ' ' ALA . . . . . . . . . . . . . . . -61.29 -56.05 37.67 Favored Pre-proline 0 CA--C 1.543 0.707 0 N-CA-C 113.67 0.989 . . . . 10.0 113.67 -179.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 869' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.44 3.77 5.03 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 121.984 1.789 . . . . 10.0 113.001 -179.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 870' ' ' LEU . . . . . 0.464 HD23 ' HA ' ' D' ' 867' ' ' ILE . 2.9 mm? -85.76 -11.99 52.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.007 0.432 . . . . 10.0 111.402 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 871' ' ' ASP . . . . . 0.701 ' HB2' HG11 ' D' ' 824' ' ' VAL . 2.9 t70 -64.09 114.97 4.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.362 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 872' ' ' GLY . . . . . . . . . . . . . . . 133.77 -30.18 3.01 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.76 -0.733 . . . . 10.0 112.508 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 873' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -119.78 -167.62 1.46 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.59 0.233 . . . . 10.0 110.937 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 874' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -131.7 153.71 49.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.114 -0.493 . . . . 10.0 110.286 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 875' ' ' LEU . . . . . . . . . . . . . 70.6 mt -114.51 144.82 42.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.716 0.294 . . . . 10.0 111.622 -178.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 876' ' ' ILE . . . . . 0.652 HD13 ' HE2' ' D' ' 858' ' ' LYS . 3.2 mp -123.7 123.7 67.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 877' ' ' VAL . . . . . 0.438 HG22 HG22 ' D' ' 850' ' ' VAL . 17.3 t -103.44 135.77 39.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 120.649 0.261 . . . . 10.0 111.009 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 878' ' ' GLU . . . . . 0.496 ' OE2' ' H81' ' A' ' 24' ' ' PCW . 0.0 OUTLIER -138.79 164.89 28.43 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.023 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D ' 879' ' ' VAL . . . . . 0.794 ' HB ' ' H62' ' A' ' 20' ' ' PCW . 45.0 t -106.21 127.06 61.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 120.67 0.271 . . . . 10.0 110.57 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 880' ' ' LEU . . . . . . . . . . . . . 94.7 mt . . . . . 0 C--O 1.252 1.207 0 CA-C-O 118.392 -0.813 . . . . 10.0 111.088 -179.998 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PCW . . . . . 0.796 H181 ' H18' ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PCW . . . . . 0.434 H481 H441 ' A' ' 56' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PCW . . . . . 0.674 H362 H321 ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PCW . . . . . 0.532 ' O2P' ' H82' ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PCW . . . . . 0.7 H382 ' H18' ' A' ' 38' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PCW . . . . . 0.922 H122 H352 ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PCW . . . . . 0.467 H261 H442 ' A' ' 4' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PCW . . . . . 0.676 H321 H331 ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PCW . . . . . 0.703 H332 H341 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PCW . . . . . 0.705 ' H61' ' H2 ' ' A' ' 36' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PCW . . . . . 0.623 H281 H451 ' A' ' 25' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PCW . . . . . 0.793 H152 H352 ' A' ' 22' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PCW . . . . . 0.524 H182 H331 ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PCW . . . . . 0.833 H451 H19A ' A' ' 34' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PCW . . . . . 0.898 H321 ' H19' ' A' ' 16' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PCW . . . . . 0.922 H352 H122 ' A' ' 6' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PCW . . . . . 0.556 ' H81' H352 ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PCW . . . . . 0.674 H321 H362 ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PCW . . . . . 0.559 H132 H141 ' A' ' 3' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PCW . . . . . 0.794 ' H62' ' HB ' ' D' ' 879' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PCW . . . . . 0.545 H472 H221 ' A' ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PCW . . . . . 0.793 H352 H152 ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PCW . . . . . 0.578 ' O2P' ' HD2' ' B' ' 73' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PCW . . . . . 0.754 H331 ' H32' ' A' ' 20' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PCW . . . . . 0.716 H131 ' H42' ' A' ' 24' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PCW . . . . . 0.644 H471 H152 ' A' ' 26' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PCW . . . . . 0.58 ' H41' ' O2 ' ' A' ' 37' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PCW . . . . . 0.644 H242 H481 ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PCW . . . . . 0.455 H252 ' H20' ' A' ' 31' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PCW . . . . . 0.632 H181 H362 ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PCW . . . . . 0.856 ' H71' ' HG ' ' D' ' 853' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PCW . . . . . 0.658 H331 ' H11' ' A' ' 35' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' 17F . . . . . 0.548 ' H33' H151 ' A' ' 32' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' 17F . . . . . 0.833 H19A H451 ' A' ' 14' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' 17F . . . . . 0.796 ' H18' H181 ' A' ' 1' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' 17F . . . . . 0.874 ' HN1' ' NZ ' ' B' ' 179' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' 17F . . . . . 0.686 HN1A ' H61' ' A' ' 12' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' 17F . . . . . 0.7 ' H18' H382 ' A' ' 5' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' 17F . . . . . 0.463 ' H46' H222 ' A' ' 28' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' 17F . . . . . 0.864 HN1A ' HE2' ' B' ' 175' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PCW . . . . . 0.578 ' H71' ' O1P' ' A' ' 59' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PCW . . . . . 0.746 ' H40' H482 ' A' ' 52' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PCW . . . . . 0.586 H211 H431 ' A' ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PCW . . . . . 0.64 H262 ' H19' ' A' ' 55' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PCW . . . . . 0.64 H141 ' HN1' ' A' ' 74' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PCW . . . . . 0.785 H182 H252 ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PCW . . . . . 0.642 ' H31' ' H4A' ' A' ' 73' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PCW . . . . . 0.607 ' H82' H411 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PCW . . . . . 0.606 H442 H261 ' A' ' 18' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PCW . . . . . 0.759 ' H31' ' H4 ' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PCW . . . . . 0.731 H361 H341 ' A' ' 70' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PCW . . . . . 0.746 H482 ' H40' ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PCW . . . . . 0.623 H152 H171 ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PCW . . . . . 0.832 H352 ' H11' ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PCW . . . . . 0.64 ' H19' H262 ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PCW . . . . . 0.434 H441 H481 ' A' ' 2' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PCW . . . . . 0.525 ' H61' ' H39' ' A' ' 45' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PCW . . . . . 0.456 H352 H171 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PCW . . . . . 0.579 H472 H231 ' A' ' 61' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' PCW . . . . . 0.665 H461 H432 ' A' ' 63' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PCW . . . . . 0.607 H411 ' H82' ' A' ' 48' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PCW . . . . . 0.573 H171 H161 ' A' ' 72' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PCW . . . . . 0.665 H432 H461 ' A' ' 60' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PCW . . . . . 0.657 H352 H162 ' A' ' 64' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PCW . . . . . 0.566 H181 ' H56' ' A' ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PCW . . . . . 0.738 H452 ' H59' ' A' ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PCW . . . . . 0.888 ' H81' ' H37' ' A' ' 78' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PCW . . . . . 0.603 H462 ' H40' ' A' ' 53' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PCW . . . . . 0.614 H132 H332 ' A' ' 42' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PCW . . . . . 0.731 H341 H361 ' A' ' 51' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PCW . . . . . 0.645 H212 H361 ' A' ' 46' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PCW . . . . . 0.832 ' H11' H352 ' A' ' 54' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' 17F . . . . . 0.642 ' H4A' ' H31' ' A' ' 47' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' 17F . . . . . 0.669 ' H12' ' H44' ' A' ' 79' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' 17F . . . . . 0.808 ' H60' H141 ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' 17F . . . . . 0.507 ' H42' ' H10' ' A' ' 80' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' 17F . . . . . 0.618 HN1A ' H32' ' A' ' 44' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' 17F . . . . . 0.888 ' H37' ' H81' ' A' ' 67' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' 17F . . . . . 0.738 ' H59' H452 ' A' ' 66' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' 17F . . . . . 0.566 ' H56' H181 ' A' ' 65' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 201' ' ' GNP . . . . . 0.541 H5'2 ' HA ' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 202' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_